smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC[C@](C)(O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000230661725 521294855 /nfs/dbraw/zinc/29/48/55/521294855.db2.gz YWKWTHJWNYTXFX-WFASDCNBSA-N 0 3 251.370 2.902 20 10 CFCDHN CC(C)(C)OC(=O)NC(C)(C)C[NH2+]Cc1ccccc1[O-] ZINC000227602486 518821239 /nfs/dbraw/zinc/82/12/39/518821239.db2.gz BOLZSZQDIDJMKC-UHFFFAOYSA-N 0 3 294.395 2.785 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000188002902 520149466 /nfs/dbraw/zinc/14/94/66/520149466.db2.gz OKRLFRWLWUJPIK-ZDUSSCGKSA-N 0 3 255.333 2.682 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC[C@@H](C)OC)c([O-])c1 ZINC000263810405 520365623 /nfs/dbraw/zinc/36/56/23/520365623.db2.gz MQXXTOFYPDZPRI-GFCCVEGCSA-N 0 3 267.369 2.696 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)[C@@H](CC)N(C)C ZINC000298489221 520547357 /nfs/dbraw/zinc/54/73/57/520547357.db2.gz FYLRKSKTGJLMDQ-OAHLLOKOSA-N 0 3 292.423 2.861 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280457836 521145095 /nfs/dbraw/zinc/14/50/95/521145095.db2.gz LZJSYYRZPFUSIC-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280457836 521145103 /nfs/dbraw/zinc/14/51/03/521145103.db2.gz LZJSYYRZPFUSIC-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCC(OCC)OCC)c1 ZINC000276213068 521151386 /nfs/dbraw/zinc/15/13/86/521151386.db2.gz LNMPBLIJXBJOGL-UHFFFAOYSA-N 0 3 297.395 2.670 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(O)CCCCCC2)c1 ZINC000265361045 521151920 /nfs/dbraw/zinc/15/19/20/521151920.db2.gz AZZIVAYSDDWKKM-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000290225328 521320338 /nfs/dbraw/zinc/32/03/38/521320338.db2.gz SGDNFAZBIPGPSZ-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000290225328 521320334 /nfs/dbraw/zinc/32/03/34/521320334.db2.gz SGDNFAZBIPGPSZ-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC000279655591 521335999 /nfs/dbraw/zinc/33/59/99/521335999.db2.gz LDORBFFWOAVXEA-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC000279655591 521336003 /nfs/dbraw/zinc/33/60/03/521336003.db2.gz LDORBFFWOAVXEA-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[NH2+]CCC2(OC)CCC2)c1[O-] ZINC000292907379 521362335 /nfs/dbraw/zinc/36/23/35/521362335.db2.gz HCCIILPSERWHLW-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](O)CC(C)(C)C)c1[O-] ZINC000227374836 521365875 /nfs/dbraw/zinc/36/58/75/521365875.db2.gz UCSDTPIJUNLFDP-ZDUSSCGKSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](O)c2ccc(C)o2)c1[O-] ZINC000265992964 521365958 /nfs/dbraw/zinc/36/59/58/521365958.db2.gz NXDVZCKAYVFZEV-ZDUSSCGKSA-N 0 3 291.347 2.516 20 10 CFCDHN CCOC1(C[NH2+]Cc2cccc(OC)c2[O-])CCCC1 ZINC000292884776 521637244 /nfs/dbraw/zinc/63/72/44/521637244.db2.gz FFVJWOPNKCSAKW-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CCCN(Cc1cn2cccnc2n1)Cc1ccccc1O ZINC000170779273 521692115 /nfs/dbraw/zinc/69/21/15/521692115.db2.gz WJPYYYVWHWSBDR-UHFFFAOYSA-N 0 3 296.374 2.847 20 10 CFCDHN COc1cc(CN[C@@H](C)c2cc(C)ccc2O)ccn1 ZINC000062058001 522473258 /nfs/dbraw/zinc/47/32/58/522473258.db2.gz UQGQIDWTWJMLDL-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])ccn1 ZINC000062058001 522473264 /nfs/dbraw/zinc/47/32/64/522473264.db2.gz UQGQIDWTWJMLDL-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COC(C)(C)C[C@H](C)[NH2+]Cc1cc(C)ccc1[O-] ZINC000174557237 522513896 /nfs/dbraw/zinc/51/38/96/522513896.db2.gz MBMOTWPSMULPIG-LBPRGKRZSA-N 0 3 251.370 2.994 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)C[C@H](C)OC)c1[O-] ZINC000289715946 522536616 /nfs/dbraw/zinc/53/66/16/522536616.db2.gz PCBFQVFLFRVIOX-VIFPVBQESA-N 0 3 273.760 2.521 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)C[C@H](C)OC)c1[O-] ZINC000289715946 522536626 /nfs/dbraw/zinc/53/66/26/522536626.db2.gz PCBFQVFLFRVIOX-VIFPVBQESA-N 0 3 273.760 2.521 20 10 CFCDHN CC[C@H]([NH2+]C[C@](C)(O)CCOC)c1ccc(C)cc1[O-] ZINC000279926021 522639315 /nfs/dbraw/zinc/63/93/15/522639315.db2.gz AKJKULZIEQILCM-GOEBONIOSA-N 0 3 281.396 2.529 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000280069848 522708062 /nfs/dbraw/zinc/70/80/62/522708062.db2.gz KYWCSVVZEUCGOV-YQQAZPJKSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC(=O)N(C(C)C)C1)c1ccc(C)cc1[O-] ZINC000280038484 522708142 /nfs/dbraw/zinc/70/81/42/522708142.db2.gz IRIOTJCIACMDFP-HIFRSBDPSA-N 0 3 290.407 2.751 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@@H](CO)SC)c1ccc(C)cc1[O-] ZINC000280205989 522735735 /nfs/dbraw/zinc/73/57/35/522735735.db2.gz TVYNXYUDDBYSMP-OSAQELSMSA-N 0 3 283.437 2.854 20 10 CFCDHN CC[C@@H]([NH2+]CCn1ccnc1C)c1ccccc1[O-] ZINC000271733417 522845528 /nfs/dbraw/zinc/84/55/28/522845528.db2.gz SXKMXKMIUIEJIY-CQSZACIVSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000293272204 522848659 /nfs/dbraw/zinc/84/86/59/522848659.db2.gz CIWDGTPCUYYRDA-UKRRQHHQSA-N 0 3 264.413 2.939 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)C(C)C)c1ccc(C)cc1[O-] ZINC000280063980 522851007 /nfs/dbraw/zinc/85/10/07/522851007.db2.gz KOAZPWNDLZIRFZ-UKRRQHHQSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CCCO)c1ccc(C)cc1[O-] ZINC000279988745 522933696 /nfs/dbraw/zinc/93/36/96/522933696.db2.gz FEOZFQCWNWQETH-TZMCWYRMSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1[O-])C(C)(C)O ZINC000295060000 522934978 /nfs/dbraw/zinc/93/49/78/522934978.db2.gz RBDNFTWGMDCJDP-QMTHXVAHSA-N 0 3 267.369 2.601 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@](=O)CC[C@@H]1C ZINC000377698942 522952489 /nfs/dbraw/zinc/95/24/89/522952489.db2.gz NBVMQYDREUNYON-BBEJJTJUSA-N 0 3 281.421 2.686 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1c(F)cccc1F ZINC000264680049 523384578 /nfs/dbraw/zinc/38/45/78/523384578.db2.gz CLAKZINQDZAUDE-HNNXBMFYSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1c(F)cccc1F ZINC000264680049 523384588 /nfs/dbraw/zinc/38/45/88/523384588.db2.gz CLAKZINQDZAUDE-HNNXBMFYSA-N 0 3 293.313 2.836 20 10 CFCDHN Cc1cccc(CN2CCOCC23CCCC3)c1O ZINC000271811582 524404698 /nfs/dbraw/zinc/40/46/98/524404698.db2.gz MCQDOTKEVOQFDM-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2CC(F)(F)C2)c1 ZINC000292696172 524748648 /nfs/dbraw/zinc/74/86/48/524748648.db2.gz BWCUIYMZYXWDEG-UHFFFAOYSA-N 0 3 257.280 2.536 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H]2CCCCN2C2CC2)c1 ZINC000278335655 524753788 /nfs/dbraw/zinc/75/37/88/524753788.db2.gz HFRUBJBDTXLPJH-OAHLLOKOSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)c1 ZINC000085976870 524770854 /nfs/dbraw/zinc/77/08/54/524770854.db2.gz MQVRLCKZQXJFEJ-ZOWXZIJZSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](C)c2cnn(C)c2)c1 ZINC000273618424 524771043 /nfs/dbraw/zinc/77/10/43/524771043.db2.gz YIFSMDFRIGOOJB-QWRGUYRKSA-N 0 3 275.352 2.546 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCOC[C@@H]2C)c1[O-] ZINC000277662620 524874707 /nfs/dbraw/zinc/87/47/07/524874707.db2.gz ZXPXDCWZNHGYTO-GWCFXTLKSA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1ccc(NC(=O)Cc2ccc(N)cc2)c(CN(C)C)c1 ZINC000237037007 525096359 /nfs/dbraw/zinc/09/63/59/525096359.db2.gz CTEWLUCNJHBBPX-UHFFFAOYSA-N 0 3 297.402 2.820 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H]2CCN(C)C[C@@H]2C)cc1C ZINC000290553843 525316553 /nfs/dbraw/zinc/31/65/53/525316553.db2.gz RYWONLUKQNHJLY-HOCLYGCPSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H]2CCN(C)C[C@@H]2C)cc1C ZINC000290553843 525316559 /nfs/dbraw/zinc/31/65/59/525316559.db2.gz RYWONLUKQNHJLY-HOCLYGCPSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000245775510 525346192 /nfs/dbraw/zinc/34/61/92/525346192.db2.gz SOVOQRYYXJVOPY-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000245775510 525346205 /nfs/dbraw/zinc/34/62/05/525346205.db2.gz SOVOQRYYXJVOPY-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](O)CC(C)(C)C)c1 ZINC000227374528 525349114 /nfs/dbraw/zinc/34/91/14/525349114.db2.gz UYAYYJHIEFKGIN-ZDUSSCGKSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c1 ZINC000273460452 525364888 /nfs/dbraw/zinc/36/48/88/525364888.db2.gz IASSKXRXXZJUIK-CABZTGNLSA-N 0 3 277.286 2.665 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@@H]2C2CC2)c1 ZINC000230669812 525365771 /nfs/dbraw/zinc/36/57/71/525365771.db2.gz RARCGTAWHDJNFE-SGIREYDYSA-N 0 3 261.365 2.919 20 10 CFCDHN C[C@H]([NH2+]CCc1cn[nH]c1)c1cc2c(cc1[O-])CCCC2 ZINC000289890683 525372907 /nfs/dbraw/zinc/37/29/07/525372907.db2.gz SQGSBGUOGLTZRU-LBPRGKRZSA-N 0 3 285.391 2.887 20 10 CFCDHN C[C@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)C1CCCC1 ZINC000070305611 525433667 /nfs/dbraw/zinc/43/36/67/525433667.db2.gz ISKOQSVGLKELGU-JTQLQIEISA-N 0 3 263.337 2.789 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCCCC1)c1cc(F)ccc1[O-] ZINC000094617928 525447809 /nfs/dbraw/zinc/44/78/09/525447809.db2.gz SBVXXTWZCFORSZ-GFCCVEGCSA-N 0 3 266.360 2.668 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1ccccc1[O-] ZINC000217689439 525569600 /nfs/dbraw/zinc/56/96/00/525569600.db2.gz BPYFCLXCAUKXSE-CFVMTHIKSA-N 0 3 260.381 2.670 20 10 CFCDHN C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1O)c1ccccc1[O-] ZINC000248385666 525593965 /nfs/dbraw/zinc/59/39/65/525593965.db2.gz JMGXMHLSBCWUOK-YMRXKLBXSA-N 0 3 269.344 2.701 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCO)c1cc2c(cc1[O-])CCCC2 ZINC000185500384 525597485 /nfs/dbraw/zinc/59/74/85/525597485.db2.gz RAWMOKCKSOXMCS-NWDGAFQWSA-N 0 3 263.381 2.693 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCN(c2ncccn2)C1)c1ccccc1[O-] ZINC000192815454 525636665 /nfs/dbraw/zinc/63/66/65/525636665.db2.gz YSYXNZDGMWGVJK-ZIAGYGMSSA-N 0 3 298.390 2.502 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cc(F)ccc1[O-] ZINC000094617422 525638910 /nfs/dbraw/zinc/63/89/10/525638910.db2.gz QGRPQTYOCRZIAZ-QMTHXVAHSA-N 0 3 289.354 2.993 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)CC1CCC1)c1cc(F)ccc1[O-] ZINC000279894022 525667857 /nfs/dbraw/zinc/66/78/57/525667857.db2.gz ADNHEENOQVJGCU-MFKMUULPSA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000063218348 525668340 /nfs/dbraw/zinc/66/83/40/525668340.db2.gz WKBDAXLPXPZJCP-HIFRSBDPSA-N 0 3 271.360 2.646 20 10 CFCDHN CSC[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000292865419 525707577 /nfs/dbraw/zinc/70/75/77/525707577.db2.gz VUEKJNOFQHYRFN-LBPRGKRZSA-N 0 3 251.395 2.967 20 10 CFCDHN CSC[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000292865419 525707586 /nfs/dbraw/zinc/70/75/86/525707586.db2.gz VUEKJNOFQHYRFN-LBPRGKRZSA-N 0 3 251.395 2.967 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CCN(C)C)c([O-])c1 ZINC000049553637 525744414 /nfs/dbraw/zinc/74/44/14/525744414.db2.gz DIVKWVHBQWDJEY-CHWSQXEVSA-N 0 3 250.386 2.691 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@@H](C)CO)c([O-])c1 ZINC000230669771 525919938 /nfs/dbraw/zinc/91/99/38/525919938.db2.gz MJYXNSFTGGOCRW-OLZOCXBDSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCCCO)c([O-])c1C ZINC000279825230 525920225 /nfs/dbraw/zinc/92/02/25/525920225.db2.gz BUXTZLBRQZPABT-ZDUSSCGKSA-N 0 3 251.370 2.822 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CCO)C(C)C)c([O-])c1 ZINC000230664233 525936760 /nfs/dbraw/zinc/93/67/60/525936760.db2.gz AZDFKRBEYQFPPH-JSGCOSHPSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1cccc(CN2CCS[C@@H](C)[C@@H]2C)c1O ZINC000093501199 525951588 /nfs/dbraw/zinc/95/15/88/525951588.db2.gz HWVPPRDKPLQABP-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c1[O-] ZINC000093501199 525951595 /nfs/dbraw/zinc/95/15/95/525951595.db2.gz HWVPPRDKPLQABP-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)c1[O-] ZINC000093501199 525951607 /nfs/dbraw/zinc/95/16/07/525951607.db2.gz HWVPPRDKPLQABP-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cc(C)ccn2)c1O ZINC000289565925 526030720 /nfs/dbraw/zinc/03/07/20/526030720.db2.gz ZFZXYINKAYGAHD-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@H+](Cc3cccc(C)c3[O-])C2)c1 ZINC000290960403 526267267 /nfs/dbraw/zinc/26/72/67/526267267.db2.gz RKZMKAWMWSHPDK-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@@H+](Cc3cccc(C)c3[O-])C2)c1 ZINC000290960403 526267270 /nfs/dbraw/zinc/26/72/70/526267270.db2.gz RKZMKAWMWSHPDK-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN Oc1cc2c(cc1CN[C@H]1CCCc3occc31)OCO2 ZINC000042879597 526336867 /nfs/dbraw/zinc/33/68/67/526336867.db2.gz OSLJLOVUQRPUQH-LBPRGKRZSA-N 0 3 287.315 2.881 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000361065485 526348853 /nfs/dbraw/zinc/34/88/53/526348853.db2.gz GQIUSLTZCQELNJ-UHFFFAOYSA-N 0 3 275.327 2.634 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000278357563 526372000 /nfs/dbraw/zinc/37/20/00/526372000.db2.gz JHZUJZWSIOKRND-AAEUAGOBSA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000278357563 526372007 /nfs/dbraw/zinc/37/20/07/526372007.db2.gz JHZUJZWSIOKRND-AAEUAGOBSA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000360669245 526372921 /nfs/dbraw/zinc/37/29/21/526372921.db2.gz CCXDOMPJELDDHS-KRWDZBQOSA-N 0 3 287.334 2.625 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000360669245 526372924 /nfs/dbraw/zinc/37/29/24/526372924.db2.gz CCXDOMPJELDDHS-KRWDZBQOSA-N 0 3 287.334 2.625 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1COc2ccccc21 ZINC000228414809 526374164 /nfs/dbraw/zinc/37/41/64/526374164.db2.gz XGJCYPPCDDVPHP-CYBMUJFWSA-N 0 3 255.317 2.658 20 10 CFCDHN [O-]c1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCO ZINC000293219777 527554565 /nfs/dbraw/zinc/55/45/65/527554565.db2.gz AIBFXKWRQWBTOD-MRXNPFEDSA-N 0 3 271.360 2.648 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291335924 527629054 /nfs/dbraw/zinc/62/90/54/527629054.db2.gz VFDQVGFCYBLOCL-SFHVURJKSA-N 0 3 283.371 2.528 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291335924 527629060 /nfs/dbraw/zinc/62/90/60/527629060.db2.gz VFDQVGFCYBLOCL-SFHVURJKSA-N 0 3 283.371 2.528 20 10 CFCDHN O[C@@H](CNCc1ccc2c(c1)CCO2)c1ccsc1 ZINC000219099531 527653273 /nfs/dbraw/zinc/65/32/73/527653273.db2.gz FMEVGRNWAXDAAZ-AWEZNQCLSA-N 0 3 275.373 2.506 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2(C)OCCCO2)c2c1c(F)ccc2[O-] ZINC000754123929 574075616 /nfs/dbraw/zinc/07/56/16/574075616.db2.gz RHXLAPSBQOJPNF-ZYHUDNBSSA-N 0 3 295.354 2.822 20 10 CFCDHN CC(C)OC1CCN(Cc2cc3c(cc2O)OCO3)CC1 ZINC000730563671 574087864 /nfs/dbraw/zinc/08/78/64/574087864.db2.gz AUNJLUQJHLAKGW-UHFFFAOYSA-N 0 3 293.363 2.510 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2N(C)C)c([O-])c1 ZINC000754349864 574090096 /nfs/dbraw/zinc/09/00/96/574090096.db2.gz PIVNYTIXKIEDFK-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870859 574131341 /nfs/dbraw/zinc/13/13/41/574131341.db2.gz ZZXXNRAYGAWHNN-TUAOUCFPSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870859 574131342 /nfs/dbraw/zinc/13/13/42/574131342.db2.gz ZZXXNRAYGAWHNN-TUAOUCFPSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)C1=CC(=O)CS1 ZINC000731870859 574131344 /nfs/dbraw/zinc/13/13/44/574131344.db2.gz ZZXXNRAYGAWHNN-TUAOUCFPSA-N 0 3 296.436 2.550 20 10 CFCDHN CC[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H](C)O1 ZINC000732185175 574145419 /nfs/dbraw/zinc/14/54/19/574145419.db2.gz LSAPXOGHYBHKFY-LRDDRELGSA-N 0 3 275.392 2.880 20 10 CFCDHN CC(C)[C@H]1CN(C)CC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000738285124 574163101 /nfs/dbraw/zinc/16/31/01/574163101.db2.gz GEJJXOVAECKZKT-QGZVFWFLSA-N 0 3 288.435 2.653 20 10 CFCDHN CC(C)[C@H]1CN(C)CC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000738285124 574163104 /nfs/dbraw/zinc/16/31/04/574163104.db2.gz GEJJXOVAECKZKT-QGZVFWFLSA-N 0 3 288.435 2.653 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000733327805 574221716 /nfs/dbraw/zinc/22/17/16/574221716.db2.gz WTEYLUIQLWPKHV-UHFFFAOYSA-N 0 3 269.344 2.925 20 10 CFCDHN COC[C@@H](C)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756342668 574227087 /nfs/dbraw/zinc/22/70/87/574227087.db2.gz UFUKQBYOYOBDTK-VXGBXAGGSA-N 0 3 263.381 2.957 20 10 CFCDHN COCCOCCC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756356981 574228941 /nfs/dbraw/zinc/22/89/41/574228941.db2.gz AOEMULOKIMQOJA-DGCLKSJQSA-N 0 3 297.370 2.722 20 10 CFCDHN CC(=O)N1CCC([NH2+][C@H](C)c2ccc(C)c(C)c2[O-])CC1 ZINC000756363227 574229774 /nfs/dbraw/zinc/22/97/74/574229774.db2.gz PIPFYUPVDKXOOU-CYBMUJFWSA-N 0 3 290.407 2.671 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756397262 574233585 /nfs/dbraw/zinc/23/35/85/574233585.db2.gz QDTNULQWLVAZMV-WCQYABFASA-N 0 3 289.354 2.956 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000756459088 574238693 /nfs/dbraw/zinc/23/86/93/574238693.db2.gz WJLUDNAROWTOHJ-WZRBSPASSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCCC(=O)N(C)C)c2c1c(F)ccc2[O-] ZINC000756480147 574240095 /nfs/dbraw/zinc/24/00/95/574240095.db2.gz REORXHAIMDWJAG-PWSUYJOCSA-N 0 3 294.370 2.538 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCSCCCO)c2c1c(F)ccc2[O-] ZINC000756541650 574244773 /nfs/dbraw/zinc/24/47/73/574244773.db2.gz GNGKEIWYASDAKI-JQWIXIFHSA-N 0 3 299.411 2.785 20 10 CFCDHN C[C@@H]([NH2+]CC1CCN(C)CC1)c1cc(F)cc(F)c1[O-] ZINC000756547263 574245599 /nfs/dbraw/zinc/24/55/99/574245599.db2.gz XGIMEIFUALKMHZ-SNVBAGLBSA-N 0 3 284.350 2.663 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756552533 574246152 /nfs/dbraw/zinc/24/61/52/574246152.db2.gz GFXNJGPSRVJTNC-ISOBSLSZSA-N 0 3 267.344 2.830 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c1 ZINC000756548597 574246376 /nfs/dbraw/zinc/24/63/76/574246376.db2.gz AJZJZZGGBPQANH-TZMCWYRMSA-N 0 3 290.407 2.536 20 10 CFCDHN CC[S@@](=O)CC[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756576677 574249360 /nfs/dbraw/zinc/24/93/60/574249360.db2.gz NZTUMXYLENRSGC-FKIZINRSSA-N 0 3 295.448 2.690 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000756576730 574249966 /nfs/dbraw/zinc/24/99/66/574249966.db2.gz ODUNNQYMVFMHEE-MKBNYLNASA-N 0 3 281.396 2.849 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756591243 574250985 /nfs/dbraw/zinc/25/09/85/574250985.db2.gz FUYLCDKIMHZZIB-FIQUKUQUSA-N 0 3 299.411 2.782 20 10 CFCDHN C[C@H](CCO)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756620634 574252592 /nfs/dbraw/zinc/25/25/92/574252592.db2.gz LLFVXSCATWVASQ-OLZOCXBDSA-N 0 3 277.408 2.940 20 10 CFCDHN C[C@@H](CCO)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756620636 574252774 /nfs/dbraw/zinc/25/27/74/574252774.db2.gz LLFVXSCATWVASQ-STQMWFEESA-N 0 3 277.408 2.940 20 10 CFCDHN C[C@@H](NCc1cc[nH]c1)c1ccc(N2CCOCC2)cc1 ZINC000748439571 574252763 /nfs/dbraw/zinc/25/27/63/574252763.db2.gz WFMJDEZLWNLGSV-CQSZACIVSA-N 0 3 285.391 2.702 20 10 CFCDHN C[C@@H]([NH2+]CCN1CC[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000756628458 574253389 /nfs/dbraw/zinc/25/33/89/574253389.db2.gz MHCVQYFDCDPJCL-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@]2(O)CCSC2)c([O-])c1C ZINC000756637594 574254237 /nfs/dbraw/zinc/25/42/37/574254237.db2.gz NZQVPZAZOHIBDF-DOMZBBRYSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CCO)C2CC2)c([O-])c1C ZINC000756738760 574259974 /nfs/dbraw/zinc/25/99/74/574259974.db2.gz KXHNHYRLMDFOFX-SWLSCSKDSA-N 0 3 263.381 2.821 20 10 CFCDHN C[C@H](CC[S@](C)=O)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756743230 574260785 /nfs/dbraw/zinc/26/07/85/574260785.db2.gz QVGPLXXHCHIZME-ODIUCEDNSA-N 0 3 299.411 2.826 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)Cc2cnccn2)cc1C ZINC000742369313 574278332 /nfs/dbraw/zinc/27/83/32/574278332.db2.gz UJBAPDDQAIFRPZ-CYBMUJFWSA-N 0 3 271.364 2.520 20 10 CFCDHN COc1ccc(C[NH2+]CC2CCC(OC)CC2)c([O-])c1 ZINC000749922723 574315980 /nfs/dbraw/zinc/31/59/80/574315980.db2.gz MZUGTCBBCNQACC-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1nccn1CCC[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000725846718 574328001 /nfs/dbraw/zinc/32/80/01/574328001.db2.gz LXCLMADHHKDPAB-UHFFFAOYSA-N 0 3 279.771 2.730 20 10 CFCDHN CN(C)C(=O)C[C@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000725846872 574328274 /nfs/dbraw/zinc/32/82/74/574328274.db2.gz WABYOFBOSVCYDP-INIZCTEOSA-N 0 3 298.386 2.701 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)COc2ccccc2)c1[O-] ZINC000725849344 574330072 /nfs/dbraw/zinc/33/00/72/574330072.db2.gz KWNQBDYZGZGOQU-CYBMUJFWSA-N 0 3 287.359 2.958 20 10 CFCDHN C[C@H](O)C[C@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811007 574395494 /nfs/dbraw/zinc/39/54/94/574395494.db2.gz KITHDHSXYNNHAT-BLLLJJGKSA-N 0 3 275.392 2.616 20 10 CFCDHN C[C@H](O)C[C@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811007 574395495 /nfs/dbraw/zinc/39/54/95/574395495.db2.gz KITHDHSXYNNHAT-BLLLJJGKSA-N 0 3 275.392 2.616 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@H](C)C(C)C)c([O-])c1OC ZINC000891605023 617683848 /nfs/dbraw/zinc/68/38/48/617683848.db2.gz WPHCHXCQOVLGJA-LLVKDONJSA-N 0 3 267.369 2.886 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@H](C)C(C)C)c([O-])c1OC ZINC000891605023 617683850 /nfs/dbraw/zinc/68/38/50/617683850.db2.gz WPHCHXCQOVLGJA-LLVKDONJSA-N 0 3 267.369 2.886 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](CO)c1cccnc1)c1ccccc1[O-] ZINC000806179019 617843641 /nfs/dbraw/zinc/84/36/41/617843641.db2.gz NFXLSQBLMXKCFF-HOCLYGCPSA-N 0 3 286.375 2.604 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@@H](C)CCSC)c([O-])c1OC ZINC000892083485 617943376 /nfs/dbraw/zinc/94/33/76/617943376.db2.gz JFOLFDFITGBZAG-NSHDSACASA-N 0 3 299.436 2.983 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@@H](C)CCSC)c([O-])c1OC ZINC000892083485 617943377 /nfs/dbraw/zinc/94/33/77/617943377.db2.gz JFOLFDFITGBZAG-NSHDSACASA-N 0 3 299.436 2.983 20 10 CFCDHN CCn1cc([C@@H](C)NCc2ccc(N(C)C)cc2)cn1 ZINC000044495344 618027729 /nfs/dbraw/zinc/02/77/29/618027729.db2.gz YXTAOPRKOJPLEM-CYBMUJFWSA-N 0 3 272.396 2.820 20 10 CFCDHN CC[C@H]([NH2+]Cc1cncn1C)c1ccc(C)cc1[O-] ZINC000289772205 618131121 /nfs/dbraw/zinc/13/11/21/618131121.db2.gz MHCKBIXLVWOLNG-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@@H](NCc1cncn1C)c1ccc(N(C)C)cc1 ZINC000289873377 618155835 /nfs/dbraw/zinc/15/58/35/618155835.db2.gz RPUPSSRWGKRBJU-MRXNPFEDSA-N 0 3 272.396 2.727 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(F)cc(F)c1[O-] ZINC000894053361 618293124 /nfs/dbraw/zinc/29/31/24/618293124.db2.gz GAWLTTADBXFSLJ-AWEZNQCLSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cc(F)cc(F)c1[O-] ZINC000894053361 618293128 /nfs/dbraw/zinc/29/31/28/618293128.db2.gz GAWLTTADBXFSLJ-AWEZNQCLSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@H]1CC[N@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894053361 618293132 /nfs/dbraw/zinc/29/31/32/618293132.db2.gz GAWLTTADBXFSLJ-AWEZNQCLSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@H]1CC[N@@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894053361 618293134 /nfs/dbraw/zinc/29/31/34/618293134.db2.gz GAWLTTADBXFSLJ-AWEZNQCLSA-N 0 3 298.377 2.977 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2CO)c1[O-] ZINC000895151181 618395494 /nfs/dbraw/zinc/39/54/94/618395494.db2.gz QRYCWOPDHTWBDE-CYBMUJFWSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCCC[C@@H]2CO)c1[O-] ZINC000895151181 618395512 /nfs/dbraw/zinc/39/55/12/618395512.db2.gz QRYCWOPDHTWBDE-CYBMUJFWSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(C)cc(CNCc2c(C)noc2C)c1O ZINC000894203909 618448157 /nfs/dbraw/zinc/44/81/57/618448157.db2.gz XPWTXZFVWKQCGN-UHFFFAOYSA-N 0 3 276.336 2.604 20 10 CFCDHN COc1ccc(CNCc2cnccc2C)cc1C ZINC000162666861 618450448 /nfs/dbraw/zinc/45/04/48/618450448.db2.gz MHQOJLJOTPXSJT-UHFFFAOYSA-N 0 3 256.349 2.997 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1ccccc1[O-] ZINC000155227869 618465196 /nfs/dbraw/zinc/46/51/96/618465196.db2.gz UDFKYIPSAFDSJD-GJZGRUSLSA-N 0 3 262.397 2.773 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CC[C@H](C(=O)OC)C1)c1ccccc1[O-] ZINC000193876394 618476358 /nfs/dbraw/zinc/47/63/58/618476358.db2.gz LTKIFCSDKVOSCJ-OUCADQQQSA-N 0 3 277.364 2.775 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](CO)CCC(C)C ZINC000895391731 618564037 /nfs/dbraw/zinc/56/40/37/618564037.db2.gz DCNBDOWLDWTCMQ-CYBMUJFWSA-N 0 3 251.370 2.587 20 10 CFCDHN c1csc(SCCCNCc2nccn2C2CC2)n1 ZINC000893045475 618813955 /nfs/dbraw/zinc/81/39/55/618813955.db2.gz RCSUWTLUSDKUBI-UHFFFAOYSA-N 0 3 294.449 2.947 20 10 CFCDHN C[C@@H]([NH2+]CCOCC(F)(F)F)c1cc(F)ccc1[O-] ZINC000094618230 619133066 /nfs/dbraw/zinc/13/30/66/619133066.db2.gz IMXBQUDWWMGRCS-MRVPVSSYSA-N 0 3 281.249 2.761 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1nccn1C ZINC000840975554 619201993 /nfs/dbraw/zinc/20/19/93/619201993.db2.gz IAQIBCCDLCXWPR-CQSZACIVSA-N 0 3 286.423 2.515 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)[C@H]2C)c1[O-] ZINC000840976492 619204107 /nfs/dbraw/zinc/20/41/07/619204107.db2.gz CKMXLKHFBGKBIJ-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)[C@H]2C)c1[O-] ZINC000840976492 619204109 /nfs/dbraw/zinc/20/41/09/619204109.db2.gz CKMXLKHFBGKBIJ-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000894567137 619420521 /nfs/dbraw/zinc/42/05/21/619420521.db2.gz RTHPKGXDLQTNHG-CYBMUJFWSA-N 0 3 284.350 2.587 20 10 CFCDHN C[N@@H+]1CCC[C@]2(CCN(Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859896 619486704 /nfs/dbraw/zinc/48/67/04/619486704.db2.gz QFBJSOQRAUBNBE-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN C[N@H+]1CCC[C@]2(CCN(Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859896 619486705 /nfs/dbraw/zinc/48/67/05/619486705.db2.gz QFBJSOQRAUBNBE-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@]2(CC[N@H+](Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859896 619486707 /nfs/dbraw/zinc/48/67/07/619486707.db2.gz QFBJSOQRAUBNBE-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@]2(CC[N@@H+](Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859896 619486709 /nfs/dbraw/zinc/48/67/09/619486709.db2.gz QFBJSOQRAUBNBE-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCN(Cc2cc(C)ccc2O)C1 ZINC000895577708 619559317 /nfs/dbraw/zinc/55/93/17/619559317.db2.gz RMGJDMKMHMSMKZ-ZDUSSCGKSA-N 0 3 289.297 2.854 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895579712 619562684 /nfs/dbraw/zinc/56/26/84/619562684.db2.gz BBWYIWBJVWRRSN-JTQLQIEISA-N 0 3 278.352 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895579712 619562685 /nfs/dbraw/zinc/56/26/85/619562685.db2.gz BBWYIWBJVWRRSN-JTQLQIEISA-N 0 3 278.352 2.977 20 10 CFCDHN CC(C)OC(=O)C1CCN(Cc2cc(F)ccc2O)CC1 ZINC000895828049 619612725 /nfs/dbraw/zinc/61/27/25/619612725.db2.gz HODIMNCLTHSPMG-UHFFFAOYSA-N 0 3 295.354 2.695 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@@]2(CO[C@@H](C)C2)O1 ZINC000895820472 619614523 /nfs/dbraw/zinc/61/45/23/619614523.db2.gz OIYWZYRFGGPUDX-GRDNDAEWSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895841676 619616946 /nfs/dbraw/zinc/61/69/46/619616946.db2.gz DWVQOAHCXHHZHT-GDBMZVCRSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895841676 619616947 /nfs/dbraw/zinc/61/69/47/619616947.db2.gz DWVQOAHCXHHZHT-GDBMZVCRSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895845776 619621355 /nfs/dbraw/zinc/62/13/55/619621355.db2.gz IZXNGQJOKZODDL-IAQYHMDHSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895845776 619621358 /nfs/dbraw/zinc/62/13/58/619621358.db2.gz IZXNGQJOKZODDL-IAQYHMDHSA-N 0 3 265.328 2.532 20 10 CFCDHN COc1nccc(CN[C@H](C)c2ccccc2O)c1F ZINC000895850559 619622963 /nfs/dbraw/zinc/62/29/63/619622963.db2.gz AKXWKUDTOFRGQU-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(C3(O)CCC3)CCC2)c([O-])c1 ZINC000895867884 619626009 /nfs/dbraw/zinc/62/60/09/619626009.db2.gz JTOBUULIBHIGJM-UHFFFAOYSA-N 0 3 275.392 2.876 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC(C)(C)CC[C@@H]2CO)c([O-])c1 ZINC000895925352 619635930 /nfs/dbraw/zinc/63/59/30/619635930.db2.gz XGHMYUPTGFQAFZ-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CC(C)(C)CC[C@@H]2CO)c([O-])c1 ZINC000895925352 619635932 /nfs/dbraw/zinc/63/59/32/619635932.db2.gz XGHMYUPTGFQAFZ-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896490399 619744594 /nfs/dbraw/zinc/74/45/94/619744594.db2.gz SJYOFGACORKKPE-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896490399 619744596 /nfs/dbraw/zinc/74/45/96/619744596.db2.gz SJYOFGACORKKPE-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](c3ccn(C)n3)C2)c([O-])c1 ZINC000896489219 619744751 /nfs/dbraw/zinc/74/47/51/619744751.db2.gz VEFQCXYKMJEBLR-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)c([O-])c1 ZINC000896489219 619744753 /nfs/dbraw/zinc/74/47/53/619744753.db2.gz VEFQCXYKMJEBLR-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cn1ccc(C2CC[NH+](Cc3ccccc3[O-])CC2)n1 ZINC000896495702 619749095 /nfs/dbraw/zinc/74/90/95/619749095.db2.gz OCKYYJZNSUGFIT-UHFFFAOYSA-N 0 3 271.364 2.505 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c([O-])c1 ZINC000896860697 619846372 /nfs/dbraw/zinc/84/63/72/619846372.db2.gz SIGGTCKMKUQPGW-WDEREUQCSA-N 0 3 259.271 2.989 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2CCCc3cccnc32)c1 ZINC000897071795 619925741 /nfs/dbraw/zinc/92/57/41/619925741.db2.gz MMDFQLAKAUGOOR-OAHLLOKOSA-N 0 3 284.359 2.963 20 10 CFCDHN CCc1onc(C)c1CNCc1ccc(C)cc1O ZINC000897336801 619999783 /nfs/dbraw/zinc/99/97/83/619999783.db2.gz ORMNEYCUSSDCJJ-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1COc3ccccc3O1)CC2 ZINC000321015476 620091434 /nfs/dbraw/zinc/09/14/34/620091434.db2.gz SPXQKKGZSLCJHC-KGLIPLIRSA-N 0 3 297.354 2.809 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CC[C@H](C3CC3)O2)c([O-])c1 ZINC000897501049 620192175 /nfs/dbraw/zinc/19/21/75/620192175.db2.gz LTTJZRNLRQRUDA-GDBMZVCRSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CC[C@@H](C3CC3)O2)c([O-])c1 ZINC000897501052 620192301 /nfs/dbraw/zinc/19/23/01/620192301.db2.gz LTTJZRNLRQRUDA-ZBFHGGJFSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CCO)C2CCCC2)c([O-])c1 ZINC000897882541 620297199 /nfs/dbraw/zinc/29/71/99/620297199.db2.gz MLQSVZKENQUVLM-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071765 620333606 /nfs/dbraw/zinc/33/36/06/620333606.db2.gz RZKGDLZLEJIPHA-GFCCVEGCSA-N 0 3 274.389 2.913 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071765 620333607 /nfs/dbraw/zinc/33/36/07/620333607.db2.gz RZKGDLZLEJIPHA-GFCCVEGCSA-N 0 3 274.389 2.913 20 10 CFCDHN Cc1cc([O-])c(CN[C@H]2CCC[NH2+][C@H]2C)c(Cl)c1 ZINC000841063101 620426641 /nfs/dbraw/zinc/42/66/41/620426641.db2.gz GQUNPZAGMXKIOR-GWCFXTLKSA-N 0 3 268.788 2.584 20 10 CFCDHN COC1(OC)CC[C@@H]1NCc1ccc(N2CCCC2)cc1 ZINC000924647718 620432501 /nfs/dbraw/zinc/43/25/01/620432501.db2.gz IPGZKJAUGSPJFI-INIZCTEOSA-N 0 3 290.407 2.528 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(C)cc1[O-] ZINC000903286471 621318489 /nfs/dbraw/zinc/31/84/89/621318489.db2.gz KHOFTNQPBOKSJR-FKKJATDVSA-N 0 3 273.376 2.917 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCOC1 ZINC000903358379 621347388 /nfs/dbraw/zinc/34/73/88/621347388.db2.gz VJHCMZNKLSUZKQ-WMLDXEAASA-N 0 3 291.391 2.553 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])CCOC1 ZINC000903357523 621347754 /nfs/dbraw/zinc/34/77/54/621347754.db2.gz MZOAQUSSIBWEDK-LRDDRELGSA-N 0 3 297.370 2.766 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000903450774 621386428 /nfs/dbraw/zinc/38/64/28/621386428.db2.gz MXOUVDXLBKHZQA-LOWVWBTDSA-N 0 3 295.354 2.914 20 10 CFCDHN Nc1ccnc(CNCc2ccc(N3CCCCC3)cc2)c1 ZINC000903950259 621486869 /nfs/dbraw/zinc/48/68/69/621486869.db2.gz KVXBGTANJAICHF-UHFFFAOYSA-N 0 3 296.418 2.944 20 10 CFCDHN CCCN(Cc1cc(Cl)ccc1[O-])[C@H]1CC[NH2+]C1 ZINC000071314557 625495184 /nfs/dbraw/zinc/49/51/84/625495184.db2.gz IAGFDOMHOZLZCM-ZDUSSCGKSA-N 0 3 268.788 2.620 20 10 CFCDHN Cc1cccc(OCC[NH2+]Cc2ccccc2[O-])c1 ZINC000042896041 621576133 /nfs/dbraw/zinc/57/61/33/621576133.db2.gz MHFPWYMXXOXVEN-UHFFFAOYSA-N 0 3 257.333 2.869 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCN1CCOC)c1ccccc1[O-] ZINC000155604932 622307116 /nfs/dbraw/zinc/30/71/16/622307116.db2.gz OBBHRMKQARYHDN-ZBFHGGJFSA-N 0 3 292.423 2.544 20 10 CFCDHN CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877030023 623017650 /nfs/dbraw/zinc/01/76/50/623017650.db2.gz WHBRFMMNFLCUSK-DOMZBBRYSA-N 0 3 251.370 2.587 20 10 CFCDHN CO[C@H](C[NH2+]Cc1c(C)cccc1[O-])C(C)(C)C ZINC000877067274 623047777 /nfs/dbraw/zinc/04/77/77/623047777.db2.gz FLUJBIPUYLZIHV-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN CC[C@H]([NH2+]CCC1(C)OCCO1)c1ccccc1[O-] ZINC000158108333 623093968 /nfs/dbraw/zinc/09/39/68/623093968.db2.gz DYTRPIKJRYFAOQ-ZDUSSCGKSA-N 0 3 265.353 2.586 20 10 CFCDHN COc1cccc(CNCc2ccccc2O)c1F ZINC000228416335 623143097 /nfs/dbraw/zinc/14/30/97/623143097.db2.gz LLAJKYPFLAACJD-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN CC(C)C[C@@H](O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000230660106 623291892 /nfs/dbraw/zinc/29/18/92/623291892.db2.gz MJRHFISEIRBXKV-ZYHUDNBSSA-N 0 3 255.333 2.589 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@](C)(O)C(C)C)c1[O-] ZINC000184708363 625638011 /nfs/dbraw/zinc/63/80/11/625638011.db2.gz SBFHKDXZHGIKQQ-CQSZACIVSA-N 0 3 287.787 2.551 20 10 CFCDHN C[C@H](O)C[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000757654529 623492641 /nfs/dbraw/zinc/49/26/41/623492641.db2.gz DJMGFVRODUTVGD-QFOLPQNPSA-N 0 3 267.344 2.829 20 10 CFCDHN C[C@H](O)C[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000757654624 623492822 /nfs/dbraw/zinc/49/28/22/623492822.db2.gz DJMGFVRODUTVGD-WDCWCFNPSA-N 0 3 267.344 2.829 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(OC)CCCC2)c([O-])c1 ZINC000824445996 623507758 /nfs/dbraw/zinc/50/77/58/623507758.db2.gz QBURCUAQAQEOHJ-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](SC)C2)c1[O-] ZINC000824683514 623544734 /nfs/dbraw/zinc/54/47/34/623544734.db2.gz NFBLWRFPHPIQKO-NSHDSACASA-N 0 3 287.812 2.992 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](SC)C2)c1[O-] ZINC000824683514 623544739 /nfs/dbraw/zinc/54/47/39/623544739.db2.gz NFBLWRFPHPIQKO-NSHDSACASA-N 0 3 287.812 2.992 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824716386 623551105 /nfs/dbraw/zinc/55/11/05/623551105.db2.gz UBUYCEAVIHFUJE-SQWLQELKSA-N 0 3 279.355 2.657 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824716386 623551108 /nfs/dbraw/zinc/55/11/08/623551108.db2.gz UBUYCEAVIHFUJE-SQWLQELKSA-N 0 3 279.355 2.657 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000824751032 623557470 /nfs/dbraw/zinc/55/74/70/623557470.db2.gz QNAIJAAKVUWJDC-GFCCVEGCSA-N 0 3 279.355 2.970 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](OC)[C@H](C)C2)c1[O-] ZINC000824814520 623569835 /nfs/dbraw/zinc/56/98/35/623569835.db2.gz ATRFUUUPCLZQCK-ZWNOBZJWSA-N 0 3 299.798 2.911 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](OC)[C@H](C)C2)c1[O-] ZINC000824814520 623569838 /nfs/dbraw/zinc/56/98/38/623569838.db2.gz ATRFUUUPCLZQCK-ZWNOBZJWSA-N 0 3 299.798 2.911 20 10 CFCDHN COCC1(C[NH2+]Cc2c([O-])cccc2OC)CCCC1 ZINC000825245191 623657527 /nfs/dbraw/zinc/65/75/27/623657527.db2.gz FWDSHAGYNUNSAA-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2c([O-])cccc2OC)CC1 ZINC000825321890 623670900 /nfs/dbraw/zinc/67/09/00/623670900.db2.gz QCFZQLNLMFCSOQ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2c([O-])cccc2OC)CC1 ZINC000825321890 623670904 /nfs/dbraw/zinc/67/09/04/623670904.db2.gz QCFZQLNLMFCSOQ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CO)c1ccccc1)CC2 ZINC000313294620 623676518 /nfs/dbraw/zinc/67/65/18/623676518.db2.gz GLKHEWCDAQDPET-CABCVRRESA-N 0 3 269.344 2.703 20 10 CFCDHN COc1cc(CN2CC(CCO)C2)c(O)c(C(C)(C)C)c1 ZINC000826112797 623794771 /nfs/dbraw/zinc/79/47/71/623794771.db2.gz DEXRCRMFQJZBCV-UHFFFAOYSA-N 0 3 293.407 2.513 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2C[C@H](O)c3ccccc32)c1 ZINC000827179364 623959971 /nfs/dbraw/zinc/95/99/71/623959971.db2.gz VUZLVUKDEYNCNV-WBVHZDCISA-N 0 3 285.343 2.669 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3COC[C@]3(C)C2)c1[O-] ZINC000827285071 623981552 /nfs/dbraw/zinc/98/15/52/623981552.db2.gz XVCYVKBKYLBAMA-DOMZBBRYSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1[O-] ZINC000827285071 623981553 /nfs/dbraw/zinc/98/15/53/623981553.db2.gz XVCYVKBKYLBAMA-DOMZBBRYSA-N 0 3 281.783 2.822 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC2=CCSC2)c([O-])c1 ZINC000827804948 624096866 /nfs/dbraw/zinc/09/68/66/624096866.db2.gz CWYWPKYDJRBMST-UHFFFAOYSA-N 0 3 279.405 2.896 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC2=CCSC2)c([O-])c1 ZINC000827804948 624096869 /nfs/dbraw/zinc/09/68/69/624096869.db2.gz CWYWPKYDJRBMST-UHFFFAOYSA-N 0 3 279.405 2.896 20 10 CFCDHN COCC1([NH2+]Cc2cc(F)ccc2[O-])CCCCC1 ZINC000827935246 624131430 /nfs/dbraw/zinc/13/14/30/624131430.db2.gz VVQTXHLJPOWBQO-UHFFFAOYSA-N 0 3 267.344 2.970 20 10 CFCDHN C[C@H]([NH2+]Cc1cccnc1N(C)C)c1ccccc1[O-] ZINC000154050109 624254413 /nfs/dbraw/zinc/25/44/13/624254413.db2.gz WBPGOUIJLWACLA-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC2(CCC2)O1 ZINC000830740463 624834054 /nfs/dbraw/zinc/83/40/54/624834054.db2.gz TXHUKBXQLFXKMA-AWEZNQCLSA-N 0 3 274.408 2.896 20 10 CFCDHN C[C@H]1CCCN(Cc2cc(Cl)ccc2[O-])[C@@H]1C[NH3+] ZINC000070175743 625279193 /nfs/dbraw/zinc/27/91/93/625279193.db2.gz HIZCWAKKDJCLJJ-GXFFZTMASA-N 0 3 268.788 2.605 20 10 CFCDHN CCCCOCCOCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834613085 625735357 /nfs/dbraw/zinc/73/53/57/625735357.db2.gz YSKRQIMZKLVIIF-OAHLLOKOSA-N 0 3 293.407 2.802 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000185524149 625736564 /nfs/dbraw/zinc/73/65/64/625736564.db2.gz MVHAPKAVDIKINU-STQMWFEESA-N 0 3 297.370 2.625 20 10 CFCDHN COc1ccccc1[C@@H](CO)N[C@@H]1CCc2cccc(O)c21 ZINC000834654535 625758932 /nfs/dbraw/zinc/75/89/32/625758932.db2.gz OTXRXTXTHCHQIG-HUUCEWRRSA-N 0 3 299.370 2.711 20 10 CFCDHN COC1(C[NH2+][C@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000186147067 625851865 /nfs/dbraw/zinc/85/18/65/625851865.db2.gz SSRIECVHQRUHPD-CYBMUJFWSA-N 0 3 279.380 2.547 20 10 CFCDHN C[C@@H]1COCC[C@@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834798898 625865652 /nfs/dbraw/zinc/86/56/52/625865652.db2.gz RCCVGLMDMCXYNV-MRVWCRGKSA-N 0 3 261.365 2.642 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000834901212 625915617 /nfs/dbraw/zinc/91/56/17/625915617.db2.gz QXQUJISCGIZCNG-VNHYZAJKSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]CCc1cnc(C)cn1)c1ccccc1[O-] ZINC000834908770 625920210 /nfs/dbraw/zinc/92/02/10/625920210.db2.gz MAJWRGLWHCLHRN-HNNXBMFYSA-N 0 3 271.364 2.774 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834914563 625921581 /nfs/dbraw/zinc/92/15/81/625921581.db2.gz OBUFMYOSWUTKKO-KXGXSXBTSA-N 0 3 265.328 2.583 20 10 CFCDHN C[C@H]([NH2+][C@H](CN)C1CC1)c1cc(Br)ccc1[O-] ZINC000817960760 625964272 /nfs/dbraw/zinc/96/42/72/625964272.db2.gz RDDCOCCCHGPLLB-QPUJVOFHSA-N 0 3 299.212 2.543 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3c(c2)CCCO3)cn1 ZINC000921524954 625972758 /nfs/dbraw/zinc/97/27/58/625972758.db2.gz MOOIEYBIALYFAB-UHFFFAOYSA-N 0 3 297.402 2.762 20 10 CFCDHN Cn1cnc2cc(CNCc3ccc4c(c3)CCO4)ccc21 ZINC000922483086 626297715 /nfs/dbraw/zinc/29/77/15/626297715.db2.gz UCRBWKHMXVJDND-UHFFFAOYSA-N 0 3 293.370 2.798 20 10 CFCDHN Oc1cc2c(cc1CN[C@H](c1ccccn1)C1CC1)OCO2 ZINC000922586847 626318576 /nfs/dbraw/zinc/31/85/76/626318576.db2.gz RNSFOZFWUDYQNZ-KRWDZBQOSA-N 0 3 298.342 2.757 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCS[C@@H](C)C1 ZINC000922840842 626377642 /nfs/dbraw/zinc/37/76/42/626377642.db2.gz BNGRVIIJAXXFDU-QWRGUYRKSA-N 0 3 267.394 2.775 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1C[C@@](CO)(c2ccccc2)C1 ZINC000923010396 626441832 /nfs/dbraw/zinc/44/18/32/626441832.db2.gz PVWPGMUJXRGQQL-MAEOIBBWSA-N 0 3 283.371 2.575 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)C1CC1 ZINC000838983037 626518655 /nfs/dbraw/zinc/51/86/55/626518655.db2.gz KKPNSEDPHCDEAP-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)C1CC1 ZINC000838983037 626518656 /nfs/dbraw/zinc/51/86/56/626518656.db2.gz KKPNSEDPHCDEAP-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2C[C@@H]3C[C@H]2CS3)cc1 ZINC000839190801 626530463 /nfs/dbraw/zinc/53/04/63/626530463.db2.gz CCUMLGGKXKDDNF-HFZJXRFXSA-N 0 3 274.433 2.956 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CCC[C@@H]3COC[C@@H]32)cc1 ZINC000839190238 626530603 /nfs/dbraw/zinc/53/06/03/626530603.db2.gz FFDRLDAEKLQLTB-LFWRUUNESA-N 0 3 286.419 2.877 20 10 CFCDHN CC[C@@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@H]1[NH3+] ZINC000843053137 626548634 /nfs/dbraw/zinc/54/86/34/626548634.db2.gz XQPIYTGNMKBFTE-ZWNOBZJWSA-N 0 3 268.788 2.605 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C2COC(C)(C)OC2)c2c1c(F)ccc2[O-] ZINC000757698349 626559088 /nfs/dbraw/zinc/55/90/88/626559088.db2.gz PVDBPHANQISWDV-BXKDBHETSA-N 0 3 295.354 2.821 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000757867810 626565990 /nfs/dbraw/zinc/56/59/90/626565990.db2.gz WFSSVNKTDRIAKK-HIFRSBDPSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000757867810 626565991 /nfs/dbraw/zinc/56/59/91/626565991.db2.gz WFSSVNKTDRIAKK-HIFRSBDPSA-N 0 3 293.407 2.630 20 10 CFCDHN Cc1ccc(O)c(CNCc2nn(C)c3ccccc23)c1 ZINC000759189628 626634195 /nfs/dbraw/zinc/63/41/95/626634195.db2.gz CMEZHXJFEFLRKN-UHFFFAOYSA-N 0 3 281.359 2.877 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(CC)CCOCC2)c([O-])c1 ZINC000761339150 626825532 /nfs/dbraw/zinc/82/55/32/626825532.db2.gz XGORKNAYLNVIKW-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000762142168 626896723 /nfs/dbraw/zinc/89/67/23/626896723.db2.gz KAKVXKDRGRSOFX-XHDPSFHLSA-N 0 3 289.375 2.583 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000762142168 626896724 /nfs/dbraw/zinc/89/67/24/626896724.db2.gz KAKVXKDRGRSOFX-XHDPSFHLSA-N 0 3 289.375 2.583 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CCO)C2CCOCC2)c1 ZINC000763559873 626998491 /nfs/dbraw/zinc/99/84/91/626998491.db2.gz XQDOPVYXTSMLQI-CJNGLKHVSA-N 0 3 293.407 2.529 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]1C1CCC1)[C@H](O)CO2 ZINC000768448330 627344250 /nfs/dbraw/zinc/34/42/50/627344250.db2.gz BUAPTXTVJNDTSW-GOEBONIOSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCC1)[C@H](O)CO2 ZINC000768448330 627344253 /nfs/dbraw/zinc/34/42/53/627344253.db2.gz BUAPTXTVJNDTSW-GOEBONIOSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC3(CCCC3)C1)[C@@H](O)CO2 ZINC000768465495 627345603 /nfs/dbraw/zinc/34/56/03/627345603.db2.gz IEQKPRYRPMJLJV-HNNXBMFYSA-N 0 3 289.375 2.584 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC3(CCCC3)C1)[C@@H](O)CO2 ZINC000768465495 627345606 /nfs/dbraw/zinc/34/56/06/627345606.db2.gz IEQKPRYRPMJLJV-HNNXBMFYSA-N 0 3 289.375 2.584 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000769190305 627411355 /nfs/dbraw/zinc/41/13/55/627411355.db2.gz SRAIDXXAAAKHFE-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(COC)CC2)c([O-])c1 ZINC000769329872 627425254 /nfs/dbraw/zinc/42/52/54/627425254.db2.gz VRVCREURXZSJDE-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000769534636 627453315 /nfs/dbraw/zinc/45/33/15/627453315.db2.gz XJPVQFPAXAFBKZ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000769534636 627453317 /nfs/dbraw/zinc/45/33/17/627453317.db2.gz XJPVQFPAXAFBKZ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(N(CC)CC)c(F)c2)C[C@@H]1O ZINC000770384332 627517799 /nfs/dbraw/zinc/51/77/99/627517799.db2.gz XLWIACMUXHVHLN-YOEHRIQHSA-N 0 3 294.414 2.875 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000770506176 627525802 /nfs/dbraw/zinc/52/58/02/627525802.db2.gz WVQWSRNRTKWXQW-DZGCQCFKSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000770506176 627525806 /nfs/dbraw/zinc/52/58/06/627525806.db2.gz WVQWSRNRTKWXQW-DZGCQCFKSA-N 0 3 261.365 2.641 20 10 CFCDHN CCN(C)c1ccc(CN(CC)Cc2cnn(C)c2)cc1 ZINC000773754651 627855418 /nfs/dbraw/zinc/85/54/18/627855418.db2.gz JQTZCJWRUJYRHP-UHFFFAOYSA-N 0 3 286.423 2.898 20 10 CFCDHN C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1ccnn1C ZINC000774362273 627919408 /nfs/dbraw/zinc/91/94/08/627919408.db2.gz JIDMFAYUBXJKJK-STQMWFEESA-N 0 3 272.396 2.898 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC[C@H]2OC)c([O-])c1 ZINC000774834049 627968763 /nfs/dbraw/zinc/96/87/63/627968763.db2.gz XUSAQKFUSMLGSP-CZUORRHYSA-N 0 3 279.380 2.696 20 10 CFCDHN COC(=O)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000775131915 627995710 /nfs/dbraw/zinc/99/57/10/627995710.db2.gz ZAMRYVVKKVXNFL-ZDUSSCGKSA-N 0 3 299.370 2.959 20 10 CFCDHN C[C@@H](NC/C=C/Cl)c1ccc(N2CCOCC2)cc1 ZINC000775261486 628004161 /nfs/dbraw/zinc/00/41/61/628004161.db2.gz VLQQJFXIPKKPIX-DRRGCAIJSA-N 0 3 280.799 2.926 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1[O-] ZINC000775512610 628033209 /nfs/dbraw/zinc/03/32/09/628033209.db2.gz LHGDZBJEHRMHBT-VBNZEHGJSA-N 0 3 274.408 2.916 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C[C@H](C)O)C(C)C)c1[O-] ZINC000775682420 628054555 /nfs/dbraw/zinc/05/45/55/628054555.db2.gz XCSBEFFWIKSHEO-NSHDSACASA-N 0 3 271.788 2.945 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C[C@H](C)O)C(C)C)c1[O-] ZINC000775682420 628054558 /nfs/dbraw/zinc/05/45/58/628054558.db2.gz XCSBEFFWIKSHEO-NSHDSACASA-N 0 3 271.788 2.945 20 10 CFCDHN CC(C)[C@@H]1CCN1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000775763940 628064007 /nfs/dbraw/zinc/06/40/07/628064007.db2.gz HTUUPCXZZAZXFE-INIZCTEOSA-N 0 3 292.398 2.893 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000776018915 628094095 /nfs/dbraw/zinc/09/40/95/628094095.db2.gz HYLZYKMFTSCLNA-QWHCGFSZSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000776018915 628094098 /nfs/dbraw/zinc/09/40/98/628094098.db2.gz HYLZYKMFTSCLNA-QWHCGFSZSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000776018917 628094159 /nfs/dbraw/zinc/09/41/59/628094159.db2.gz HYLZYKMFTSCLNA-STQMWFEESA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000776018917 628094164 /nfs/dbraw/zinc/09/41/64/628094164.db2.gz HYLZYKMFTSCLNA-STQMWFEESA-N 0 3 298.789 2.901 20 10 CFCDHN COc1cc(O)c(CN[C@@H](C)c2ccccn2)cc1OC ZINC000776069803 628098321 /nfs/dbraw/zinc/09/83/21/628098321.db2.gz NLAKBCIMSWHJKM-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN Cc1ccc(O)c(CNC2(C(=O)Nc3ccccc3)CC2)c1 ZINC000778217182 628288552 /nfs/dbraw/zinc/28/85/52/628288552.db2.gz HROGLBNZDLTESS-UHFFFAOYSA-N 0 3 296.370 2.962 20 10 CFCDHN C[C@@H]1C[NH+](Cc2cc(F)ccc2[O-])C[C@@H](C)S1 ZINC000779003076 628344551 /nfs/dbraw/zinc/34/45/51/628344551.db2.gz ORVYDYKFVLWEEM-NXEZZACHSA-N 0 3 255.358 2.857 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000779028942 628346680 /nfs/dbraw/zinc/34/66/80/628346680.db2.gz LSEYMUZLHDBXQL-BXUZGUMPSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000779028942 628346683 /nfs/dbraw/zinc/34/66/83/628346683.db2.gz LSEYMUZLHDBXQL-BXUZGUMPSA-N 0 3 265.328 2.532 20 10 CFCDHN C[C@@H](Cc1ccncc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779087773 628351209 /nfs/dbraw/zinc/35/12/09/628351209.db2.gz PEIMLIOTFZWULC-NSHDSACASA-N 0 3 260.312 2.647 20 10 CFCDHN COCC[C@H](NCc1cccc(OC)c1O)c1ccco1 ZINC000779991979 628425528 /nfs/dbraw/zinc/42/55/28/628425528.db2.gz MBTQTJMPFRKHRW-ZDUSSCGKSA-N 0 3 291.347 2.861 20 10 CFCDHN CCOc1ccc(C[NH2+]CC(C)(C)OCC)c([O-])c1 ZINC000780583767 628479588 /nfs/dbraw/zinc/47/95/88/628479588.db2.gz TZPVNWVUEVKVDB-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000783515762 628715008 /nfs/dbraw/zinc/71/50/08/628715008.db2.gz AWHUELLAMLBMII-YNEHKIRRSA-N 0 3 251.370 2.840 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H](C)c1ccccc1[O-])C(F)(F)F ZINC000783523328 628716314 /nfs/dbraw/zinc/71/63/14/628716314.db2.gz IEEUQVQLFNXQFQ-KWQFWETISA-N 0 3 263.259 2.620 20 10 CFCDHN C[C@@H]([NH2+]CCc1cnc(C2CC2)nc1)c1ccccc1[O-] ZINC000783520229 628716498 /nfs/dbraw/zinc/71/64/98/628716498.db2.gz ZMWVVYANXTYXLN-GFCCVEGCSA-N 0 3 283.375 2.953 20 10 CFCDHN COc1ccccc1[C@H](CO)N[C@H](C)c1ccccc1O ZINC000783524283 628716825 /nfs/dbraw/zinc/71/68/25/628716825.db2.gz YSPYTTBFQOWBGS-DOMZBBRYSA-N 0 3 287.359 2.785 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)[C@H]1C ZINC000787242175 629001603 /nfs/dbraw/zinc/00/16/03/629001603.db2.gz UOABLHMBYPGIGT-JSGCOSHPSA-N 0 3 299.370 2.929 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)[C@H]1C ZINC000787242175 629001606 /nfs/dbraw/zinc/00/16/06/629001606.db2.gz UOABLHMBYPGIGT-JSGCOSHPSA-N 0 3 299.370 2.929 20 10 CFCDHN CC[C@@H](CCO)[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000788604051 629085902 /nfs/dbraw/zinc/08/59/02/629085902.db2.gz TUBVDQZNQGNPHR-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000788981857 629113361 /nfs/dbraw/zinc/11/33/61/629113361.db2.gz PTFPWSDRPATPER-IONOHQLYSA-N 0 3 293.260 2.592 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000790717840 629258824 /nfs/dbraw/zinc/25/88/24/629258824.db2.gz PTFPWSDRPATPER-KADJCCMJSA-N 0 3 293.260 2.592 20 10 CFCDHN CN(C)c1ccc(/C=C/CN(C)C[C@@H]2CCCO2)cc1 ZINC000835025032 629319944 /nfs/dbraw/zinc/31/99/44/629319944.db2.gz FWSXUDSUBXMWET-YXMMZVCTSA-N 0 3 274.408 2.877 20 10 CFCDHN C[C@H]1COCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835024800 629320428 /nfs/dbraw/zinc/32/04/28/629320428.db2.gz BTPQSTMCJHBLIS-MBVDDHJVSA-N 0 3 274.408 2.734 20 10 CFCDHN C[C@H]1COCCCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000835024714 629320824 /nfs/dbraw/zinc/32/08/24/629320824.db2.gz AARYYMFMMUHBHD-VOKGJARPSA-N 0 3 274.408 2.877 20 10 CFCDHN CC[C@@H]1CN(C)CCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000835055951 629359200 /nfs/dbraw/zinc/35/92/00/629359200.db2.gz QIIQNGCWGKOBOY-DKRLNXSXSA-N 0 3 287.451 2.792 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCOC(C)(C)C1 ZINC000835059948 629362295 /nfs/dbraw/zinc/36/22/95/629362295.db2.gz MGYPWZSECCBDHB-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(C)ccc2O)c([O-])c1 ZINC000793391335 629536977 /nfs/dbraw/zinc/53/69/77/629536977.db2.gz VJOQQJNZGQFVEY-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCCC[C@H]2CCO)c1 ZINC000793607605 629577997 /nfs/dbraw/zinc/57/79/97/629577997.db2.gz BBAWBZFOLGOWBR-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCCC[C@H]2CCO)c1 ZINC000793607605 629578000 /nfs/dbraw/zinc/57/80/00/629578000.db2.gz BBAWBZFOLGOWBR-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609089 629578573 /nfs/dbraw/zinc/57/85/73/629578573.db2.gz NOEBRMILASMWGQ-OAHLLOKOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609089 629578575 /nfs/dbraw/zinc/57/85/75/629578575.db2.gz NOEBRMILASMWGQ-OAHLLOKOSA-N 0 3 293.407 2.918 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(C(C)=O)CC1)c1ccc(C)cc1[O-] ZINC000794793380 629687029 /nfs/dbraw/zinc/68/70/29/629687029.db2.gz NZBYAAPLDCJMDJ-MRXNPFEDSA-N 0 3 290.407 2.752 20 10 CFCDHN CC[C@@H]([NH2+]C[C@](C)(O)C1CC1)c1ccc(C)cc1[O-] ZINC000794806269 629687807 /nfs/dbraw/zinc/68/78/07/629687807.db2.gz GSVFMJFWIZOKIK-ZBFHGGJFSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)C(=O)NC)c1ccc(C)cc1[O-] ZINC000794814403 629689528 /nfs/dbraw/zinc/68/95/28/629689528.db2.gz DNCUTCHRVAPBAO-ZDUSSCGKSA-N 0 3 278.396 2.514 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nncn1CC)c1ccc(C)cc1[O-] ZINC000794811899 629689738 /nfs/dbraw/zinc/68/97/38/629689738.db2.gz UMACQDKVJTUPIY-CQSZACIVSA-N 0 3 288.395 2.595 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C[C@@H](C)O)c1ccc(C)cc1[O-] ZINC000794818758 629690452 /nfs/dbraw/zinc/69/04/52/629690452.db2.gz TVMLQUWDCUBQHZ-BZPMIXESSA-N 0 3 251.370 2.901 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2([S@@](C)=O)CC2)c2c1c(F)ccc2[O-] ZINC000799727514 630340214 /nfs/dbraw/zinc/34/02/14/630340214.db2.gz NCDSQOOWPHOBAW-CYKBGDKZSA-N 0 3 297.395 2.580 20 10 CFCDHN CCOc1ccc(O)c(CN2CC[C@H](OC(F)F)C2)c1 ZINC000802658805 630536881 /nfs/dbraw/zinc/53/68/81/630536881.db2.gz QPDMFLCSNXEVNC-LBPRGKRZSA-N 0 3 287.306 2.604 20 10 CFCDHN C[C@@H]1CCC[C@@](C[NH2+]Cc2ccccc2[O-])(N(C)C)C1 ZINC000040668240 649985682 /nfs/dbraw/zinc/98/56/82/649985682.db2.gz VGWRIMLRSNKILX-RHSMWYFYSA-N 0 3 276.424 2.992 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](O)C(F)(F)F)c1[O-] ZINC000808679926 631027606 /nfs/dbraw/zinc/02/76/06/631027606.db2.gz FGAQSBXQFXWYGV-XCBNKYQSSA-N 0 3 297.704 2.928 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCN(C)C2)c1[O-] ZINC000808692245 631029065 /nfs/dbraw/zinc/02/90/65/631029065.db2.gz QLWNTIIONVJRQB-ZYHUDNBSSA-N 0 3 268.788 2.709 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCN(C)C2)c1[O-] ZINC000808692237 631029193 /nfs/dbraw/zinc/02/91/93/631029193.db2.gz QLWNTIIONVJRQB-JQWIXIFHSA-N 0 3 268.788 2.709 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC2(C)OCCO2)c1[O-] ZINC000808710082 631032061 /nfs/dbraw/zinc/03/20/61/631032061.db2.gz LTKXYTYJJVIBCX-JTQLQIEISA-N 0 3 285.771 2.768 20 10 CFCDHN CNC(=O)C(C)(C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808710435 631032211 /nfs/dbraw/zinc/03/22/11/631032211.db2.gz QJANIBKOTQPZOD-SNVBAGLBSA-N 0 3 298.814 2.777 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCn2cncn2)c1[O-] ZINC000808710796 631032505 /nfs/dbraw/zinc/03/25/05/631032505.db2.gz ONDTZCXTXPJSIO-LLVKDONJSA-N 0 3 294.786 2.686 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2(C)OCCO2)c1[O-] ZINC000808710083 631032630 /nfs/dbraw/zinc/03/26/30/631032630.db2.gz LTKXYTYJJVIBCX-SNVBAGLBSA-N 0 3 285.771 2.768 20 10 CFCDHN CC(C)NC(=O)[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000840891360 631253567 /nfs/dbraw/zinc/25/35/67/631253567.db2.gz RCMPCRBWXMMBTG-SCVCMEIPSA-N 0 3 294.370 2.582 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)N[C@@H]1CCn2ccnc21 ZINC000840894308 631254287 /nfs/dbraw/zinc/25/42/87/631254287.db2.gz PXZDAYPPGXVHJW-WMLDXEAASA-N 0 3 298.434 2.923 20 10 CFCDHN CC[C@@H](N[C@@H](c1nncn1C)C(C)C)c1ccccc1O ZINC000809691715 631263993 /nfs/dbraw/zinc/26/39/93/631263993.db2.gz LUGGHOIMNNYBDA-UKRRQHHQSA-N 0 3 288.395 2.959 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCCOC2)c1[O-] ZINC000809692773 631264854 /nfs/dbraw/zinc/26/48/54/631264854.db2.gz GMJXERLXBBFWLZ-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@H]2CCCOC2)c1[O-] ZINC000809692773 631264859 /nfs/dbraw/zinc/26/48/59/631264859.db2.gz GMJXERLXBBFWLZ-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(OC)c2O)[C@H](C)C1 ZINC000809698327 631266485 /nfs/dbraw/zinc/26/64/85/631266485.db2.gz YIEUBYUIKATZAT-LLVKDONJSA-N 0 3 298.814 2.580 20 10 CFCDHN CCc1cc(CNCc2ccc(N(C)C)cc2C)n[nH]1 ZINC000840934566 631267354 /nfs/dbraw/zinc/26/73/54/631267354.db2.gz SVKGKEWZBCORKV-UHFFFAOYSA-N 0 3 272.396 2.636 20 10 CFCDHN CCc1cc(CNCc2ccc(N(C)C)cc2C)[nH]n1 ZINC000840934566 631267362 /nfs/dbraw/zinc/26/73/62/631267362.db2.gz SVKGKEWZBCORKV-UHFFFAOYSA-N 0 3 272.396 2.636 20 10 CFCDHN C[N@H+](Cc1ccc(O)cc1)Cc1cc(F)ccc1[O-] ZINC000809753248 631281407 /nfs/dbraw/zinc/28/14/07/631281407.db2.gz FGVSBCAHULIUAG-UHFFFAOYSA-N 0 3 261.296 2.869 20 10 CFCDHN C[N@@H+](Cc1ccc(O)cc1)Cc1cc(F)ccc1[O-] ZINC000809753248 631281410 /nfs/dbraw/zinc/28/14/10/631281410.db2.gz FGVSBCAHULIUAG-UHFFFAOYSA-N 0 3 261.296 2.869 20 10 CFCDHN COCC[C@@H](C)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000840955698 631283177 /nfs/dbraw/zinc/28/31/77/631283177.db2.gz VCHYTBVKUWJSJR-SNVBAGLBSA-N 0 3 287.787 2.816 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)[C@@H]2CC2(F)F)c([O-])c1 ZINC000840968093 631289057 /nfs/dbraw/zinc/28/90/57/631289057.db2.gz NMOWRKRUPNHOTG-KCJUWKMLSA-N 0 3 257.280 2.534 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000809790546 631291118 /nfs/dbraw/zinc/29/11/18/631291118.db2.gz LABZNJFGYKDPND-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000809790546 631291123 /nfs/dbraw/zinc/29/11/23/631291123.db2.gz LABZNJFGYKDPND-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c1[O-] ZINC000840980148 631293810 /nfs/dbraw/zinc/29/38/10/631293810.db2.gz WLKMYLOXGLBAGH-NEPJUHHUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)[C@H]2C)c1[O-] ZINC000840980148 631293819 /nfs/dbraw/zinc/29/38/19/631293819.db2.gz WLKMYLOXGLBAGH-NEPJUHHUSA-N 0 3 283.799 2.947 20 10 CFCDHN CC(C)(C)[C@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841086682 631335417 /nfs/dbraw/zinc/33/54/17/631335417.db2.gz CSCVNSXNDNCNFN-LBPRGKRZSA-N 0 3 256.777 2.509 20 10 CFCDHN [O-]c1c(Cl)cc(Cl)cc1C[NH2+]CCCNC1CC1 ZINC000841093314 631338649 /nfs/dbraw/zinc/33/86/49/631338649.db2.gz QWWHNJYNVWNSAM-UHFFFAOYSA-N 0 3 289.206 2.931 20 10 CFCDHN [O-]c1c(Cl)cc(Cl)cc1CNCCC[NH2+]C1CC1 ZINC000841093314 631338653 /nfs/dbraw/zinc/33/86/53/631338653.db2.gz QWWHNJYNVWNSAM-UHFFFAOYSA-N 0 3 289.206 2.931 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@]3(CCC[NH2+]3)C2)c(Cl)c1 ZINC000841105711 631341397 /nfs/dbraw/zinc/34/13/97/631341397.db2.gz STMQRAZRRJXFJZ-HNNXBMFYSA-N 0 3 280.799 2.682 20 10 CFCDHN COCC[C@H](COC)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000810257749 631350525 /nfs/dbraw/zinc/35/05/25/631350525.db2.gz VLBQLPYTXBPJIZ-LOWVWBTDSA-N 0 3 297.370 2.721 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@@](C)(O)C2)c1[O-] ZINC000841760467 631467770 /nfs/dbraw/zinc/46/77/70/631467770.db2.gz WCSRVVHDMRCKNF-UDZFHETQSA-N 0 3 269.772 2.918 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@H]2C[C@@](C)(O)C2)c2c1c(F)ccc2[O-] ZINC000841758183 631468388 /nfs/dbraw/zinc/46/83/88/631468388.db2.gz FJLUAMLJDOMWNE-ZBHNRTSDSA-N 0 3 265.328 2.583 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841888735 631487928 /nfs/dbraw/zinc/48/79/28/631487928.db2.gz OYLNRWSKUQECNN-UHFFFAOYSA-N 0 3 261.365 2.926 20 10 CFCDHN C[N@H+](CCC(C)(C)C)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000842630394 631684991 /nfs/dbraw/zinc/68/49/91/631684991.db2.gz DKSYYGKZPSXONO-CQSZACIVSA-N 0 3 279.380 2.686 20 10 CFCDHN C[N@@H+](CCC(C)(C)C)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000842630394 631684994 /nfs/dbraw/zinc/68/49/94/631684994.db2.gz DKSYYGKZPSXONO-CQSZACIVSA-N 0 3 279.380 2.686 20 10 CFCDHN OCC[C@@H](NCc1ccccc1O)c1ccccc1F ZINC000842762754 631732890 /nfs/dbraw/zinc/73/28/90/631732890.db2.gz JEVTVSWIZUUXMI-OAHLLOKOSA-N 0 3 275.323 2.745 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1=O)c1cc(F)ccc1[O-] ZINC000842886447 631772719 /nfs/dbraw/zinc/77/27/19/631772719.db2.gz SAJKDYRLGCDNJF-MFKMUULPSA-N 0 3 294.370 2.581 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000842913363 631780966 /nfs/dbraw/zinc/78/09/66/631780966.db2.gz BHABRULHMLBQHS-DMDPSCGWSA-N 0 3 269.360 2.979 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)[C@]1(O)CCOC1)c1ccccc1[O-] ZINC000842918246 631781884 /nfs/dbraw/zinc/78/18/84/631781884.db2.gz DXLYBDUIXQKHFM-PBHICJAKSA-N 0 3 293.407 2.611 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000842913663 631782128 /nfs/dbraw/zinc/78/21/28/631782128.db2.gz CXOVJNYRMNIOTJ-RWMBFGLXSA-N 0 3 251.370 2.840 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)[C@@H]1SC ZINC000842922792 631782503 /nfs/dbraw/zinc/78/25/03/631782503.db2.gz DQNLTDFXTQXXFH-DMEJVMROSA-N 0 3 293.432 2.878 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]([NH3+])[C@@H](C)C2)c(Cl)c1 ZINC000843051003 631814612 /nfs/dbraw/zinc/81/46/12/631814612.db2.gz DDSQFOYQIOZXOQ-GWCFXTLKSA-N 0 3 268.788 2.523 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CCNCC12CCCCC2 ZINC000843054496 631817307 /nfs/dbraw/zinc/81/73/07/631817307.db2.gz OJWRZWLKMVQJFH-UHFFFAOYSA-N 0 3 278.371 2.639 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CCNCC12CCCCC2 ZINC000843054496 631817309 /nfs/dbraw/zinc/81/73/09/631817309.db2.gz OJWRZWLKMVQJFH-UHFFFAOYSA-N 0 3 278.371 2.639 20 10 CFCDHN Cc1cc([O-])c(CN2CCC(C)([NH3+])CC2)c(Cl)c1 ZINC000843106069 631836667 /nfs/dbraw/zinc/83/66/67/631836667.db2.gz HKXPFLQLXDATTJ-UHFFFAOYSA-N 0 3 268.788 2.667 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCO)CSC)c1ccccc1[O-] ZINC000155980043 650039814 /nfs/dbraw/zinc/03/98/14/650039814.db2.gz MVIIRIKSLCFUFA-WCQYABFASA-N 0 3 269.410 2.547 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000843431618 631957607 /nfs/dbraw/zinc/95/76/07/631957607.db2.gz IYMYVXNLTLCCSM-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000843431618 631957610 /nfs/dbraw/zinc/95/76/10/631957610.db2.gz IYMYVXNLTLCCSM-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2CC(F)(F)C2)c([O-])c1 ZINC000813781874 631958420 /nfs/dbraw/zinc/95/84/20/631958420.db2.gz UAYMFXCQRRAYGK-UHFFFAOYSA-N 0 3 271.307 2.926 20 10 CFCDHN COc1cccc(CN2C[C@H](C)OC3(CCCC3)C2)c1O ZINC000843435464 631959443 /nfs/dbraw/zinc/95/94/43/631959443.db2.gz UNZJTAGGVSDGER-ZDUSSCGKSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C(C)(C)COC)c([O-])c1 ZINC000814178497 632024392 /nfs/dbraw/zinc/02/43/92/632024392.db2.gz SAQJMJJZFJXQGT-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C(C)(C)COC)c([O-])c1 ZINC000814178497 632024398 /nfs/dbraw/zinc/02/43/98/632024398.db2.gz SAQJMJJZFJXQGT-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)Cc2ccc(O)cc2)c([O-])c1 ZINC000105446984 632134706 /nfs/dbraw/zinc/13/47/06/632134706.db2.gz YGOMELYPZHLITG-GFCCVEGCSA-N 0 3 287.359 2.827 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CNc2ccccc2C1 ZINC000844904668 632332277 /nfs/dbraw/zinc/33/22/77/632332277.db2.gz BMNIAHJLNXLWRT-AWEZNQCLSA-N 0 3 254.333 2.519 20 10 CFCDHN C[N@H+](Cc1cn[nH]c1)Cc1ccc2ccccc2c1[O-] ZINC000816512343 632474878 /nfs/dbraw/zinc/47/48/78/632474878.db2.gz GCTLZMBTYDGPHH-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1cn[nH]c1)Cc1ccc2ccccc2c1[O-] ZINC000816512343 632474882 /nfs/dbraw/zinc/47/48/82/632474882.db2.gz GCTLZMBTYDGPHH-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1C[NH2+][C@H]1CCc2cn[nH]c2C1 ZINC000816556808 632483835 /nfs/dbraw/zinc/48/38/35/632483835.db2.gz UPRRGYXGHFBGJB-JTQLQIEISA-N 0 3 295.745 2.555 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1C[NH2+][C@@H]1CCc2cn[nH]c2C1 ZINC000816556809 632484294 /nfs/dbraw/zinc/48/42/94/632484294.db2.gz UPRRGYXGHFBGJB-SNVBAGLBSA-N 0 3 295.745 2.555 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000816648508 632503103 /nfs/dbraw/zinc/50/31/03/632503103.db2.gz LLYSBOWKEJKTSL-OLZOCXBDSA-N 0 3 278.371 2.503 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](CO)C[C@H](C)C2)c1[O-] ZINC000817412644 632624612 /nfs/dbraw/zinc/62/46/12/632624612.db2.gz NOXIZZHWKGRMRY-CMPLNLGQSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c1[O-] ZINC000817412644 632624615 /nfs/dbraw/zinc/62/46/15/632624615.db2.gz NOXIZZHWKGRMRY-CMPLNLGQSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@@H](CO)C2)c1[O-] ZINC000817412647 632624933 /nfs/dbraw/zinc/62/49/33/632624933.db2.gz NOXIZZHWKGRMRY-ZYHUDNBSSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c1[O-] ZINC000817412647 632624937 /nfs/dbraw/zinc/62/49/37/632624937.db2.gz NOXIZZHWKGRMRY-ZYHUDNBSSA-N 0 3 283.799 2.804 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC([C@H](C)CO)CC2)c([O-])c1 ZINC000846059137 632626470 /nfs/dbraw/zinc/62/64/70/632626470.db2.gz YTOVEROPJHEWMM-CYBMUJFWSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846117763 632639293 /nfs/dbraw/zinc/63/92/93/632639293.db2.gz RDCNGVLREIWVEE-ZDUSSCGKSA-N 0 3 269.291 2.632 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846117763 632639295 /nfs/dbraw/zinc/63/92/95/632639295.db2.gz RDCNGVLREIWVEE-ZDUSSCGKSA-N 0 3 269.291 2.632 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1ccccc1[O-] ZINC000846180121 632655161 /nfs/dbraw/zinc/65/51/61/632655161.db2.gz SAEBMUYMDOSIIQ-LIRRHRJNSA-N 0 3 297.398 2.919 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CC[C@H](C(N)=O)CC2)c1 ZINC000817585228 632671577 /nfs/dbraw/zinc/67/15/77/632671577.db2.gz CUUHTRLJSDDXRI-IHRRRGAJSA-N 0 3 290.407 2.643 20 10 CFCDHN CC[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)CCO1 ZINC000817587485 632672278 /nfs/dbraw/zinc/67/22/78/632672278.db2.gz YGYIVXGSHYIAOW-MJBXVCDLSA-N 0 3 261.365 2.927 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000817588821 632672371 /nfs/dbraw/zinc/67/23/71/632672371.db2.gz ROQXPQNSHUJGNF-TZMCWYRMSA-N 0 3 291.391 2.553 20 10 CFCDHN COC1([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])CCOCC1 ZINC000817589204 632672586 /nfs/dbraw/zinc/67/25/86/632672586.db2.gz VYSQRFFJMQKHCD-RYUDHWBXSA-N 0 3 297.370 2.766 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CCCCC1)c1ccc(F)cc1[O-] ZINC000817938140 632742794 /nfs/dbraw/zinc/74/27/94/632742794.db2.gz FFTXSWAONIRXIL-NSHDSACASA-N 0 3 266.360 2.844 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817944824 632747139 /nfs/dbraw/zinc/74/71/39/632747139.db2.gz NGQPXRBBNJKXSO-PWSUYJOCSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](N)c1ccccc1)c1cc(F)ccc1[O-] ZINC000817955372 632755065 /nfs/dbraw/zinc/75/50/65/632755065.db2.gz WQSIFPZQAIVHBW-IAQYHMDHSA-N 0 3 274.339 2.882 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1[O-] ZINC000817960534 632759664 /nfs/dbraw/zinc/75/96/64/632759664.db2.gz MTGVBXOQJMXLEW-QMMMGPOBSA-N 0 3 276.302 2.799 20 10 CFCDHN CCC[NH2+]CCN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000817963650 632762910 /nfs/dbraw/zinc/76/29/10/632762910.db2.gz WTRVTMNAYNYLQJ-JTQLQIEISA-N 0 3 256.777 2.696 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817965460 632764505 /nfs/dbraw/zinc/76/45/05/632764505.db2.gz VIFOSKASCIUWSZ-VIFPVBQESA-N 0 3 288.313 2.943 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CNCC[C@H]1C)c1ccc(F)cc1[O-] ZINC000817969729 632768616 /nfs/dbraw/zinc/76/86/16/632768616.db2.gz YUVNZZWVHPHLAJ-SWHYSGLUSA-N 0 3 266.360 2.570 20 10 CFCDHN CC[C@@H](N)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817979884 632777242 /nfs/dbraw/zinc/77/72/42/632777242.db2.gz PXROJGOKGBFWOE-DTWKUNHWSA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@H]([NH2+][C@H](CN)C1CCCC1)c1ccc(F)cc1[O-] ZINC000817981451 632778008 /nfs/dbraw/zinc/77/80/08/632778008.db2.gz KBMUAKDIHLEARP-IINYFYTJSA-N 0 3 266.360 2.699 20 10 CFCDHN CCc1cc(CNCc2cccc(CC)c2O)[nH]n1 ZINC000848897500 633387579 /nfs/dbraw/zinc/38/75/79/633387579.db2.gz QPNXLSJCHNXJOC-UHFFFAOYSA-N 0 3 259.353 2.530 20 10 CFCDHN CCc1cccc(CN2C[C@@H](C)O[C@H](C3CC3)C2)c1O ZINC000848907695 633393748 /nfs/dbraw/zinc/39/37/48/633393748.db2.gz HDMNDDFZBZIXRG-WBMJQRKESA-N 0 3 275.392 2.954 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cnc(Cl)n2C)c1 ZINC000848911856 633396671 /nfs/dbraw/zinc/39/66/71/633396671.db2.gz JLOKJIQYBZSLQE-SECBINFHSA-N 0 3 295.770 2.639 20 10 CFCDHN CCc1cccc(CN2CC3(CC3(F)F)C2)c1O ZINC000848922717 633404642 /nfs/dbraw/zinc/40/46/42/633404642.db2.gz UZMIXCUPNBKUSS-UHFFFAOYSA-N 0 3 253.292 2.796 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000849353055 633627183 /nfs/dbraw/zinc/62/71/83/633627183.db2.gz XINKKUSQUWESDH-HNNXBMFYSA-N 0 3 284.359 2.760 20 10 CFCDHN CN1CCCc2cc(CNCc3cnn4c3CCC4)ccc21 ZINC000850099734 633840689 /nfs/dbraw/zinc/84/06/89/633840689.db2.gz VTJIGJCZPCORGA-UHFFFAOYSA-N 0 3 296.418 2.502 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1c(C2CC2)cnn1C ZINC000850137453 633853867 /nfs/dbraw/zinc/85/38/67/633853867.db2.gz PFCKRYDSMSZMNC-UHFFFAOYSA-N 0 3 298.434 2.962 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3cncs3)C2)cc1 ZINC000850347619 633948576 /nfs/dbraw/zinc/94/85/76/633948576.db2.gz UZJSGCAUOVTMDL-LBPRGKRZSA-N 0 3 289.404 2.520 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccc(C)cn3)C2)cc1 ZINC000850347422 633948639 /nfs/dbraw/zinc/94/86/39/633948639.db2.gz RXEIHXDPHGDBIC-INIZCTEOSA-N 0 3 297.402 2.767 20 10 CFCDHN COc1cccc(CN[C@@H]2C[C@H](O)c3ccccc32)c1O ZINC000850370397 633959662 /nfs/dbraw/zinc/95/96/62/633959662.db2.gz DNMSLXZHXIEEBL-CABCVRRESA-N 0 3 285.343 2.669 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000850370953 633961154 /nfs/dbraw/zinc/96/11/54/633961154.db2.gz GWMSMGMPOJKFQX-HOCLYGCPSA-N 0 3 255.317 2.660 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000850370949 633961420 /nfs/dbraw/zinc/96/14/20/633961420.db2.gz GWMSMGMPOJKFQX-GDBMZVCRSA-N 0 3 255.317 2.660 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@]1(C)CC1(F)F ZINC000850378931 633964588 /nfs/dbraw/zinc/96/45/88/633964588.db2.gz BDCWIWPMWQLZTG-LBPRGKRZSA-N 0 3 257.280 2.536 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000850408881 633980810 /nfs/dbraw/zinc/98/08/10/633980810.db2.gz HPFLGVJFCMBVJU-MORSLUCNSA-N 0 3 299.345 2.968 20 10 CFCDHN Cc1ccncc1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000850508995 634024343 /nfs/dbraw/zinc/02/43/43/634024343.db2.gz WXOZXOUPFXMDMZ-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)C2(CO)CC2)c([O-])c1 ZINC000850513162 634024817 /nfs/dbraw/zinc/02/48/17/634024817.db2.gz CPXJKXZFLVDDQW-CHWSQXEVSA-N 0 3 263.381 2.821 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](CO)CC1CC1)c1ccccc1[O-] ZINC000850544171 634046133 /nfs/dbraw/zinc/04/61/33/634046133.db2.gz DCZLUSDCFQBSOZ-UKRRQHHQSA-N 0 3 263.381 2.842 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000850555937 634052798 /nfs/dbraw/zinc/05/27/98/634052798.db2.gz KCNKYQZTOAFFEX-STQMWFEESA-N 0 3 290.407 2.690 20 10 CFCDHN CN(Cc1ccccc1O)C(=O)C[C@@H]1NCc2ccccc21 ZINC000852789642 634836748 /nfs/dbraw/zinc/83/67/48/634836748.db2.gz JUKXCHVFPSGHPQ-INIZCTEOSA-N 0 3 296.370 2.585 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCC2(COC2)C1 ZINC000853595492 635044914 /nfs/dbraw/zinc/04/49/14/635044914.db2.gz QERPGMKUGMZTLX-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCC2(COC2)C1 ZINC000853595492 635044917 /nfs/dbraw/zinc/04/49/17/635044917.db2.gz QERPGMKUGMZTLX-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000853605873 635048678 /nfs/dbraw/zinc/04/86/78/635048678.db2.gz NBPXVGOVPQLPKU-SWBAQPJJSA-N 0 3 289.375 2.581 20 10 CFCDHN CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000853605873 635048680 /nfs/dbraw/zinc/04/86/80/635048680.db2.gz NBPXVGOVPQLPKU-SWBAQPJJSA-N 0 3 289.375 2.581 20 10 CFCDHN CC[C@H](NCC12CC(C1)C[NH2+]2)c1cccc(Cl)c1[O-] ZINC000854226293 635264759 /nfs/dbraw/zinc/26/47/59/635264759.db2.gz HDQQUFVMFMICOP-IQYSWEBNSA-N 0 3 280.799 2.838 20 10 CFCDHN CC[C@H]([NH2+]CC12CC(C1)CN2)c1cccc(Cl)c1[O-] ZINC000854226293 635264766 /nfs/dbraw/zinc/26/47/66/635264766.db2.gz HDQQUFVMFMICOP-IQYSWEBNSA-N 0 3 280.799 2.838 20 10 CFCDHN CC[C@H](COC)NCc1cc(F)c(N(C)C)cc1F ZINC000858143637 636138026 /nfs/dbraw/zinc/13/80/26/636138026.db2.gz PUGXXWIBNUNYOU-LLVKDONJSA-N 0 3 272.339 2.545 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000858484969 636268166 /nfs/dbraw/zinc/26/81/66/636268166.db2.gz HHGPNZGNGDGDRW-STQMWFEESA-N 0 3 251.370 2.840 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000858504946 636274816 /nfs/dbraw/zinc/27/48/16/636274816.db2.gz BWMLPXNLEQNAJG-AAEUAGOBSA-N 0 3 275.348 2.695 20 10 CFCDHN CN(C)c1cc(F)c(CN2CCC[C@@H]2C(C)(C)O)cc1F ZINC000862324894 637321519 /nfs/dbraw/zinc/32/15/19/637321519.db2.gz XQHCMJQAMAVLTO-OAHLLOKOSA-N 0 3 298.377 2.766 20 10 CFCDHN CC[C@@H](C)[N@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000862386993 637350315 /nfs/dbraw/zinc/35/03/15/637350315.db2.gz GBIQZUWDMKFOKW-SNVBAGLBSA-N 0 3 287.787 2.647 20 10 CFCDHN CC[C@@H](C)[N@@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000862386993 637350318 /nfs/dbraw/zinc/35/03/18/637350318.db2.gz GBIQZUWDMKFOKW-SNVBAGLBSA-N 0 3 287.787 2.647 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC(O)(CC)CC)c([O-])c1 ZINC000862539961 637413059 /nfs/dbraw/zinc/41/30/59/637413059.db2.gz VMKHYMLLZVDBAI-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC(O)(CC)CC)c([O-])c1 ZINC000862539961 637413060 /nfs/dbraw/zinc/41/30/60/637413060.db2.gz VMKHYMLLZVDBAI-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+][C@H]1CC)c1ccc(F)cc1[O-] ZINC000863543694 637689929 /nfs/dbraw/zinc/68/99/29/637689929.db2.gz VZHAOKDMEGRTFB-MELADBBJSA-N 0 3 266.360 2.713 20 10 CFCDHN C[N@H+](Cc1ccc2c[nH]nc2c1)Cc1ccccc1[O-] ZINC000120037659 637960218 /nfs/dbraw/zinc/96/02/18/637960218.db2.gz JHDJDFDPCYHACS-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1ccc2c[nH]nc2c1)Cc1ccccc1[O-] ZINC000120037659 637960223 /nfs/dbraw/zinc/96/02/23/637960223.db2.gz JHDJDFDPCYHACS-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000865725314 638537946 /nfs/dbraw/zinc/53/79/46/638537946.db2.gz HXMBYAJJDYWLQI-UHFFFAOYSA-N 0 3 269.344 2.755 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CCC1)[C@H]1CCCO1 ZINC000865735602 638544153 /nfs/dbraw/zinc/54/41/53/638544153.db2.gz RNUIDCONRNPLQH-CVEARBPZSA-N 0 3 261.365 2.830 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000865779519 638569528 /nfs/dbraw/zinc/56/95/28/638569528.db2.gz XECVUKHDFONHTI-ZDUSSCGKSA-N 0 3 291.391 2.697 20 10 CFCDHN CCOc1ccc(O)c(CN[C@@H]2CCCn3nccc32)c1 ZINC000865872985 638631983 /nfs/dbraw/zinc/63/19/83/638631983.db2.gz YFSZBVOHMYQKBQ-CQSZACIVSA-N 0 3 287.363 2.612 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@H](O)C(F)(F)F ZINC000866463602 638825881 /nfs/dbraw/zinc/82/58/81/638825881.db2.gz BZIBKTRIRKJFBQ-CWSCBRNRSA-N 0 3 290.329 2.715 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@@H](O)C(F)(F)F)c1ccccc1[O-] ZINC000866464903 638825888 /nfs/dbraw/zinc/82/58/88/638825888.db2.gz ZSNCOYDWBSDTKP-PTOFAABTSA-N 0 3 277.286 2.745 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)CC(C)C)c1ccccc1[O-] ZINC000121083902 638831521 /nfs/dbraw/zinc/83/15/21/638831521.db2.gz YUKJGROIXSVPNU-TZMCWYRMSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCn2nccc21)c1ccccc1[O-] ZINC000866631694 638857915 /nfs/dbraw/zinc/85/79/15/638857915.db2.gz CWRKZGVLHZFARO-WCQYABFASA-N 0 3 257.337 2.774 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCCn3nccc31)CC2 ZINC000866632933 638858166 /nfs/dbraw/zinc/85/81/66/638858166.db2.gz DKERXHDIXWNBNN-CHWSQXEVSA-N 0 3 269.348 2.701 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000191590551 650512287 /nfs/dbraw/zinc/51/22/87/650512287.db2.gz LEUMUNIPEADMBV-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1C[C@@H]3CCC[C@H]3O1)CC2 ZINC000872106937 641638912 /nfs/dbraw/zinc/63/89/12/641638912.db2.gz JBQPUUYXKPQLGC-TTZDDIAXSA-N 0 3 273.376 2.927 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1Cc2ccccc2CN1)c1ccccc1[O-] ZINC000873294465 642125552 /nfs/dbraw/zinc/12/55/52/642125552.db2.gz SYWCHSGBJKKDNI-CZUORRHYSA-N 0 3 282.387 2.757 20 10 CFCDHN CC[C@@H](C)[C@H](C[N@H+](C)Cc1ccccc1[O-])OC ZINC000876615409 642945617 /nfs/dbraw/zinc/94/56/17/642945617.db2.gz DTODTETUHWTWBM-DOMZBBRYSA-N 0 3 251.370 2.885 20 10 CFCDHN CC[C@@H](C)[C@H](C[N@@H+](C)Cc1ccccc1[O-])OC ZINC000876615409 642945619 /nfs/dbraw/zinc/94/56/19/642945619.db2.gz DTODTETUHWTWBM-DOMZBBRYSA-N 0 3 251.370 2.885 20 10 CFCDHN COc1cncc(CN(C)Cc2ccccc2O)c1C ZINC000876616297 642946069 /nfs/dbraw/zinc/94/60/69/642946069.db2.gz VMNOSUNUZIEMFX-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000876619242 642948104 /nfs/dbraw/zinc/94/81/04/642948104.db2.gz RGNFWLGHXFLXPH-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000876619242 642948111 /nfs/dbraw/zinc/94/81/11/642948111.db2.gz RGNFWLGHXFLXPH-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN COC(=O)CCC1CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000876727365 642984545 /nfs/dbraw/zinc/98/45/45/642984545.db2.gz YQIIMXSQOUXIFE-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(C3(C)OCCO3)CC2)c([O-])c1 ZINC000876727637 642985181 /nfs/dbraw/zinc/98/51/81/642985181.db2.gz PRHNZOUOHCOSOT-UHFFFAOYSA-N 0 3 291.391 2.676 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000876739793 642988400 /nfs/dbraw/zinc/98/84/00/642988400.db2.gz QOZFMJMDDIEKFS-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000876739793 642988402 /nfs/dbraw/zinc/98/84/02/642988402.db2.gz QOZFMJMDDIEKFS-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000876781131 643006096 /nfs/dbraw/zinc/00/60/96/643006096.db2.gz KAGSOCXMYRHDTQ-KGLIPLIRSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000876781131 643006103 /nfs/dbraw/zinc/00/61/03/643006103.db2.gz KAGSOCXMYRHDTQ-KGLIPLIRSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(CNCc2cccc3c2OCCO3)c(O)c1 ZINC000876875971 643045424 /nfs/dbraw/zinc/04/54/24/643045424.db2.gz GUQAQOJLRRYNKV-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](CO)Cc2ccccc2)c([O-])c1 ZINC000876965815 643085575 /nfs/dbraw/zinc/08/55/75/643085575.db2.gz LPFIKBLWTJZIDA-INIZCTEOSA-N 0 3 285.387 2.641 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)COCC(F)(F)F)c([O-])c1 ZINC000876974552 643089128 /nfs/dbraw/zinc/08/91/28/643089128.db2.gz KVZVECPKKVQJHH-JTQLQIEISA-N 0 3 277.286 2.758 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCN(C)C(=O)OC(C)(C)C ZINC000876995589 643097386 /nfs/dbraw/zinc/09/73/86/643097386.db2.gz HBNMFXGZCIUEDK-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN Cc1ccc(C[NH2+]CCCc2nc(C(C)C)no2)c([O-])c1 ZINC000877007539 643102135 /nfs/dbraw/zinc/10/21/35/643102135.db2.gz UYLFNYHDBOYTJV-UHFFFAOYSA-N 0 3 289.379 2.929 20 10 CFCDHN Cc1ccc(CN[C@H](CO)c2cccc(F)c2)c(O)c1 ZINC000877035869 643114839 /nfs/dbraw/zinc/11/48/39/643114839.db2.gz LMVPGBRNEFMSSA-OAHLLOKOSA-N 0 3 275.323 2.663 20 10 CFCDHN COc1ccccc1[C@@H](CO)NCc1ccc(C)cc1O ZINC000877040726 643116406 /nfs/dbraw/zinc/11/64/06/643116406.db2.gz FHCCJAKAKBINED-OAHLLOKOSA-N 0 3 287.359 2.532 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877045355 643118560 /nfs/dbraw/zinc/11/85/60/643118560.db2.gz AQFJAGCAEMEJHD-HNNXBMFYSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2ccsc2)c([O-])c1 ZINC000877049099 643120742 /nfs/dbraw/zinc/12/07/42/643120742.db2.gz QGTJKTZKJUDQOV-CQSZACIVSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)CCC(C)C)c([O-])c1 ZINC000877050466 643121803 /nfs/dbraw/zinc/12/18/03/643121803.db2.gz NCGVDHYWQNRNIU-MRXNPFEDSA-N 0 3 265.397 2.977 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)C[C@@H](C)O)c([O-])c1 ZINC000877055095 643124312 /nfs/dbraw/zinc/12/43/12/643124312.db2.gz OSPPGQRCSUILKC-GFCCVEGCSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c([O-])c1 ZINC000877070833 643134687 /nfs/dbraw/zinc/13/46/87/643134687.db2.gz WXCDKUUEEUJKRS-FVQBIDKESA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](C)c1ccncc1 ZINC000877074627 643137431 /nfs/dbraw/zinc/13/74/31/643137431.db2.gz CKEIHWXLECJXDJ-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN CC[S@](=O)[C@H]1CCC[C@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877077313 643138748 /nfs/dbraw/zinc/13/87/48/643138748.db2.gz CJOZAKSGIOBPCL-AVYPCKFXSA-N 0 3 295.448 2.870 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877112955 643157929 /nfs/dbraw/zinc/15/79/29/643157929.db2.gz WDIPEBJIFLQQEG-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN CCC(CC)(CO)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877120811 643161701 /nfs/dbraw/zinc/16/17/01/643161701.db2.gz JGSKYELGKSBZIB-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000877139417 643174214 /nfs/dbraw/zinc/17/42/14/643174214.db2.gz NVAAQWNKAZWLQO-GDBMZVCRSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000877139417 643174218 /nfs/dbraw/zinc/17/42/18/643174218.db2.gz NVAAQWNKAZWLQO-GDBMZVCRSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000877167207 643184999 /nfs/dbraw/zinc/18/49/99/643184999.db2.gz QFBVKEYGJGUPCC-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000877167207 643185003 /nfs/dbraw/zinc/18/50/03/643185003.db2.gz QFBVKEYGJGUPCC-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[NH2+]CCCCOC(C)C)c([O-])c1 ZINC000877196849 643199241 /nfs/dbraw/zinc/19/92/41/643199241.db2.gz LBOXLYDRRCARDV-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCCOC(C)C ZINC000877197114 643199318 /nfs/dbraw/zinc/19/93/18/643199318.db2.gz OUDMJJDHDQKNFK-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000877308940 643230762 /nfs/dbraw/zinc/23/07/62/643230762.db2.gz DRGBTPLJTZHXJK-UONOGXRCSA-N 0 3 263.381 2.995 20 10 CFCDHN COc1ccc(C[NH2+]C[C@@]2(C)CCCS2)c([O-])c1 ZINC000126495871 643254221 /nfs/dbraw/zinc/25/42/21/643254221.db2.gz CKXNUOJRYDSPSN-CQSZACIVSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000877395970 643258707 /nfs/dbraw/zinc/25/87/07/643258707.db2.gz PWLRLUUXYKOWPI-DLBZAZTESA-N 0 3 275.392 2.995 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCCC[C@H]1O ZINC000245617793 650826007 /nfs/dbraw/zinc/82/60/07/650826007.db2.gz NBBYAYRUDJGZMZ-GDBMZVCRSA-N 0 3 263.381 2.908 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCCC[C@H]1O ZINC000245617793 650826010 /nfs/dbraw/zinc/82/60/10/650826010.db2.gz NBBYAYRUDJGZMZ-GDBMZVCRSA-N 0 3 263.381 2.908 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000877486611 643302139 /nfs/dbraw/zinc/30/21/39/643302139.db2.gz OLCBYYJJADTKNA-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000877486611 643302141 /nfs/dbraw/zinc/30/21/41/643302141.db2.gz OLCBYYJJADTKNA-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530730 643335551 /nfs/dbraw/zinc/33/55/51/643335551.db2.gz GSURZGRJJGQLTI-SMDDNHRTSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530730 643335557 /nfs/dbraw/zinc/33/55/57/643335557.db2.gz GSURZGRJJGQLTI-SMDDNHRTSA-N 0 3 296.361 2.587 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877536611 643340353 /nfs/dbraw/zinc/34/03/53/643340353.db2.gz XCXMSBLLPMQYAP-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000877554602 643356047 /nfs/dbraw/zinc/35/60/47/643356047.db2.gz LWZXCAPJSHWQGY-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000877554602 643356049 /nfs/dbraw/zinc/35/60/49/643356049.db2.gz LWZXCAPJSHWQGY-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]([C@H](CO)C2CC2)C2CC2)c([O-])c1 ZINC000877566649 643366388 /nfs/dbraw/zinc/36/63/88/643366388.db2.gz LNJAOEOVZOJGJJ-WBVHZDCISA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]([C@@H](CO)C2CC2)C2CC2)c([O-])c1 ZINC000877566648 643366830 /nfs/dbraw/zinc/36/68/30/643366830.db2.gz LNJAOEOVZOJGJJ-RDJZCZTQSA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)C(C)(C)O ZINC000877575572 643372813 /nfs/dbraw/zinc/37/28/13/643372813.db2.gz YFRDVNSGEBWBKQ-UHFFFAOYSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCOC(C)(C)C1 ZINC000877578014 643375373 /nfs/dbraw/zinc/37/53/73/643375373.db2.gz QJWFXWDBGDQMIV-ZDUSSCGKSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(c3ccncn3)CC2)c([O-])c1 ZINC000877586616 643381372 /nfs/dbraw/zinc/38/13/72/643381372.db2.gz LSUXBTFCYLXZSA-UHFFFAOYSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1ccc(CN2C[C@H](C)OC3(CCC3)C2)c(O)c1 ZINC000877607791 643394867 /nfs/dbraw/zinc/39/48/67/643394867.db2.gz LSFNUWZWODCOMC-ZDUSSCGKSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(CN2C[C@@H](C)OCC23CCC3)c(O)c1 ZINC000877612885 643399144 /nfs/dbraw/zinc/39/91/44/643399144.db2.gz YPNZLYVFYWTAJU-CYBMUJFWSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCCN1CC(F)F ZINC000877650645 643432277 /nfs/dbraw/zinc/43/22/77/643432277.db2.gz CHRHIWNIBVIYEY-LBPRGKRZSA-N 0 3 284.350 2.520 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H]1CCSC1 ZINC000877662718 643439735 /nfs/dbraw/zinc/43/97/35/643439735.db2.gz XATHLCBLUJZHRK-GFCCVEGCSA-N 0 3 251.395 2.933 20 10 CFCDHN CC[C@]1(O)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000877691967 643457439 /nfs/dbraw/zinc/45/74/39/643457439.db2.gz YXHCZBDFNFXYQK-INIZCTEOSA-N 0 3 280.387 2.629 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cn(C)c2ncccc12 ZINC000877734053 643494476 /nfs/dbraw/zinc/49/44/76/643494476.db2.gz GWEXWVWORWJJIF-UHFFFAOYSA-N 0 3 295.386 2.920 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cn(C)c3ncccc23)c([O-])c1 ZINC000877733820 643494661 /nfs/dbraw/zinc/49/46/61/643494661.db2.gz BRAWQLPYMKNDOS-UHFFFAOYSA-N 0 3 295.386 2.920 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(C(C)(C)O)CC2)c([O-])c1 ZINC000877753697 643532661 /nfs/dbraw/zinc/53/26/61/643532661.db2.gz KQMWGCCFZOLHST-UHFFFAOYSA-N 0 3 293.407 2.774 20 10 CFCDHN COC(=O)c1[nH]c(C[NH2+][C@@H](C)c2ccccc2[O-])cc1C ZINC000877758176 643539025 /nfs/dbraw/zinc/53/90/25/643539025.db2.gz LQQZMABLSPURJY-NSHDSACASA-N 0 3 288.347 2.666 20 10 CFCDHN Cc1cccc(CN[C@@H](C)c2nccnc2C)c1O ZINC000877829256 643595006 /nfs/dbraw/zinc/59/50/06/643595006.db2.gz XPLQQVJIMOMKSI-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN CC(=O)Nc1ccccc1CN(C)Cc1ccccc1O ZINC000091974632 650912826 /nfs/dbraw/zinc/91/28/26/650912826.db2.gz NBYVEQRPPIRJAU-UHFFFAOYSA-N 0 3 284.359 2.983 20 10 CFCDHN C[N@H+](Cc1ccc(-n2cncn2)cc1)Cc1ccccc1[O-] ZINC000091974611 650913119 /nfs/dbraw/zinc/91/31/19/650913119.db2.gz UIPHBUKFRNYGAQ-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN C[N@@H+](Cc1ccc(-n2cncn2)cc1)Cc1ccccc1[O-] ZINC000091974611 650913121 /nfs/dbraw/zinc/91/31/21/650913121.db2.gz UIPHBUKFRNYGAQ-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN CCCCCNC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648781 644362690 /nfs/dbraw/zinc/36/26/90/644362690.db2.gz DLKYIKMFTKKQAA-CHWSQXEVSA-N 0 3 278.396 2.738 20 10 CFCDHN Cc1ccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000879651781 644364599 /nfs/dbraw/zinc/36/45/99/644364599.db2.gz KOAGLVVGPANNAO-AWEZNQCLSA-N 0 3 298.386 2.668 20 10 CFCDHN CC(C)CCNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651806 644364837 /nfs/dbraw/zinc/36/48/37/644364837.db2.gz LGJAUSWBYPRWJW-STQMWFEESA-N 0 3 278.396 2.594 20 10 CFCDHN CC(C)CCNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651805 644365121 /nfs/dbraw/zinc/36/51/21/644365121.db2.gz LGJAUSWBYPRWJW-QWHCGFSZSA-N 0 3 278.396 2.594 20 10 CFCDHN CCN(C)c1ccc(CN[C@@H](C)c2ccnn2C)cc1 ZINC000879687951 644381535 /nfs/dbraw/zinc/38/15/35/644381535.db2.gz YRUXUXRRDVFKIQ-ZDUSSCGKSA-N 0 3 272.396 2.727 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC[C@@H]2CO)cc1F ZINC000092470835 650920394 /nfs/dbraw/zinc/92/03/94/650920394.db2.gz VZYXASJHDAZIPS-CQSZACIVSA-N 0 3 280.387 2.629 20 10 CFCDHN CC[C@H](C)[C@H](O)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000248493587 650936606 /nfs/dbraw/zinc/93/66/06/650936606.db2.gz KDLBLLPUBFJICM-YWPYICTPSA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644260 650943676 /nfs/dbraw/zinc/94/36/76/650943676.db2.gz BTZDCOSOFDEULL-FZMZJTMJSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644260 650943678 /nfs/dbraw/zinc/94/36/78/650943678.db2.gz BTZDCOSOFDEULL-FZMZJTMJSA-N 0 3 282.815 2.960 20 10 CFCDHN CC[C@@H](O)CN(Cc1ccco1)Cc1ccccc1O ZINC000128423121 644706352 /nfs/dbraw/zinc/70/63/52/644706352.db2.gz CSIYWPPLVSLHHM-CQSZACIVSA-N 0 3 275.348 2.758 20 10 CFCDHN CCCN(CC(=O)N1CCCCC1)Cc1ccccc1O ZINC000130724050 645561192 /nfs/dbraw/zinc/56/11/92/645561192.db2.gz NXBURQDASWOZQP-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](CO)Cc2ccoc2)c([O-])c1 ZINC000883276553 645718022 /nfs/dbraw/zinc/71/80/22/645718022.db2.gz MJLPTDBVGHAGOJ-DZGCQCFKSA-N 0 3 289.375 2.795 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](CO)Cc1ccoc1)c1ccccc1[O-] ZINC000883277473 645718874 /nfs/dbraw/zinc/71/88/74/645718874.db2.gz ZZVJYPBXINKGKY-GDBMZVCRSA-N 0 3 289.375 2.877 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC3(CCC3)O2)c([O-])c1 ZINC000883365219 645771405 /nfs/dbraw/zinc/77/14/05/645771405.db2.gz WOAUYGAZOXNINB-HNNXBMFYSA-N 0 3 291.391 2.982 20 10 CFCDHN CCN(CC)c1ccc(CN(C)[C@@H]2CCOC2)cc1F ZINC000132080985 645875117 /nfs/dbraw/zinc/87/51/17/645875117.db2.gz SNZYGMHIMVNZPH-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN Cc1n[nH]c(CNCc2ccc(N(C)C)cc2C)c1C ZINC000885988884 646798296 /nfs/dbraw/zinc/79/82/96/646798296.db2.gz RBRHLCZDKHTBIZ-UHFFFAOYSA-N 0 3 272.396 2.691 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CC[C@@]2(CO[C@H](C)C2)O1)c1ccccc1[O-] ZINC000886764410 647130453 /nfs/dbraw/zinc/13/04/53/647130453.db2.gz SFIYPRKSBBUJSF-VWPFQQQWSA-N 0 3 291.391 2.769 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@@H]1CCCOC1 ZINC000886789659 647137478 /nfs/dbraw/zinc/13/74/78/647137478.db2.gz ZFPFTIDFRGMXDG-FMKPAKJESA-N 0 3 293.407 2.793 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@@H]1CCCOC1 ZINC000886789660 647137713 /nfs/dbraw/zinc/13/77/13/647137713.db2.gz ZFPFTIDFRGMXDG-LZWOXQAQSA-N 0 3 293.407 2.793 20 10 CFCDHN CC[C@@H](N[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1[O-] ZINC000925785753 648323360 /nfs/dbraw/zinc/32/33/60/648323360.db2.gz QOKDHJJDCPVMNR-OASPWFOLSA-N 0 3 268.788 2.694 20 10 CFCDHN C[N@H+](CCCc1cccnc1)Cc1ccccc1[O-] ZINC000929973305 649158186 /nfs/dbraw/zinc/15/81/86/649158186.db2.gz YLYDVXYXWDCQOL-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN C[N@@H+](CCCc1cccnc1)Cc1ccccc1[O-] ZINC000929973305 649158190 /nfs/dbraw/zinc/15/81/90/649158190.db2.gz YLYDVXYXWDCQOL-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN CCC[N@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000305781098 651077898 /nfs/dbraw/zinc/07/78/98/651077898.db2.gz UEHQODCOIGBMPK-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN CCC[N@@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000305781098 651077901 /nfs/dbraw/zinc/07/79/01/651077901.db2.gz UEHQODCOIGBMPK-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN CC[C@@](C)(CCO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000305782641 651078021 /nfs/dbraw/zinc/07/80/21/651078021.db2.gz PUEDZMBDARAWMX-AWEZNQCLSA-N 0 3 271.788 2.995 20 10 CFCDHN CC[C@H](CCC(=O)OC)C[N@H+](C)Cc1ccccc1[O-] ZINC001208787118 769940479 /nfs/dbraw/zinc/94/04/79/769940479.db2.gz ZUOUCIVSLOIDHE-CYBMUJFWSA-N 0 3 279.380 2.803 20 10 CFCDHN CC[C@H](CCC(=O)OC)C[N@@H+](C)Cc1ccccc1[O-] ZINC001208787118 769940487 /nfs/dbraw/zinc/94/04/87/769940487.db2.gz ZUOUCIVSLOIDHE-CYBMUJFWSA-N 0 3 279.380 2.803 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccnc2OC)c1 ZINC000037650442 770049773 /nfs/dbraw/zinc/04/97/73/770049773.db2.gz LCJTWOPNRPWFBN-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)CS(C)(=O)=O)c1ccccc1[O-] ZINC000723879926 770702671 /nfs/dbraw/zinc/70/26/71/770702671.db2.gz UPITXSMTDMQOQB-ZDUSSCGKSA-N 0 3 299.436 2.504 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C2CC2)[C@H]2CCCOC2)c1 ZINC000724011811 770749169 /nfs/dbraw/zinc/74/91/69/770749169.db2.gz SCAJJJKPFHCUJS-YOEHRIQHSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001140948213 775685159 /nfs/dbraw/zinc/68/51/59/775685159.db2.gz YJDFXXXBYOXLFY-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001140948213 775685164 /nfs/dbraw/zinc/68/51/64/775685164.db2.gz YJDFXXXBYOXLFY-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc2c(c1)CCN(Cc1cc(O)ccc1O)C2 ZINC001141162882 775969690 /nfs/dbraw/zinc/96/96/90/775969690.db2.gz IYHMNQOHCWDITP-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN COc1cc(CN2CCC[C@@H](C(F)F)C2)c(O)cc1O ZINC001231635727 777286571 /nfs/dbraw/zinc/28/65/71/777286571.db2.gz JABJYGXEMKKFDK-SECBINFHSA-N 0 3 287.306 2.584 20 10 CFCDHN Cc1cc(C)c(CN2CCN(c3ccccn3)CC2)c(O)c1 ZINC001231840972 777345335 /nfs/dbraw/zinc/34/53/35/777345335.db2.gz BIYCPAIKXLFPRK-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN Cc1cc(CN2CCc3cccc(O)c3C2)cc(C)n1 ZINC001232002286 777407986 /nfs/dbraw/zinc/40/79/86/777407986.db2.gz DKIJSWXCWURHFM-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN Cc1ncc(CN(C)Cc2ccc(N3CCCC3)cc2)[nH]1 ZINC001232462559 777567924 /nfs/dbraw/zinc/56/79/24/777567924.db2.gz RGPIOBMTXKJQOC-UHFFFAOYSA-N 0 3 284.407 2.950 20 10 CFCDHN CC[N@H+](Cc1c[nH]c2nccnc12)Cc1ccccc1[O-] ZINC001232548196 777599038 /nfs/dbraw/zinc/59/90/38/777599038.db2.gz ZMJULLFCLUDHGL-UHFFFAOYSA-N 0 3 282.347 2.637 20 10 CFCDHN CC[N@@H+](Cc1c[nH]c2nccnc12)Cc1ccccc1[O-] ZINC001232548196 777599042 /nfs/dbraw/zinc/59/90/42/777599042.db2.gz ZMJULLFCLUDHGL-UHFFFAOYSA-N 0 3 282.347 2.637 20 10 CFCDHN CN(C)c1ccc(C[N@H+](C)Cc2ccccc2[O-])c(O)c1 ZINC001232840646 777690662 /nfs/dbraw/zinc/69/06/62/777690662.db2.gz FDQZAINHVCSZNB-UHFFFAOYSA-N 0 3 286.375 2.796 20 10 CFCDHN CN(C)c1ccc(C[N@@H+](C)Cc2ccccc2[O-])c(O)c1 ZINC001232840646 777690665 /nfs/dbraw/zinc/69/06/65/777690665.db2.gz FDQZAINHVCSZNB-UHFFFAOYSA-N 0 3 286.375 2.796 20 10 CFCDHN CN(CCc1cccs1)Cc1cc(O)c(O)c(O)c1 ZINC001233013432 777764663 /nfs/dbraw/zinc/76/46/63/777764663.db2.gz QXZRHTSKVPBBGJ-UHFFFAOYSA-N 0 3 279.361 2.539 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)CC[C@H]2C)c1[O-] ZINC001233288096 777870580 /nfs/dbraw/zinc/87/05/80/777870580.db2.gz WGAQWUYQPLBRJI-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](CO)CC[C@H]2C)c1[O-] ZINC001233288096 777870586 /nfs/dbraw/zinc/87/05/86/777870586.db2.gz WGAQWUYQPLBRJI-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@H]1CC[N@H+]1Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727659 778057375 /nfs/dbraw/zinc/05/73/75/778057375.db2.gz NUUNVZCTWWHKLD-QMMMGPOBSA-N 0 3 261.243 2.885 20 10 CFCDHN C[C@H]1CC[N@@H+]1Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727659 778057362 /nfs/dbraw/zinc/05/73/62/778057362.db2.gz NUUNVZCTWWHKLD-QMMMGPOBSA-N 0 3 261.243 2.885 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3C[C@@H](O)C[C@H]3C)c2c1 ZINC001234525283 778243532 /nfs/dbraw/zinc/24/35/32/778243532.db2.gz DPEYGLWZOXMVQA-YPMHNXCESA-N 0 3 287.359 2.509 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3C[C@@H](O)C[C@H]3C)c2c1 ZINC001234525283 778243538 /nfs/dbraw/zinc/24/35/38/778243538.db2.gz DPEYGLWZOXMVQA-YPMHNXCESA-N 0 3 287.359 2.509 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@@]34CCOC4)c2c1 ZINC001234569743 778255545 /nfs/dbraw/zinc/25/55/45/778255545.db2.gz RVCTYKOCVYFWCY-SFHVURJKSA-N 0 3 299.370 2.919 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@@]34CCOC4)c2c1 ZINC001234569743 778255548 /nfs/dbraw/zinc/25/55/48/778255548.db2.gz RVCTYKOCVYFWCY-SFHVURJKSA-N 0 3 299.370 2.919 20 10 CFCDHN CCO[C@H](C)COc1ccc(N2CCN(CC)CC2)cc1 ZINC001234660260 778280629 /nfs/dbraw/zinc/28/06/29/778280629.db2.gz FMUKRPJKSYQTRM-OAHLLOKOSA-N 0 3 292.423 2.632 20 10 CFCDHN CN1CC2(C1)C[NH+](Cc1cccc(-c3ccccc3)c1[O-])C2 ZINC001234998313 778349271 /nfs/dbraw/zinc/34/92/71/778349271.db2.gz DYONYBUTXKZIHD-UHFFFAOYSA-N 0 3 294.398 2.807 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[NH2+][C@H]3C2)cc1Cl ZINC001235218364 778419653 /nfs/dbraw/zinc/41/96/53/778419653.db2.gz GAHBRMGRZNJDSO-RISCZKNCSA-N 0 3 280.799 2.538 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235674890 778532340 /nfs/dbraw/zinc/53/23/40/778532340.db2.gz IGKXUZJXYMZIFC-CYBMUJFWSA-N 0 3 291.391 2.685 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235674890 778532342 /nfs/dbraw/zinc/53/23/42/778532342.db2.gz IGKXUZJXYMZIFC-CYBMUJFWSA-N 0 3 291.391 2.685 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](O)C2)c([O-])c1 ZINC001235676824 778534125 /nfs/dbraw/zinc/53/41/25/778534125.db2.gz WBAMEMBLHAAOHI-CQSZACIVSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H](O)C2)c([O-])c1 ZINC001235676824 778534128 /nfs/dbraw/zinc/53/41/28/778534128.db2.gz WBAMEMBLHAAOHI-CQSZACIVSA-N 0 3 263.381 2.646 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)[NH2+]C[C@@H]2C)cc1Cl ZINC001236079797 778684019 /nfs/dbraw/zinc/68/40/19/778684019.db2.gz UYZUYYMTJKMOAO-QWRGUYRKSA-N 0 3 268.788 2.536 20 10 CFCDHN Cc1cc([O-])c(CN(C)C[C@@H]2CCC[NH2+]2)cc1Cl ZINC001236119567 778700839 /nfs/dbraw/zinc/70/08/39/778700839.db2.gz JUEBQOIZHNIVEJ-LBPRGKRZSA-N 0 3 268.788 2.538 20 10 CFCDHN CCC[C@@H]1C[NH2+]CCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001236133553 778707851 /nfs/dbraw/zinc/70/78/51/778707851.db2.gz ZFVYTCBYAREKIV-CYBMUJFWSA-N 0 3 282.815 2.928 20 10 CFCDHN [O-]c1c(O)cccc1C[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001168412637 778890196 /nfs/dbraw/zinc/89/01/96/778890196.db2.gz RWMMPZYZBVYOGJ-OAHLLOKOSA-N 0 3 287.334 2.884 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c([O-])c1 ZINC001236782676 778933273 /nfs/dbraw/zinc/93/32/73/778933273.db2.gz CUZHFSHGRYGVOM-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2CO)c([O-])c1 ZINC001236782676 778933276 /nfs/dbraw/zinc/93/32/76/778933276.db2.gz CUZHFSHGRYGVOM-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+](C)CC2CCOCC2)c([O-])c1 ZINC001236782584 778933312 /nfs/dbraw/zinc/93/33/12/778933312.db2.gz CSGWKGJBDQIOSI-UHFFFAOYSA-N 0 3 263.381 2.813 20 10 CFCDHN CCc1ccc(C[N@@H+](C)CC2CCOCC2)c([O-])c1 ZINC001236782584 778933314 /nfs/dbraw/zinc/93/33/14/778933314.db2.gz CSGWKGJBDQIOSI-UHFFFAOYSA-N 0 3 263.381 2.813 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](O)(CF)CC2)c([O-])c1 ZINC001236782234 778933603 /nfs/dbraw/zinc/93/36/03/778933603.db2.gz ACIUFHBXNIUKAE-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](O)(CF)CC2)c([O-])c1 ZINC001236782234 778933609 /nfs/dbraw/zinc/93/36/09/778933609.db2.gz ACIUFHBXNIUKAE-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+](CC)CCn2cccn2)c([O-])c1 ZINC001236791508 778936491 /nfs/dbraw/zinc/93/64/91/778936491.db2.gz HXDHRTZDSNGMLT-UHFFFAOYSA-N 0 3 273.380 2.673 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)CCn2cccn2)c([O-])c1 ZINC001236791508 778936496 /nfs/dbraw/zinc/93/64/96/778936496.db2.gz HXDHRTZDSNGMLT-UHFFFAOYSA-N 0 3 273.380 2.673 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](CCO)C2)c([O-])c1 ZINC001236794430 778939760 /nfs/dbraw/zinc/93/97/60/778939760.db2.gz MRHJJDUHLLNBMK-AWEZNQCLSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](CCO)C2)c([O-])c1 ZINC001236794430 778939764 /nfs/dbraw/zinc/93/97/64/778939764.db2.gz MRHJJDUHLLNBMK-AWEZNQCLSA-N 0 3 263.381 2.549 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001236810972 778947978 /nfs/dbraw/zinc/94/79/78/778947978.db2.gz MCPJYZRVVJXDFA-CYBMUJFWSA-N 0 3 277.364 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001236810972 778947982 /nfs/dbraw/zinc/94/79/82/778947982.db2.gz MCPJYZRVVJXDFA-CYBMUJFWSA-N 0 3 277.364 2.510 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236809034 778948950 /nfs/dbraw/zinc/94/89/50/778948950.db2.gz SRIWZTYQSZJFSY-QGZVFWFLSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236809034 778948953 /nfs/dbraw/zinc/94/89/53/778948953.db2.gz SRIWZTYQSZJFSY-QGZVFWFLSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(CN2CCC[C@@H]2c2cnccn2)c(O)c1 ZINC001236813933 778950607 /nfs/dbraw/zinc/95/06/07/778950607.db2.gz MXAXMKPETAFTFU-MRXNPFEDSA-N 0 3 299.374 2.836 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c([O-])c1 ZINC001236817714 778952423 /nfs/dbraw/zinc/95/24/23/778952423.db2.gz GEPGLZUXYZASDR-MJVIPROJSA-N 0 3 265.328 2.642 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c([O-])c1 ZINC001236817714 778952429 /nfs/dbraw/zinc/95/24/29/778952429.db2.gz GEPGLZUXYZASDR-MJVIPROJSA-N 0 3 265.328 2.642 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@H](O)C1 ZINC001236826812 778955007 /nfs/dbraw/zinc/95/50/07/778955007.db2.gz NDWBASCTFZVRTO-HNNXBMFYSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@H](O)C1 ZINC001236826812 778955012 /nfs/dbraw/zinc/95/50/12/778955012.db2.gz NDWBASCTFZVRTO-HNNXBMFYSA-N 0 3 257.333 2.502 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237045868 778997767 /nfs/dbraw/zinc/99/77/67/778997767.db2.gz MBJWOUYJEIMJBT-CQSZACIVSA-N 0 3 277.364 2.511 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237045868 778997771 /nfs/dbraw/zinc/99/77/71/778997771.db2.gz MBJWOUYJEIMJBT-CQSZACIVSA-N 0 3 277.364 2.511 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCc2cccnc2)c([O-])c1 ZINC001237044638 778997810 /nfs/dbraw/zinc/99/78/10/778997810.db2.gz QXFZQABSCQQJHM-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCc2cccnc2)c([O-])c1 ZINC001237044638 778997813 /nfs/dbraw/zinc/99/78/13/778997813.db2.gz QXFZQABSCQQJHM-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056725 779001928 /nfs/dbraw/zinc/00/19/28/779001928.db2.gz ZGFKZFMMXRRCOT-CQSZACIVSA-N 0 3 261.365 2.927 20 10 CFCDHN CC(=O)[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056725 779001936 /nfs/dbraw/zinc/00/19/36/779001936.db2.gz ZGFKZFMMXRRCOT-CQSZACIVSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[NH+]1CCN(Cc2c([O-])ccc(Cl)c2Cl)CC1 ZINC001237078518 779006757 /nfs/dbraw/zinc/00/67/57/779006757.db2.gz UBIYNEUFYLUUSM-UHFFFAOYSA-N 0 3 289.206 2.837 20 10 CFCDHN C[C@@H]1C[C@@H](O)CCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237141350 779025769 /nfs/dbraw/zinc/02/57/69/779025769.db2.gz VZGVYCUYPKTLBP-SKDRFNHKSA-N 0 3 289.297 2.756 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237383090 779088284 /nfs/dbraw/zinc/08/82/84/779088284.db2.gz OCZFZUAQWWFZGR-FZMZJTMJSA-N 0 3 280.799 2.620 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237404114 779097591 /nfs/dbraw/zinc/09/75/91/779097591.db2.gz NFYNCJBLHROBPT-BXUZGUMPSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@]2(C1)CCCCO2 ZINC001237486257 779117795 /nfs/dbraw/zinc/11/77/95/779117795.db2.gz ZTDCUIVCSHLPKI-INIZCTEOSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@]2(C1)CCCCO2 ZINC001237486257 779117798 /nfs/dbraw/zinc/11/77/98/779117798.db2.gz ZTDCUIVCSHLPKI-INIZCTEOSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC001237482525 779117843 /nfs/dbraw/zinc/11/78/43/779117843.db2.gz LKWYRIQUMAEUPI-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC001237482525 779117848 /nfs/dbraw/zinc/11/78/48/779117848.db2.gz LKWYRIQUMAEUPI-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(O)c1CN1CC[C@](C)(F)[C@@H](F)C1 ZINC001237484292 779117886 /nfs/dbraw/zinc/11/78/86/779117886.db2.gz ASDMTCVOIRQRGG-KBPBESRZSA-N 0 3 255.308 2.973 20 10 CFCDHN CO[C@H]1CCC[C@@H]2C[N@H+](Cc3c(C)cccc3[O-])C[C@@H]21 ZINC001237488212 779119529 /nfs/dbraw/zinc/11/95/29/779119529.db2.gz KBWNLYYCEXJTLN-KMFMINBZSA-N 0 3 275.392 2.948 20 10 CFCDHN CO[C@H]1CCC[C@@H]2C[N@@H+](Cc3c(C)cccc3[O-])C[C@@H]21 ZINC001237488212 779119531 /nfs/dbraw/zinc/11/95/31/779119531.db2.gz KBWNLYYCEXJTLN-KMFMINBZSA-N 0 3 275.392 2.948 20 10 CFCDHN CC(=O)N1CC[C@H]([N@@H+](Cc2c(C)cccc2[O-])C(C)C)C1 ZINC001237493398 779120377 /nfs/dbraw/zinc/12/03/77/779120377.db2.gz YALXBYUJLIACCU-HNNXBMFYSA-N 0 3 290.407 2.532 20 10 CFCDHN CC(=O)N1CC[C@H]([N@H+](Cc2c(C)cccc2[O-])C(C)C)C1 ZINC001237493398 779120383 /nfs/dbraw/zinc/12/03/83/779120383.db2.gz YALXBYUJLIACCU-HNNXBMFYSA-N 0 3 290.407 2.532 20 10 CFCDHN COCC[N@H+](C)Cc1cc(Br)c(C)cc1[O-] ZINC001237676494 779159581 /nfs/dbraw/zinc/15/95/81/779159581.db2.gz JIYABNFTJATDQB-UHFFFAOYSA-N 0 3 288.185 2.541 20 10 CFCDHN COCC[N@@H+](C)Cc1cc(Br)c(C)cc1[O-] ZINC001237676494 779159585 /nfs/dbraw/zinc/15/95/85/779159585.db2.gz JIYABNFTJATDQB-UHFFFAOYSA-N 0 3 288.185 2.541 20 10 CFCDHN [O-]c1ccc(-c2ccc(F)cc2)cc1C[NH+]1CC(CO)C1 ZINC001237645764 779155068 /nfs/dbraw/zinc/15/50/68/779155068.db2.gz KOYDRTBUUGOKQJ-UHFFFAOYSA-N 0 3 287.334 2.622 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)CC2)c1[O-] ZINC001237680884 779160089 /nfs/dbraw/zinc/16/00/89/779160089.db2.gz JEGSNPKLVSWHHB-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)CC2)c1[O-] ZINC001237680884 779160092 /nfs/dbraw/zinc/16/00/92/779160092.db2.gz JEGSNPKLVSWHHB-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2[C@@H](C)CC[C@H]2CO)c1[O-] ZINC001237681387 779161815 /nfs/dbraw/zinc/16/18/15/779161815.db2.gz OTJMKXFIMUGRMM-GWCFXTLKSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2[C@@H](C)CC[C@H]2CO)c1[O-] ZINC001237681387 779161820 /nfs/dbraw/zinc/16/18/20/779161820.db2.gz OTJMKXFIMUGRMM-GWCFXTLKSA-N 0 3 269.772 2.699 20 10 CFCDHN CN1CC2(C1)CC[NH+](Cc1cc(F)cc(Cl)c1[O-])CC2 ZINC001237800787 779182314 /nfs/dbraw/zinc/18/23/14/779182314.db2.gz BIAMYHSGZLBFCB-UHFFFAOYSA-N 0 3 298.789 2.712 20 10 CFCDHN C[NH+]1CCC2(CN(Cc3cc(F)c(Cl)cc3[O-])C2)CC1 ZINC001237950622 779214157 /nfs/dbraw/zinc/21/41/57/779214157.db2.gz YLYAALLVDBSSQU-UHFFFAOYSA-N 0 3 298.789 2.712 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](F)(CO)CC2)c1[O-] ZINC001238060248 779243194 /nfs/dbraw/zinc/24/31/94/779243194.db2.gz GRWJTSKHEHRJBB-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](F)(CO)CC2)c1[O-] ZINC001238060248 779243196 /nfs/dbraw/zinc/24/31/96/779243196.db2.gz GRWJTSKHEHRJBB-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN CC[N@H+](CCn1ccnc1)Cc1cc(F)cc(C)c1[O-] ZINC001238067434 779243991 /nfs/dbraw/zinc/24/39/91/779243991.db2.gz PDGMOELLYZOVGG-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN CC[N@@H+](CCn1ccnc1)Cc1cc(F)cc(C)c1[O-] ZINC001238067434 779243994 /nfs/dbraw/zinc/24/39/94/779243994.db2.gz PDGMOELLYZOVGG-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H](C)C2CCOCC2)c1[O-] ZINC000691433862 779401140 /nfs/dbraw/zinc/40/11/40/779401140.db2.gz JUTCJUPXXALLFS-LBPRGKRZSA-N 0 3 263.381 2.859 20 10 CFCDHN COc1cncc(C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000699876327 779405207 /nfs/dbraw/zinc/40/52/07/779405207.db2.gz GMUCNONAJOPWKQ-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)C[C@H]([NH3+])C2)cc1Cl ZINC001236051076 779449552 /nfs/dbraw/zinc/44/95/52/779449552.db2.gz VEIDVZJIZILJFC-SKDRFNHKSA-N 0 3 268.788 2.523 20 10 CFCDHN OCc1cccc(CNCc2ccc3c(c2)CCCO3)c1 ZINC000921697003 780175349 /nfs/dbraw/zinc/17/53/49/780175349.db2.gz FHCKWWLTYMMUCU-UHFFFAOYSA-N 0 3 283.371 2.794 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000700354883 780682100 /nfs/dbraw/zinc/68/21/00/780682100.db2.gz IWVVKDZZQAUHGX-INIZCTEOSA-N 0 3 269.344 2.623 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](OC)C(C)C)c1[O-] ZINC000072924656 346948916 /nfs/dbraw/zinc/94/89/16/346948916.db2.gz BKQAUNGIVSHQCC-CQSZACIVSA-N 0 3 267.369 2.552 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@H](CO)c1ccccc1 ZINC000295140819 199368495 /nfs/dbraw/zinc/36/84/95/199368495.db2.gz ZOCSFNGORQTWGW-OAHLLOKOSA-N 0 3 257.333 2.558 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@H](CO)c1ccccc1 ZINC000295140819 199368497 /nfs/dbraw/zinc/36/84/97/199368497.db2.gz ZOCSFNGORQTWGW-OAHLLOKOSA-N 0 3 257.333 2.558 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1 ZINC000067504320 346805729 /nfs/dbraw/zinc/80/57/29/346805729.db2.gz KHOISTPKZDMOEA-INIZCTEOSA-N 0 3 297.402 2.608 20 10 CFCDHN COc1cccc(CN[C@H](CCO)c2ccccc2)c1O ZINC000077468225 347193881 /nfs/dbraw/zinc/19/38/81/347193881.db2.gz HTNLKGCKLAYMDK-OAHLLOKOSA-N 0 3 287.359 2.614 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000093482968 347676345 /nfs/dbraw/zinc/67/63/45/347676345.db2.gz RUOFBPVMMQQVRG-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000093482968 347676347 /nfs/dbraw/zinc/67/63/47/347676347.db2.gz RUOFBPVMMQQVRG-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c1 ZINC000093837422 347685124 /nfs/dbraw/zinc/68/51/24/347685124.db2.gz LEACFJKVMNCTMB-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H](CO)C(C)(C)C)c1 ZINC000093837422 347685127 /nfs/dbraw/zinc/68/51/27/347685127.db2.gz LEACFJKVMNCTMB-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)CC2 ZINC000296045519 199764036 /nfs/dbraw/zinc/76/40/36/199764036.db2.gz QWWGUFFBFYHBMB-GOEBONIOSA-N 0 3 287.334 2.842 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](CO)c1ccccc1)CC2 ZINC000297938608 200306592 /nfs/dbraw/zinc/30/65/92/200306592.db2.gz YAPIVFRMFGDQSH-CVEARBPZSA-N 0 3 283.371 2.745 20 10 CFCDHN COc1ccc(N(C)C(=O)c2cccc3c2CCNC3)cc1 ZINC000317876801 541225361 /nfs/dbraw/zinc/22/53/61/541225361.db2.gz SNGHEBOJAVAMPH-UHFFFAOYSA-N 0 3 296.370 2.618 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2(N(C)C)CCCCC2)c1 ZINC000020094669 372230572 /nfs/dbraw/zinc/23/05/72/372230572.db2.gz FRPJMFKOXUQCKV-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN COCc1ccccc1C[NH2+]Cc1ccccc1[O-] ZINC000037762611 372699494 /nfs/dbraw/zinc/69/94/94/372699494.db2.gz ZQHMMQQZLCKLMJ-UHFFFAOYSA-N 0 3 257.333 2.828 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000037644186 372681753 /nfs/dbraw/zinc/68/17/53/372681753.db2.gz CWFPHBPKDKSFLN-KBPBESRZSA-N 0 3 262.397 2.693 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000038014009 372767867 /nfs/dbraw/zinc/76/78/67/372767867.db2.gz JLFAFHFXZNIKRF-OLZOCXBDSA-N 0 3 278.396 2.656 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000038013870 372768934 /nfs/dbraw/zinc/76/89/34/372768934.db2.gz QTYUKHKMTPEAMA-QWHCGFSZSA-N 0 3 278.396 2.656 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccncc2)c1 ZINC000048261742 373156406 /nfs/dbraw/zinc/15/64/06/373156406.db2.gz AAAGWRHADKWQNA-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN CCCCOCCC[NH2+]Cc1cccc(OC)c1[O-] ZINC000083495521 374747984 /nfs/dbraw/zinc/74/79/84/374747984.db2.gz QMYYQNIEAWHPJU-UHFFFAOYSA-N 0 3 267.369 2.697 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000091964600 375074045 /nfs/dbraw/zinc/07/40/45/375074045.db2.gz JRUAVFCHXLPFEK-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000091964600 375074049 /nfs/dbraw/zinc/07/40/49/375074049.db2.gz JRUAVFCHXLPFEK-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN C[N@H+](Cc1c[nH]nc1-c1cccnc1)Cc1ccccc1[O-] ZINC000091974594 375074243 /nfs/dbraw/zinc/07/42/43/375074243.db2.gz KOCWXXNMJUVOSV-UHFFFAOYSA-N 0 3 294.358 2.809 20 10 CFCDHN C[N@@H+](Cc1c[nH]nc1-c1cccnc1)Cc1ccccc1[O-] ZINC000091974594 375074249 /nfs/dbraw/zinc/07/42/49/375074249.db2.gz KOCWXXNMJUVOSV-UHFFFAOYSA-N 0 3 294.358 2.809 20 10 CFCDHN Cc1cc(O)c(CN2CC[C@](O)(C(F)(F)F)C2)cc1C ZINC000093611762 375275216 /nfs/dbraw/zinc/27/52/16/375275216.db2.gz LHXLXALMPIVLSD-CYBMUJFWSA-N 0 3 289.297 2.508 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2CSC)c1[O-] ZINC000093761321 375307972 /nfs/dbraw/zinc/30/79/72/375307972.db2.gz CSILISQQIRYMLH-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2CSC)c1[O-] ZINC000093761321 375307977 /nfs/dbraw/zinc/30/79/77/375307977.db2.gz CSILISQQIRYMLH-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(CN2CCS[C@H](C)[C@H]2C)c1O ZINC000093501200 375256689 /nfs/dbraw/zinc/25/66/89/375256689.db2.gz HWVPPRDKPLQABP-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@H](C)[C@H]2C)c1[O-] ZINC000093501200 375256692 /nfs/dbraw/zinc/25/66/92/375256692.db2.gz HWVPPRDKPLQABP-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@H](C)[C@H]2C)c1[O-] ZINC000093501200 375256697 /nfs/dbraw/zinc/25/66/97/375256697.db2.gz HWVPPRDKPLQABP-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[NH2+]CCOC2CCCCC2)c1[O-] ZINC000111607897 375856979 /nfs/dbraw/zinc/85/69/79/375856979.db2.gz YGZQDZDSVNRQQT-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CC1([NH2+]Cc2cc3c(cc2[O-])OCO3)Cc2ccccc2C1 ZINC000125400857 377152533 /nfs/dbraw/zinc/15/25/33/377152533.db2.gz WIDVEEJZEVQUQO-UHFFFAOYSA-N 0 3 297.354 2.768 20 10 CFCDHN CN1CCCc2cc(CNCC3=CCCOC3)ccc21 ZINC000126881218 377252063 /nfs/dbraw/zinc/25/20/63/377252063.db2.gz DMBRVMUGDAHGRN-UHFFFAOYSA-N 0 3 272.392 2.505 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](C)SC)c1[O-] ZINC000128010828 377312459 /nfs/dbraw/zinc/31/24/59/377312459.db2.gz UZNJRKLUHUWFCJ-SNVBAGLBSA-N 0 3 255.383 2.632 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C[C@H]2CCOC2)C2CC2)c1 ZINC000130034982 377503610 /nfs/dbraw/zinc/50/36/10/377503610.db2.gz QPCUVZMIBPENOD-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C[C@H]2CCOC2)C2CC2)c1 ZINC000130034982 377503615 /nfs/dbraw/zinc/50/36/15/377503615.db2.gz QPCUVZMIBPENOD-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC1(CO)CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000129817214 377476863 /nfs/dbraw/zinc/47/68/63/377476863.db2.gz KKKXDYOHGLFGKV-UHFFFAOYSA-N 0 3 294.414 2.876 20 10 CFCDHN C[C@@H]1C[C@@H](N(C)Cc2c([O-])cccc2Cl)CC[N@@H+]1C ZINC000130657748 377590458 /nfs/dbraw/zinc/59/04/58/377590458.db2.gz AUSXKDQBBUEAHV-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@@H](N(C)Cc2c([O-])cccc2Cl)CC[N@H+]1C ZINC000130657748 377590464 /nfs/dbraw/zinc/59/04/64/377590464.db2.gz AUSXKDQBBUEAHV-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@@H]([N@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657748 377590467 /nfs/dbraw/zinc/59/04/67/377590467.db2.gz AUSXKDQBBUEAHV-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@@H]([N@@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657748 377590475 /nfs/dbraw/zinc/59/04/75/377590475.db2.gz AUSXKDQBBUEAHV-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCO[C@]2(CCSC2)C1 ZINC000133999936 377975311 /nfs/dbraw/zinc/97/53/11/377975311.db2.gz JVZOJUPKLUVYPO-DZGCQCFKSA-N 0 3 279.405 2.537 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000134233385 377995478 /nfs/dbraw/zinc/99/54/78/377995478.db2.gz IFAGSPKLNRSHIS-UHFFFAOYSA-N 0 3 255.317 2.617 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733574 378161574 /nfs/dbraw/zinc/16/15/74/378161574.db2.gz HDXKOYNSEMNGBA-AAEUAGOBSA-N 0 3 278.396 2.736 20 10 CFCDHN CC[C@@H](NCc1ccnn1C)c1ccc(N(C)C)cc1 ZINC000152194560 378402269 /nfs/dbraw/zinc/40/22/69/378402269.db2.gz NDQGRPGUSIVTOI-MRXNPFEDSA-N 0 3 272.396 2.727 20 10 CFCDHN CN(C)C[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000153147441 378477554 /nfs/dbraw/zinc/47/75/54/378477554.db2.gz DXOUAJNQSYEYFB-AWEZNQCLSA-N 0 3 284.403 2.929 20 10 CFCDHN CN(C)C[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000153147441 378477560 /nfs/dbraw/zinc/47/75/60/378477560.db2.gz DXOUAJNQSYEYFB-AWEZNQCLSA-N 0 3 284.403 2.929 20 10 CFCDHN CN(C)c1ccc(CN(C)Cc2cccn2C)cc1 ZINC000153288495 378484926 /nfs/dbraw/zinc/48/49/26/378484926.db2.gz SFHHLOJVGQDCIT-UHFFFAOYSA-N 0 3 257.381 2.723 20 10 CFCDHN CCCN1CCC([N@H+](C)Cc2ccccc2[O-])CC1 ZINC000179562003 380557327 /nfs/dbraw/zinc/55/73/27/380557327.db2.gz MLZWPNXIBVQOMN-UHFFFAOYSA-N 0 3 262.397 2.698 20 10 CFCDHN CCCN1CCC([N@@H+](C)Cc2ccccc2[O-])CC1 ZINC000179562003 380557329 /nfs/dbraw/zinc/55/73/29/380557329.db2.gz MLZWPNXIBVQOMN-UHFFFAOYSA-N 0 3 262.397 2.698 20 10 CFCDHN CCC[N@H+](C)C[C@@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180215302 380633600 /nfs/dbraw/zinc/63/36/00/380633600.db2.gz PCAYMTRDJSYXFE-ZDUSSCGKSA-N 0 3 280.387 2.695 20 10 CFCDHN CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180215302 380633601 /nfs/dbraw/zinc/63/36/01/380633601.db2.gz PCAYMTRDJSYXFE-ZDUSSCGKSA-N 0 3 280.387 2.695 20 10 CFCDHN C[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccccc1[O-] ZINC000179899435 380594601 /nfs/dbraw/zinc/59/46/01/380594601.db2.gz FSWLASCCKLYYGC-CXAGYDPISA-N 0 3 271.360 2.951 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000180187055 380629651 /nfs/dbraw/zinc/62/96/51/380629651.db2.gz QJMQNCDTHXEGSQ-UHFFFAOYSA-N 0 3 267.344 2.516 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2CSC)c1 ZINC000180534811 380672199 /nfs/dbraw/zinc/67/21/99/380672199.db2.gz JZSHVHYZBBSQKM-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H]2CSC)c1 ZINC000180534811 380672207 /nfs/dbraw/zinc/67/22/07/380672207.db2.gz JZSHVHYZBBSQKM-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@]3(CCOC3)C2)c1[O-] ZINC000180616284 380682942 /nfs/dbraw/zinc/68/29/42/380682942.db2.gz PHYLPYCTPKTSPZ-OAHLLOKOSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@]3(CCOC3)C2)c1[O-] ZINC000180616284 380682950 /nfs/dbraw/zinc/68/29/50/380682950.db2.gz PHYLPYCTPKTSPZ-OAHLLOKOSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1[O-] ZINC000180722953 380693042 /nfs/dbraw/zinc/69/30/42/380693042.db2.gz RJWXCLZZQFDWFB-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1[O-] ZINC000180722953 380693043 /nfs/dbraw/zinc/69/30/43/380693043.db2.gz RJWXCLZZQFDWFB-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@H](OCC(C)C)C2)c1 ZINC000180723196 380693186 /nfs/dbraw/zinc/69/31/86/380693186.db2.gz QEMBTYZBRVCRBP-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000180723196 380693191 /nfs/dbraw/zinc/69/31/91/380693191.db2.gz QEMBTYZBRVCRBP-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000180723196 380693194 /nfs/dbraw/zinc/69/31/94/380693194.db2.gz QEMBTYZBRVCRBP-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@](C)(O)C2)c1[O-] ZINC000180378189 380649077 /nfs/dbraw/zinc/64/90/77/380649077.db2.gz CBCNYNLGEUHWDP-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@](C)(O)C2)c1[O-] ZINC000180378189 380649083 /nfs/dbraw/zinc/64/90/83/380649083.db2.gz CBCNYNLGEUHWDP-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN CC(C)(C)CNC(=O)C(C)(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180868137 380708695 /nfs/dbraw/zinc/70/86/95/380708695.db2.gz ZXEODBWEVXXITP-UHFFFAOYSA-N 0 3 296.386 2.562 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2c(C)noc2C)c1 ZINC000182358147 381074448 /nfs/dbraw/zinc/07/44/48/381074448.db2.gz AULFYAKRWCECEI-JTQLQIEISA-N 0 3 290.363 2.899 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CCc1ccccc1 ZINC000182520755 381104167 /nfs/dbraw/zinc/10/41/67/381104167.db2.gz SQHFNUHNINFVOV-KRWDZBQOSA-N 0 3 285.387 2.818 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)CCc1ccccc1 ZINC000182520755 381104176 /nfs/dbraw/zinc/10/41/76/381104176.db2.gz SQHFNUHNINFVOV-KRWDZBQOSA-N 0 3 285.387 2.818 20 10 CFCDHN Cc1cccc(CNC(C)(C)C(=O)NCC(C)(C)C)c1O ZINC000182658014 381129900 /nfs/dbraw/zinc/12/99/00/381129900.db2.gz MSWAHDIFNGNXGZ-UHFFFAOYSA-N 0 3 292.423 2.731 20 10 CFCDHN Cc1cccc(C[NH2+]C(C)(C)C(=O)NCC(C)(C)C)c1[O-] ZINC000182658014 381129906 /nfs/dbraw/zinc/12/99/06/381129906.db2.gz MSWAHDIFNGNXGZ-UHFFFAOYSA-N 0 3 292.423 2.731 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295996548 381203153 /nfs/dbraw/zinc/20/31/53/381203153.db2.gz OABOZSRBBLDNDF-ZBFHGGJFSA-N 0 3 299.370 2.711 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000183420514 381270266 /nfs/dbraw/zinc/27/02/66/381270266.db2.gz PAPKADAAGQVLSK-CYBMUJFWSA-N 0 3 278.396 2.691 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183436280 381271073 /nfs/dbraw/zinc/27/10/73/381271073.db2.gz AGQIBNCQEWRLKN-MLGOLLRUSA-N 0 3 287.359 2.785 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)CC2 ZINC000296045516 381228418 /nfs/dbraw/zinc/22/84/18/381228418.db2.gz QWWGUFFBFYHBMB-GDBMZVCRSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccccc1[O-] ZINC000183623416 381296657 /nfs/dbraw/zinc/29/66/57/381296657.db2.gz DPPIYRQCTKJULR-RYUDHWBXSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)N1CCCC1 ZINC000296214835 381304992 /nfs/dbraw/zinc/30/49/92/381304992.db2.gz ZPMAVSQTYYBDDQ-GJZGRUSLSA-N 0 3 274.408 2.844 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccccc1[O-] ZINC000183487395 381277686 /nfs/dbraw/zinc/27/76/86/381277686.db2.gz DKQVDWWUYIFLOJ-MLGOLLRUSA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccccc1[O-] ZINC000183543806 381285279 /nfs/dbraw/zinc/28/52/79/381285279.db2.gz LDFBZFYDMKXVFI-KCXAZCMYSA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1ccccc1[O-] ZINC000183549105 381285315 /nfs/dbraw/zinc/28/53/15/381285315.db2.gz NMIGXHKNLQPSPP-AVGNSLFASA-N 0 3 260.381 2.668 20 10 CFCDHN CCCN(CC)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183541592 381285711 /nfs/dbraw/zinc/28/57/11/381285711.db2.gz XVKKPYOZTQBJDD-ZDUSSCGKSA-N 0 3 250.386 2.775 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCCCO)c1cc(F)ccc1[O-] ZINC000296637974 381483737 /nfs/dbraw/zinc/48/37/37/381483737.db2.gz XXDCBGODYNVJQJ-WDEREUQCSA-N 0 3 255.333 2.733 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@@H]1CCCCO1)CC2 ZINC000296574931 381456428 /nfs/dbraw/zinc/45/64/28/381456428.db2.gz VJPGWAJWVQHBQZ-KBPBESRZSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)CCCO)c1 ZINC000296662262 381497094 /nfs/dbraw/zinc/49/70/94/381497094.db2.gz ZXOVREROLOYBET-STQMWFEESA-N 0 3 251.370 2.760 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCOc1ncccc1F)CC2 ZINC000296763467 381532130 /nfs/dbraw/zinc/53/21/30/381532130.db2.gz KGKQELZGECWAFD-ZDUSSCGKSA-N 0 3 288.322 2.582 20 10 CFCDHN CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000297836853 381573762 /nfs/dbraw/zinc/57/37/62/381573762.db2.gz SEJDHMXNPZNZOA-RRFJBIMHSA-N 0 3 274.408 2.842 20 10 CFCDHN CC1(C)[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)[C@@H]2CCO[C@@H]21 ZINC000297965891 381576002 /nfs/dbraw/zinc/57/60/02/381576002.db2.gz ZPCGFIWRJNUONS-OJDYBEQGSA-N 0 3 273.376 2.783 20 10 CFCDHN Cc1nccn1CCCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297913847 381576026 /nfs/dbraw/zinc/57/60/26/381576026.db2.gz WTCRNLDGMHELLD-OAHLLOKOSA-N 0 3 285.391 2.954 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297562420 381565997 /nfs/dbraw/zinc/56/59/97/381565997.db2.gz GFQNAGKOCNUJNS-DOMZBBRYSA-N 0 3 285.391 2.810 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000371313473 381588323 /nfs/dbraw/zinc/58/83/23/381588323.db2.gz HQHZVPVFZNGSBH-KGLIPLIRSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000371313473 381588330 /nfs/dbraw/zinc/58/83/30/381588330.db2.gz HQHZVPVFZNGSBH-KGLIPLIRSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCc2cnn(C)c2)c1 ZINC000185313050 381593279 /nfs/dbraw/zinc/59/32/79/381593279.db2.gz XBKMCTJAMINLOY-ZDUSSCGKSA-N 0 3 273.380 2.718 20 10 CFCDHN CC(=O)N1CCC(C[NH2+][C@H](C)c2ccc(C)cc2[O-])CC1 ZINC000185377338 381617069 /nfs/dbraw/zinc/61/70/69/381617069.db2.gz JQCUOIMGOUFGNI-CYBMUJFWSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@@H]([NH2+]CC1(C)COC1)c1cc2c(cc1[O-])CCCC2 ZINC000185441841 381633994 /nfs/dbraw/zinc/63/39/94/381633994.db2.gz IAUBFIVYWMMNRA-GFCCVEGCSA-N 0 3 275.392 2.958 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)C[C@@H](C)O)c1 ZINC000185521060 381656422 /nfs/dbraw/zinc/65/64/22/381656422.db2.gz YQSKMEWFMZRABK-UPJWGTAASA-N 0 3 251.370 2.758 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](c2ccncn2)C1 ZINC000359908218 381672963 /nfs/dbraw/zinc/67/29/63/381672963.db2.gz XOGJHFCJMFNWQF-LBPRGKRZSA-N 0 3 287.338 2.701 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000359908218 381672968 /nfs/dbraw/zinc/67/29/68/381672968.db2.gz XOGJHFCJMFNWQF-LBPRGKRZSA-N 0 3 287.338 2.701 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCO[C@H]2CCOC2)c1 ZINC000185702245 381710670 /nfs/dbraw/zinc/71/06/70/381710670.db2.gz AWJXEIGQPGRVKN-KGLIPLIRSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCO[C@H]2CCOC2)c([O-])c1 ZINC000185705091 381710775 /nfs/dbraw/zinc/71/07/75/381710775.db2.gz CDWFXFYTDJPQNA-KBPBESRZSA-N 0 3 279.380 2.547 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000359995148 381717257 /nfs/dbraw/zinc/71/72/57/381717257.db2.gz ODPWNQAYPNBEQH-UHFFFAOYSA-N 0 3 279.355 2.922 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000186444707 381913257 /nfs/dbraw/zinc/91/32/57/381913257.db2.gz LZTNXYFMIBJKJD-CHWSQXEVSA-N 0 3 292.379 2.582 20 10 CFCDHN Cc1nc(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)no1 ZINC000373125322 381933756 /nfs/dbraw/zinc/93/37/56/381933756.db2.gz NJEDCKKBLSWHPB-UHFFFAOYSA-N 0 3 291.326 2.602 20 10 CFCDHN CC[C@@H]([NH2+]C1(CO)Cc2ccccc2C1)c1ccccc1[O-] ZINC000373454715 382007495 /nfs/dbraw/zinc/00/74/95/382007495.db2.gz SGMZLACSEYJJTB-QGZVFWFLSA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000375978045 382113208 /nfs/dbraw/zinc/11/32/08/382113208.db2.gz VZGWUMOTEOHNHN-HOCLYGCPSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@]2(CCOC2)C1 ZINC000375978045 382113212 /nfs/dbraw/zinc/11/32/12/382113212.db2.gz VZGWUMOTEOHNHN-HOCLYGCPSA-N 0 3 261.365 2.956 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@]3(CCCCO3)C2)c1 ZINC000376109899 382120128 /nfs/dbraw/zinc/12/01/28/382120128.db2.gz GCRGMNJCMZEGKU-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@]3(CCCCO3)C2)c1 ZINC000376109899 382120136 /nfs/dbraw/zinc/12/01/36/382120136.db2.gz GCRGMNJCMZEGKU-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@]23CCOC3)cc1C ZINC000375311563 382078819 /nfs/dbraw/zinc/07/88/19/382078819.db2.gz VNXQBURHBCHCJK-MRXNPFEDSA-N 0 3 261.365 2.764 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@]23CCOC3)cc1C ZINC000375311563 382078827 /nfs/dbraw/zinc/07/88/27/382078827.db2.gz VNXQBURHBCHCJK-MRXNPFEDSA-N 0 3 261.365 2.764 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(OC)c1[O-])C(C)(C)O ZINC000293574513 382180920 /nfs/dbraw/zinc/18/09/20/382180920.db2.gz HHBXPUZOGDCVMX-LBPRGKRZSA-N 0 3 287.787 2.693 20 10 CFCDHN Cc1cccc(C[NH2+]C2(C3CC3)CCOCC2)c1[O-] ZINC000376385143 382132484 /nfs/dbraw/zinc/13/24/84/382132484.db2.gz KDNSAMDHDPFQSL-UHFFFAOYSA-N 0 3 261.365 2.749 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(O)CCCC2(C)C)c1[O-] ZINC000293524498 382158913 /nfs/dbraw/zinc/15/89/13/382158913.db2.gz BHRVJBGWVRUODW-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1cccc(OCC)c1[O-])OC ZINC000293615724 382197219 /nfs/dbraw/zinc/19/72/19/382197219.db2.gz HZIBADZZZNZWJD-CYBMUJFWSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]1Cn1cncn1 ZINC000377694613 382321922 /nfs/dbraw/zinc/32/19/22/382321922.db2.gz HBGXVTSHEOTEIY-UKRRQHHQSA-N 0 3 286.379 2.599 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]1Cn1cncn1 ZINC000377694613 382321925 /nfs/dbraw/zinc/32/19/25/382321925.db2.gz HBGXVTSHEOTEIY-UKRRQHHQSA-N 0 3 286.379 2.599 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@]2(CO)CC(C)C)c1[O-] ZINC000188040507 382331788 /nfs/dbraw/zinc/33/17/88/382331788.db2.gz KZNBXHLXUUMPGQ-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@]2(CO)CC(C)C)c1[O-] ZINC000188040507 382331792 /nfs/dbraw/zinc/33/17/92/382331792.db2.gz KZNBXHLXUUMPGQ-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000188121078 382349404 /nfs/dbraw/zinc/34/94/04/382349404.db2.gz YDTSTUYRRTUXEM-RYUDHWBXSA-N 0 3 263.381 2.957 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](C)[C@H](OC)C2)c1[O-] ZINC000188319637 382392326 /nfs/dbraw/zinc/39/23/26/382392326.db2.gz FSQOEUOQLISKKJ-IUODEOHRSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](C)[C@H](OC)C2)c1[O-] ZINC000188319637 382392330 /nfs/dbraw/zinc/39/23/30/382392330.db2.gz FSQOEUOQLISKKJ-IUODEOHRSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(CN[C@@H]2CN(C)Cc3ccccc32)c1O ZINC000378268645 382426940 /nfs/dbraw/zinc/42/69/40/382426940.db2.gz GJJILRHUPDHPRB-MRXNPFEDSA-N 0 3 298.386 2.677 20 10 CFCDHN Cc1cnn(C)c1CNCc1c(C)c2ccccc2n1C ZINC000352702976 382451176 /nfs/dbraw/zinc/45/11/76/382451176.db2.gz DNMZZWRSBZJWGJ-UHFFFAOYSA-N 0 3 282.391 2.818 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCOC[C@@H](C)C2)c1[O-] ZINC000378445760 382462507 /nfs/dbraw/zinc/46/25/07/382462507.db2.gz WHZRAXAFDBKZOG-JTQLQIEISA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCOC[C@@H](C)C2)c1[O-] ZINC000378445760 382462510 /nfs/dbraw/zinc/46/25/10/382462510.db2.gz WHZRAXAFDBKZOG-JTQLQIEISA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000294228624 382468404 /nfs/dbraw/zinc/46/84/04/382468404.db2.gz ZDKSPFCWTIBYTH-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000294228624 382468405 /nfs/dbraw/zinc/46/84/05/382468405.db2.gz ZDKSPFCWTIBYTH-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN C[C@H]1CCC[N@@H+]1C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000378495724 382472850 /nfs/dbraw/zinc/47/28/50/382472850.db2.gz MFYZPAYXXMAMPR-ZDUSSCGKSA-N 0 3 292.398 2.980 20 10 CFCDHN C[C@H]1CCC[N@H+]1C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000378495724 382472854 /nfs/dbraw/zinc/47/28/54/382472854.db2.gz MFYZPAYXXMAMPR-ZDUSSCGKSA-N 0 3 292.398 2.980 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC(CF)CC2)c1 ZINC000294973958 382558469 /nfs/dbraw/zinc/55/84/69/382558469.db2.gz GBHRQYNSXJGHNM-UHFFFAOYSA-N 0 3 253.317 2.582 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C2(C(=O)N(C)C)CCCCC2)c1 ZINC000294970850 382558652 /nfs/dbraw/zinc/55/86/52/382558652.db2.gz IZIZMFQQRFATBJ-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H]2CCN(C)C[C@H]21 ZINC000367356657 382565172 /nfs/dbraw/zinc/56/51/72/382565172.db2.gz OYAROLZODOVTOM-NUEKZKHPSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H]2CCN(C)C[C@H]21 ZINC000367356657 382565174 /nfs/dbraw/zinc/56/51/74/382565174.db2.gz OYAROLZODOVTOM-NUEKZKHPSA-N 0 3 274.408 2.869 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CC2=CCCCC2)cc1OC ZINC000295205895 382583630 /nfs/dbraw/zinc/58/36/30/382583630.db2.gz ZHGKJXBSVHJZAF-UHFFFAOYSA-N 0 3 277.364 2.999 20 10 CFCDHN C[C@@](O)(CC[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000189827956 382642198 /nfs/dbraw/zinc/64/21/98/382642198.db2.gz JQZUXLXNIKMPBE-QGZVFWFLSA-N 0 3 271.360 2.780 20 10 CFCDHN CCC(C)(C)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000189994431 382649464 /nfs/dbraw/zinc/64/94/64/382649464.db2.gz UMELYKNMDGMUEK-UHFFFAOYSA-N 0 3 251.326 2.647 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCCC[C@H]2O)c1 ZINC000246992580 383129515 /nfs/dbraw/zinc/12/95/15/383129515.db2.gz MQVRLCKZQXJFEJ-YWPYICTPSA-N 0 3 279.380 2.603 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252667044 383425758 /nfs/dbraw/zinc/42/57/58/383425758.db2.gz FUTNSQFPRSRGDW-KGLIPLIRSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252667044 383425763 /nfs/dbraw/zinc/42/57/63/383425763.db2.gz FUTNSQFPRSRGDW-KGLIPLIRSA-N 0 3 280.799 2.762 20 10 CFCDHN C[C@@H](CO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000266125737 384086217 /nfs/dbraw/zinc/08/62/17/384086217.db2.gz BGCBGOCOBJYCHP-LBPRGKRZSA-N 0 3 257.333 2.530 20 10 CFCDHN CCC1(C[NH2+]Cc2cccc(OC)c2[O-])CCOCC1 ZINC000266633116 384212415 /nfs/dbraw/zinc/21/24/15/384212415.db2.gz QOYFUUQMRYYBSP-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NC[C@H](O)C(F)(F)F)cc1 ZINC000268859541 384680109 /nfs/dbraw/zinc/68/01/09/384680109.db2.gz RPOJTFAIYRBOAV-GWCFXTLKSA-N 0 3 290.329 2.717 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000268999966 384708478 /nfs/dbraw/zinc/70/84/78/384708478.db2.gz ZFSGKMVXCPTFNL-AWEZNQCLSA-N 0 3 261.365 2.892 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000281385970 385192561 /nfs/dbraw/zinc/19/25/61/385192561.db2.gz WMIILUIGOGJPLX-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000281385970 385192566 /nfs/dbraw/zinc/19/25/66/385192566.db2.gz WMIILUIGOGJPLX-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@H](NCc1ccc(OC)c(C)c1)[C@H](O)C(F)(F)F ZINC000270864468 385251107 /nfs/dbraw/zinc/25/11/07/385251107.db2.gz FAPZZNBYJNYOIO-AAEUAGOBSA-N 0 3 291.313 2.795 20 10 CFCDHN CC[C@@H]([NH2+]CC1([S@@](C)=O)CC1)c1ccc(C)cc1[O-] ZINC000282411494 385303886 /nfs/dbraw/zinc/30/38/86/385303886.db2.gz SDTYSTDNZIABCR-BFUOFWGJSA-N 0 3 281.421 2.652 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1ccccc1[O-] ZINC000271720842 385389239 /nfs/dbraw/zinc/38/92/39/385389239.db2.gz XROWGIXGPNXCNB-CYBMUJFWSA-N 0 3 298.386 2.945 20 10 CFCDHN CCSCCC[NH2+]Cc1cc(OC)c(OC)cc1[O-] ZINC000282572986 385343920 /nfs/dbraw/zinc/34/39/20/385343920.db2.gz UGLPVTQHSFZNRD-UHFFFAOYSA-N 0 3 285.409 2.642 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC000271735315 385390264 /nfs/dbraw/zinc/39/02/64/385390264.db2.gz OKJSLUQPGFGAPK-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC000271735315 385390269 /nfs/dbraw/zinc/39/02/69/385390269.db2.gz OKJSLUQPGFGAPK-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](OC)C2)cc1 ZINC000271198659 385373116 /nfs/dbraw/zinc/37/31/16/385373116.db2.gz SOCZIEWGCIYDQC-INIZCTEOSA-N 0 3 262.397 2.754 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC3(C2)CCOCC3)c1 ZINC000271228149 385377649 /nfs/dbraw/zinc/37/76/49/385377649.db2.gz SDOUERFKUMVXPC-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC3(C2)CCOCC3)c1 ZINC000271228149 385377652 /nfs/dbraw/zinc/37/76/52/385377652.db2.gz SDOUERFKUMVXPC-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C2(C)CCCC2)cc1OC ZINC000271773112 385390893 /nfs/dbraw/zinc/39/08/93/385390893.db2.gz CMHZTEPPQNCQIF-UHFFFAOYSA-N 0 3 265.353 2.832 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](CCCO)Cc1ccccc1 ZINC000272296020 385501684 /nfs/dbraw/zinc/50/16/84/385501684.db2.gz OVAUXRDFVJNGST-UHFFFAOYSA-N 0 3 289.350 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](CCCO)Cc1ccccc1 ZINC000272296020 385501687 /nfs/dbraw/zinc/50/16/87/385501687.db2.gz OVAUXRDFVJNGST-UHFFFAOYSA-N 0 3 289.350 2.916 20 10 CFCDHN Cc1cc(C)c([C@H](C)NCc2ccnn2C)c(O)c1 ZINC000283691643 385489927 /nfs/dbraw/zinc/48/99/27/385489927.db2.gz AHXNKMSRKCNOMJ-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]Cc2ccnn2C)c([O-])c1 ZINC000283691643 385489933 /nfs/dbraw/zinc/48/99/33/385489933.db2.gz AHXNKMSRKCNOMJ-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN COc1ccc(N2CCN(CCCCCF)CC2)cc1 ZINC000284121571 385537331 /nfs/dbraw/zinc/53/73/31/385537331.db2.gz NPZUMEUQJYKCPQ-UHFFFAOYSA-N 0 3 280.387 2.957 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c1 ZINC000284128869 385538962 /nfs/dbraw/zinc/53/89/62/385538962.db2.gz CUIIYILSWRCCRB-WOSRLPQWSA-N 0 3 295.423 2.509 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCO[C@@H]2c2cccnc2)c1[O-] ZINC000284510473 385549094 /nfs/dbraw/zinc/54/90/94/385549094.db2.gz DTKQJSMQTFILFM-DOTOQJQBSA-N 0 3 284.359 2.715 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnn(C)c2)c([O-])c1 ZINC000284199495 385546200 /nfs/dbraw/zinc/54/62/00/385546200.db2.gz SAMANDDVEPLEHT-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@@H](C)NCc2cnn(C)c2)c(O)c1 ZINC000284199495 385546206 /nfs/dbraw/zinc/54/62/06/385546206.db2.gz SAMANDDVEPLEHT-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]Cc2cnn(C)c2)c([O-])c1 ZINC000284199505 385546212 /nfs/dbraw/zinc/54/62/12/385546212.db2.gz SAMANDDVEPLEHT-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@H](C)NCc2cnn(C)c2)c(O)c1 ZINC000284199505 385546215 /nfs/dbraw/zinc/54/62/15/385546215.db2.gz SAMANDDVEPLEHT-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)CCCO)c([O-])c1 ZINC000284311443 385547018 /nfs/dbraw/zinc/54/70/18/385547018.db2.gz ZHKFDOLPAFKQKE-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCn2cccn2)c([O-])c1 ZINC000284321468 385547419 /nfs/dbraw/zinc/54/74/19/385547419.db2.gz ZVSAQJSSZHLEHK-AWEZNQCLSA-N 0 3 273.380 2.946 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c1ccccc1[O-] ZINC000284337544 385547854 /nfs/dbraw/zinc/54/78/54/385547854.db2.gz MPFQYADJLYAZPA-INWMFGNUSA-N 0 3 295.423 2.591 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284948097 385551691 /nfs/dbraw/zinc/55/16/91/385551691.db2.gz HMGKDKPSRYJBRW-GOEBONIOSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284948097 385551696 /nfs/dbraw/zinc/55/16/96/385551696.db2.gz HMGKDKPSRYJBRW-GOEBONIOSA-N 0 3 277.364 2.544 20 10 CFCDHN Cc1c(C[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])cnn1C ZINC000285067691 385551714 /nfs/dbraw/zinc/55/17/14/385551714.db2.gz JCFQEUXRRTUCLB-LBPRGKRZSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000285320335 385554525 /nfs/dbraw/zinc/55/45/25/385554525.db2.gz WXGNAFFLJHMCFM-HUUCEWRRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000285320335 385554527 /nfs/dbraw/zinc/55/45/27/385554527.db2.gz WXGNAFFLJHMCFM-HUUCEWRRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1 ZINC000285414317 385555715 /nfs/dbraw/zinc/55/57/15/385555715.db2.gz XXAKQANZCZCTDM-MFKMUULPSA-N 0 3 291.313 2.973 20 10 CFCDHN C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)c1ccccc1[O-] ZINC000272824585 385624836 /nfs/dbraw/zinc/62/48/36/385624836.db2.gz GLEKJVDOQWZJSL-XUJVJEKNSA-N 0 3 260.381 2.526 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1 ZINC000273167240 385671665 /nfs/dbraw/zinc/67/16/65/385671665.db2.gz LQOLSAHNUQAXPI-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1ccc([C@H](C)NC[C@H](O)C(F)(F)F)c(O)c1C ZINC000273306111 385676803 /nfs/dbraw/zinc/67/68/03/385676803.db2.gz CWMKCMMHPHBHAC-ONGXEEELSA-N 0 3 277.286 2.583 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCn2ccnc2)c([O-])c1C ZINC000273443805 385682610 /nfs/dbraw/zinc/68/26/10/385682610.db2.gz ZGRQPNCZCMFFFT-CQSZACIVSA-N 0 3 273.380 2.946 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCOc2ncccc2F)c1 ZINC000273452904 385685232 /nfs/dbraw/zinc/68/52/32/385685232.db2.gz GNVZGWJILHKHCR-GFCCVEGCSA-N 0 3 290.338 2.964 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273563053 385687527 /nfs/dbraw/zinc/68/75/27/385687527.db2.gz ISKCXXMIQRXANK-CYBMUJFWSA-N 0 3 273.380 2.865 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CCN(C)C)c([O-])c1C ZINC000273562989 385687916 /nfs/dbraw/zinc/68/79/16/385687916.db2.gz IRANUBBEIBKAAB-OCCSQVGLSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@]2(N(C)C)CCSC2)c([O-])c1 ZINC000273570642 385689343 /nfs/dbraw/zinc/68/93/43/385689343.db2.gz KOXZBBBPXWUYEJ-CZUORRHYSA-N 0 3 294.464 2.789 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2O)c([O-])c1C ZINC000273574743 385689511 /nfs/dbraw/zinc/68/95/11/385689511.db2.gz LPLTZFXUXDOQPH-CFVMTHIKSA-N 0 3 263.381 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCNc2ccccn2)c1 ZINC000273582403 385689625 /nfs/dbraw/zinc/68/96/25/385689625.db2.gz MXFRREHPVRNYLE-LBPRGKRZSA-N 0 3 287.363 2.559 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CO[C@@H]2CCOC2)c([O-])c1C ZINC000273598688 385690597 /nfs/dbraw/zinc/69/05/97/385690597.db2.gz RKKVLFQEUVZJSK-AEGPPILISA-N 0 3 293.407 2.854 20 10 CFCDHN COCCCN(C)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273616667 385690982 /nfs/dbraw/zinc/69/09/82/385690982.db2.gz XOQKLEZLUFXWIN-HNNXBMFYSA-N 0 3 294.439 2.628 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)N(C)C)c([O-])c1C ZINC000273602726 385691004 /nfs/dbraw/zinc/69/10/04/385691004.db2.gz SHWXYHXPNZBABU-WCQYABFASA-N 0 3 250.386 2.610 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2cc(C)ccc2[O-])o1 ZINC000273612085 385691260 /nfs/dbraw/zinc/69/12/60/385691260.db2.gz WFIUXZBNHPXIKH-DOMZBBRYSA-N 0 3 275.348 2.986 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1c3ccccc3C[C@H]1O)CC2 ZINC000296225347 285397561 /nfs/dbraw/zinc/39/75/61/285397561.db2.gz AHEAWXPBPQQZEN-KYJSFNMBSA-N 0 3 281.355 2.627 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1COc3ccccc3C1)CC2 ZINC000297502539 285397629 /nfs/dbraw/zinc/39/76/29/285397629.db2.gz CAXUPQCMQDIIDL-LSDHHAIUSA-N 0 3 281.355 2.973 20 10 CFCDHN Oc1cccc2c1[C@H](N[C@H]1CCCc3c[nH]nc31)CC2 ZINC000296660793 285397658 /nfs/dbraw/zinc/39/76/58/285397658.db2.gz FEQNYVMBAGEHFP-OLZOCXBDSA-N 0 3 269.348 2.770 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CC(=O)N(C(C)(C)C)C2)c1 ZINC000186085951 393540612 /nfs/dbraw/zinc/54/06/12/393540612.db2.gz ZRWFSZPKKQNSKE-STQMWFEESA-N 0 3 290.407 2.751 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000374253855 393489166 /nfs/dbraw/zinc/48/91/66/393489166.db2.gz KKRVVMKWOGHIQM-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000374253855 393489169 /nfs/dbraw/zinc/48/91/69/393489169.db2.gz KKRVVMKWOGHIQM-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000374256319 393491219 /nfs/dbraw/zinc/49/12/19/393491219.db2.gz VGMFNYGWAOILLG-LSDHHAIUSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000374256319 393491221 /nfs/dbraw/zinc/49/12/21/393491221.db2.gz VGMFNYGWAOILLG-LSDHHAIUSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C)CC(C)(C)OC)c1 ZINC000119075924 393913568 /nfs/dbraw/zinc/91/35/68/393913568.db2.gz ZQYZORSNVHFQGK-NSHDSACASA-N 0 3 267.369 2.694 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000119714882 393924170 /nfs/dbraw/zinc/92/41/70/393924170.db2.gz NJTMLLCVMZZKAR-UHFFFAOYSA-N 0 3 295.379 2.542 20 10 CFCDHN CC[C@H](NCc1ccc(N(C)C)c(F)c1)c1cnn(C)c1 ZINC000122417286 393968747 /nfs/dbraw/zinc/96/87/47/393968747.db2.gz ONBLXLOHEHMMAW-HNNXBMFYSA-N 0 3 290.386 2.866 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(C)OCCCO2)c([O-])c1 ZINC000190644446 292246549 /nfs/dbraw/zinc/24/65/49/292246549.db2.gz IYFVTHNJJNFYSE-LBPRGKRZSA-N 0 3 265.353 2.504 20 10 CFCDHN COCCC1(C[NH2+][C@H](C)c2cc(OC)ccc2[O-])CC1 ZINC000186134074 292308616 /nfs/dbraw/zinc/30/86/16/292308616.db2.gz ZQBKSKSQFLOWNV-GFCCVEGCSA-N 0 3 279.380 2.868 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1ccccc1[O-] ZINC000020122208 171002764 /nfs/dbraw/zinc/00/27/64/171002764.db2.gz JTMWZKOOIZQYFU-TZMCWYRMSA-N 0 3 274.364 2.939 20 10 CFCDHN C[C@H](NCc1ccc(N(C)C)cc1)c1cccnc1 ZINC000020127436 171013211 /nfs/dbraw/zinc/01/32/11/171013211.db2.gz STCOYLMETHBERL-ZDUSSCGKSA-N 0 3 255.365 2.998 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)NCc1ccc(N(C)C)cc1 ZINC000020351383 171156237 /nfs/dbraw/zinc/15/62/37/171156237.db2.gz QSMDQQHMDSRBHO-GFCCVEGCSA-N 0 3 272.396 2.645 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cc(C)ccc2[O-])c1 ZINC000071408015 176156641 /nfs/dbraw/zinc/15/66/41/176156641.db2.gz DJVHJFABWJQJFJ-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCc2ccc(O)cc2)c1 ZINC000071408294 176156808 /nfs/dbraw/zinc/15/68/08/176156808.db2.gz SNRTWCNPNCNZBC-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN CCOc1cccc(CN[C@@H](C)c2cnn(C)c2C)c1O ZINC000037167729 260072562 /nfs/dbraw/zinc/07/25/62/260072562.db2.gz NFKFVWKBZIACHQ-NSHDSACASA-N 0 3 289.379 2.684 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCOCC[C@H]2C)c1 ZINC000367700888 267111237 /nfs/dbraw/zinc/11/12/37/267111237.db2.gz DRUSUHRPFYPQFJ-VXGBXAGGSA-N 0 3 265.353 2.573 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCOCC[C@H]2C)c1 ZINC000367700888 267111239 /nfs/dbraw/zinc/11/12/39/267111239.db2.gz DRUSUHRPFYPQFJ-VXGBXAGGSA-N 0 3 265.353 2.573 20 10 CFCDHN COc1cccc(C[NH+]2CCC([C@@H]3CCOC3)CC2)c1[O-] ZINC000368235841 267154913 /nfs/dbraw/zinc/15/49/13/267154913.db2.gz QWBFAKHWIPUWCT-OAHLLOKOSA-N 0 3 291.391 2.649 20 10 CFCDHN Cn1nccc1[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368404080 267170223 /nfs/dbraw/zinc/17/02/23/267170223.db2.gz UIFSFLCFVCGAMI-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1nccc1[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368404080 267170224 /nfs/dbraw/zinc/17/02/24/267170224.db2.gz UIFSFLCFVCGAMI-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000368657261 267194612 /nfs/dbraw/zinc/19/46/12/267194612.db2.gz AQOGTGDSLMYFQD-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000368657261 267194616 /nfs/dbraw/zinc/19/46/16/267194616.db2.gz AQOGTGDSLMYFQD-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000368667199 267196413 /nfs/dbraw/zinc/19/64/13/267196413.db2.gz QDGXCLZSISPYTE-CXAGYDPISA-N 0 3 293.407 2.802 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000368667199 267196414 /nfs/dbraw/zinc/19/64/14/267196414.db2.gz QDGXCLZSISPYTE-CXAGYDPISA-N 0 3 293.407 2.802 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000369875602 267273340 /nfs/dbraw/zinc/27/33/40/267273340.db2.gz VVZSFIJIPKGMAH-WBVHZDCISA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000369875602 267273342 /nfs/dbraw/zinc/27/33/42/267273342.db2.gz VVZSFIJIPKGMAH-WBVHZDCISA-N 0 3 291.391 2.552 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000370723366 267342217 /nfs/dbraw/zinc/34/22/17/267342217.db2.gz VLOLMGFUNLOHKF-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000370723366 267342220 /nfs/dbraw/zinc/34/22/20/267342220.db2.gz VLOLMGFUNLOHKF-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc(C[NH+]2CCC(OCC3CC3)CC2)c1[O-] ZINC000371335404 267392491 /nfs/dbraw/zinc/39/24/91/267392491.db2.gz KDMCESMOWPNZCK-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@@H]2CCCN(C)C2)c1[O-] ZINC000092253596 276379705 /nfs/dbraw/zinc/37/97/05/276379705.db2.gz RKSNWLRKSWBCID-CQSZACIVSA-N 0 3 292.423 2.565 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@@H]2CCCN(C)C2)c1[O-] ZINC000092253596 276379706 /nfs/dbraw/zinc/37/97/06/276379706.db2.gz RKSNWLRKSWBCID-CQSZACIVSA-N 0 3 292.423 2.565 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C(=O)N1CCCC1)c1ccc(C)cc1[O-] ZINC000281421035 288057434 /nfs/dbraw/zinc/05/74/34/288057434.db2.gz BTPPFFCTUZAURC-ZFWWWQNUSA-N 0 3 290.407 2.752 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCOC[C@@H]1[C@H]1CCCO1 ZINC000377703810 288167223 /nfs/dbraw/zinc/16/72/23/288167223.db2.gz RCDKORXJSAHZJG-BFYDXBDKSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](C[NH2+][C@@H](C)c1cc(OC)ccc1[O-])N1CCCC1 ZINC000184990838 280837216 /nfs/dbraw/zinc/83/72/16/280837216.db2.gz NLXDVMXUTMLREX-UONOGXRCSA-N 0 3 292.423 2.926 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cccc(Cl)c3[O-])[C@H]2C1 ZINC000272540672 290158577 /nfs/dbraw/zinc/15/85/77/290158577.db2.gz BWRXYVPIYIPRTH-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cccc(Cl)c3[O-])[C@H]2C1 ZINC000272540672 290158579 /nfs/dbraw/zinc/15/85/79/290158579.db2.gz BWRXYVPIYIPRTH-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN COc1cc(O)c(CN2CCS[C@H](C)[C@H]2C)cc1OC ZINC000160217882 295004117 /nfs/dbraw/zinc/00/41/17/295004117.db2.gz AJMGIBMFMAUNIC-GHMZBOCLSA-N 0 3 297.420 2.735 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1 ZINC000295069929 295168391 /nfs/dbraw/zinc/16/83/91/295168391.db2.gz PEPKSLXTLGRDBL-QWRGUYRKSA-N 0 3 267.369 2.601 20 10 CFCDHN Cc1ccc(O)c(CNC[C@@H](n2cccn2)C(F)(F)F)c1 ZINC000527745106 330280388 /nfs/dbraw/zinc/28/03/88/330280388.db2.gz RGHSNVXAJMHMIU-CYBMUJFWSA-N 0 3 299.296 2.790 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c([O-])c1 ZINC000527804511 330284415 /nfs/dbraw/zinc/28/44/15/330284415.db2.gz QKOXAVHLHBDPNB-BUWBCJGYSA-N 0 3 279.380 2.692 20 10 CFCDHN Cc1ccc(O)c([C@H](C)N[C@H]2Cc3ccccc3NC2=O)c1 ZINC000527999994 330299907 /nfs/dbraw/zinc/29/99/07/330299907.db2.gz MIYLRSSNMAPNFL-LRDDRELGSA-N 0 3 296.370 2.915 20 10 CFCDHN CCOc1cccc(C[NH2+]CC(C)(C)OCC)c1[O-] ZINC000159211575 521361010 /nfs/dbraw/zinc/36/10/10/521361010.db2.gz KJLHJVXYZLGQMD-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@H](CSC)[NH2+]Cc1cccc(OC)c1[O-] ZINC000163878474 522284642 /nfs/dbraw/zinc/28/46/42/522284642.db2.gz RTULTFGJTOTVCH-LLVKDONJSA-N 0 3 255.383 2.632 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000290041463 519627908 /nfs/dbraw/zinc/62/79/08/519627908.db2.gz DMOGAWGCYGAQJL-OLZOCXBDSA-N 0 3 250.386 2.772 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@@H]2CCN(C)C2)c([O-])c1 ZINC000156021141 520346320 /nfs/dbraw/zinc/34/63/20/520346320.db2.gz SGWFKTFYWSURRC-CQSZACIVSA-N 0 3 292.423 2.565 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@@H]2CCN(C)C2)c([O-])c1 ZINC000156021141 520346329 /nfs/dbraw/zinc/34/63/29/520346329.db2.gz SGWFKTFYWSURRC-CQSZACIVSA-N 0 3 292.423 2.565 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@]2(CC)CO)c([O-])c1 ZINC000191956918 520347776 /nfs/dbraw/zinc/34/77/76/520347776.db2.gz UMIHCXNRBRCGFX-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@]2(CC)CO)c([O-])c1 ZINC000191956918 520347789 /nfs/dbraw/zinc/34/77/89/520347789.db2.gz UMIHCXNRBRCGFX-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])[C@@H]1OC ZINC000274988829 520367068 /nfs/dbraw/zinc/36/70/68/520367068.db2.gz YQYRNPWLKBUAFD-NFAWXSAZSA-N 0 3 299.798 2.636 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@](C)(O)CCC)c([O-])c1 ZINC000264897480 520369163 /nfs/dbraw/zinc/36/91/63/520369163.db2.gz YLDDPMCKLAOSGY-MRXNPFEDSA-N 0 3 281.396 2.822 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@]12CCCO2 ZINC000274251216 520433558 /nfs/dbraw/zinc/43/35/58/520433558.db2.gz SHWAVSXJTPZENF-KKBVYLPWSA-N 0 3 291.391 2.769 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2[O-])[C@@]12CCCO2 ZINC000274251223 520436201 /nfs/dbraw/zinc/43/62/01/520436201.db2.gz SHWAVSXJTPZENF-ZFVVBOAOSA-N 0 3 291.391 2.769 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1cc(OCC)ccc1[O-])OC ZINC000295206109 520710042 /nfs/dbraw/zinc/71/00/42/520710042.db2.gz ZKRAVJHJVTWSKT-AWEZNQCLSA-N 0 3 267.369 2.696 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000230661875 520938763 /nfs/dbraw/zinc/93/87/63/520938763.db2.gz UKGBOBJDEFEKAO-QMTHXVAHSA-N 0 3 255.333 2.733 20 10 CFCDHN CCC[C@@]1([NH2+]Cc2cc(F)ccc2[O-])CCOC1 ZINC000289972770 520965861 /nfs/dbraw/zinc/96/58/61/520965861.db2.gz ZLUSHSNLISQKQV-CQSZACIVSA-N 0 3 253.317 2.580 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000290198970 520966378 /nfs/dbraw/zinc/96/63/78/520966378.db2.gz PLJVVFFAIRFIQA-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000290198970 520966386 /nfs/dbraw/zinc/96/63/86/520966386.db2.gz PLJVVFFAIRFIQA-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C2CC(OCC)C2)c1 ZINC000290342375 521139558 /nfs/dbraw/zinc/13/95/58/521139558.db2.gz FNIAHNLNTXNUTR-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C2CC(OCC)C2)c1 ZINC000290342375 521139567 /nfs/dbraw/zinc/13/95/67/521139567.db2.gz FNIAHNLNTXNUTR-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H]2CCSC2)c1 ZINC000130613780 521143824 /nfs/dbraw/zinc/14/38/24/521143824.db2.gz KGPMDDHMVFJLGH-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H]2CCSC2)c1 ZINC000130613780 521143830 /nfs/dbraw/zinc/14/38/30/521143830.db2.gz KGPMDDHMVFJLGH-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H]2CCN(C)C[C@H]2C)c1 ZINC000290529133 521143865 /nfs/dbraw/zinc/14/38/65/521143865.db2.gz QNZYPDFDCORNDF-CZUORRHYSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)C[C@H]2C)c1 ZINC000290529133 521143869 /nfs/dbraw/zinc/14/38/69/521143869.db2.gz QNZYPDFDCORNDF-CZUORRHYSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280457834 521143881 /nfs/dbraw/zinc/14/38/81/521143881.db2.gz LZJSYYRZPFUSIC-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280457834 521143887 /nfs/dbraw/zinc/14/38/87/521143887.db2.gz LZJSYYRZPFUSIC-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@](C)(OC)C2)c1 ZINC000280724868 521144570 /nfs/dbraw/zinc/14/45/70/521144570.db2.gz YIXRSXREVVTJSZ-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@](C)(OC)C2)c1 ZINC000280724868 521144575 /nfs/dbraw/zinc/14/45/75/521144575.db2.gz YIXRSXREVVTJSZ-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@](C)(O)CC2)c1 ZINC000279688296 521144616 /nfs/dbraw/zinc/14/46/16/521144616.db2.gz PNPKVLQWXBSTAR-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@](C)(O)CC2)c1 ZINC000279688296 521144619 /nfs/dbraw/zinc/14/46/19/521144619.db2.gz PNPKVLQWXBSTAR-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H]2CCSC2)c1 ZINC000279891287 521151475 /nfs/dbraw/zinc/15/14/75/521151475.db2.gz GPTKFUFIZIMATD-LLVKDONJSA-N 0 3 267.394 2.634 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000230661842 521294929 /nfs/dbraw/zinc/29/49/29/521294929.db2.gz NLQPDWVQBAQYAC-DOMZBBRYSA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000278734092 521316422 /nfs/dbraw/zinc/31/64/22/521316422.db2.gz QSVROVIWHGZOHY-OAHLLOKOSA-N 0 3 267.344 2.658 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000278734092 521316426 /nfs/dbraw/zinc/31/64/26/521316426.db2.gz QSVROVIWHGZOHY-OAHLLOKOSA-N 0 3 267.344 2.658 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H]2CCN(C)C[C@H]2C)c1[O-] ZINC000290316359 521333172 /nfs/dbraw/zinc/33/31/72/521333172.db2.gz COGCURFTZMAILJ-HIFRSBDPSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H]2CCN(C)C[C@H]2C)c1[O-] ZINC000290316359 521333180 /nfs/dbraw/zinc/33/31/80/521333180.db2.gz COGCURFTZMAILJ-HIFRSBDPSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@]2(CC)CO)c1[O-] ZINC000191957729 521336274 /nfs/dbraw/zinc/33/62/74/521336274.db2.gz MZSHPIMBLPDEJH-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@]2(CC)CO)c1[O-] ZINC000191957729 521336283 /nfs/dbraw/zinc/33/62/83/521336283.db2.gz MZSHPIMBLPDEJH-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@]23CCOC3)c1[O-] ZINC000312735619 521341238 /nfs/dbraw/zinc/34/12/38/521341238.db2.gz UDOORVJUQKWFGY-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@]23CCOC3)c1[O-] ZINC000312735619 521341250 /nfs/dbraw/zinc/34/12/50/521341250.db2.gz UDOORVJUQKWFGY-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2ccncc2)c1[O-] ZINC000048261316 521366133 /nfs/dbraw/zinc/36/61/33/521366133.db2.gz DTQPKBRLPGNURO-UHFFFAOYSA-N 0 3 272.348 2.518 20 10 CFCDHN CCOc1cccc(CN[C@@H](CO)c2ccccc2)c1O ZINC000062999375 521371758 /nfs/dbraw/zinc/37/17/58/521371758.db2.gz DYLZFGLOOFXVGN-HNNXBMFYSA-N 0 3 287.359 2.614 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)COCC(C)C ZINC000174374579 521689846 /nfs/dbraw/zinc/68/98/46/521689846.db2.gz UDLVITFQHKYLPT-INIZCTEOSA-N 0 3 295.423 2.638 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](O)COCC(C)C ZINC000174374579 521689849 /nfs/dbraw/zinc/68/98/49/521689849.db2.gz UDLVITFQHKYLPT-INIZCTEOSA-N 0 3 295.423 2.638 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)C(C)C ZINC000292546676 521690179 /nfs/dbraw/zinc/69/01/79/521690179.db2.gz GWBFODBHOZZMIB-HNNXBMFYSA-N 0 3 251.370 2.621 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](O)C(C)C ZINC000292546676 521690182 /nfs/dbraw/zinc/69/01/82/521690182.db2.gz GWBFODBHOZZMIB-HNNXBMFYSA-N 0 3 251.370 2.621 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@@H](CC)c2ccccc2[O-])CCC1 ZINC000276835542 521733418 /nfs/dbraw/zinc/73/34/18/521733418.db2.gz BRKSENCHNPSMAT-AWEZNQCLSA-N 0 3 290.407 2.739 20 10 CFCDHN CN(C)c1ccc(CNCCC(=O)OC(C)(C)C)cc1 ZINC000174433305 522204561 /nfs/dbraw/zinc/20/45/61/522204561.db2.gz ZBSQXDSSAWASPP-UHFFFAOYSA-N 0 3 278.396 2.574 20 10 CFCDHN COC[C@@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000228664080 522475978 /nfs/dbraw/zinc/47/59/78/522475978.db2.gz SZXKIKVUXSLYGJ-SNVBAGLBSA-N 0 3 285.771 2.523 20 10 CFCDHN COC[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000228664080 522475987 /nfs/dbraw/zinc/47/59/87/522475987.db2.gz SZXKIKVUXSLYGJ-SNVBAGLBSA-N 0 3 285.771 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)C[C@@H](C)OC)c1[O-] ZINC000289715942 522538317 /nfs/dbraw/zinc/53/83/17/522538317.db2.gz PCBFQVFLFRVIOX-SECBINFHSA-N 0 3 273.760 2.521 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)C[C@@H](C)OC)c1[O-] ZINC000289715942 522538327 /nfs/dbraw/zinc/53/83/27/522538327.db2.gz PCBFQVFLFRVIOX-SECBINFHSA-N 0 3 273.760 2.521 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](CCO)C(C)C)c1[O-] ZINC000230934914 522540676 /nfs/dbraw/zinc/54/06/76/522540676.db2.gz AJILWDWDWIGICG-GFCCVEGCSA-N 0 3 287.787 2.551 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CC2(C)C)c1[O-] ZINC000228671924 522544243 /nfs/dbraw/zinc/54/42/43/522544243.db2.gz DDIQBWGNKYEFCC-NSHDSACASA-N 0 3 255.745 2.942 20 10 CFCDHN CC[C@H]([NH2+]CC1(N(C)C)CCC1)c1ccccc1[O-] ZINC000097927941 522573537 /nfs/dbraw/zinc/57/35/37/522573537.db2.gz FWTNAEFDIUDIOS-AWEZNQCLSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CC[C@H](O)C1)c1ccc(C)cc1[O-] ZINC000280208124 522635350 /nfs/dbraw/zinc/63/53/50/522635350.db2.gz TYWOGKVMLDAIFH-YDHLFZDLSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1ccccc1[O-] ZINC000274783142 522635806 /nfs/dbraw/zinc/63/58/06/522635806.db2.gz PPORFCHAHKPOOV-JQWIXIFHSA-N 0 3 277.286 2.746 20 10 CFCDHN CC[C@H]([NH2+]C[C@](C)(O)CC)c1ccc(C)cc1[O-] ZINC000280124050 522636653 /nfs/dbraw/zinc/63/66/53/522636653.db2.gz OMUKKBGDEBBYRM-DZGCQCFKSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CCCO)c1ccc(C)cc1[O-] ZINC000279988740 522688953 /nfs/dbraw/zinc/68/89/53/522688953.db2.gz FEOZFQCWNWQETH-JSGCOSHPSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2n[nH]cc2C1)c1ccccc1[O-] ZINC000156735812 522722205 /nfs/dbraw/zinc/72/22/05/522722205.db2.gz JHFOERZXUGXNIK-OCCSQVGLSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733644 522730617 /nfs/dbraw/zinc/73/06/17/522730617.db2.gz HDXKOYNSEMNGBA-YPMHNXCESA-N 0 3 278.396 2.736 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)N(C)C)c1ccc(C)cc1[O-] ZINC000280282287 522857973 /nfs/dbraw/zinc/85/79/73/522857973.db2.gz YQDGHXXAJZLJMS-GXTWGEPZSA-N 0 3 250.386 2.691 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000191957091 523619708 /nfs/dbraw/zinc/61/97/08/523619708.db2.gz UJHZYRNSIIGRHY-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000191957091 523619714 /nfs/dbraw/zinc/61/97/14/523619714.db2.gz UJHZYRNSIIGRHY-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)N1[C@H](C)CC[C@@H]1C ZINC000101645580 524086471 /nfs/dbraw/zinc/08/64/71/524086471.db2.gz DZYLRYJGDCAAQJ-MJBXVCDLSA-N 0 3 290.407 2.612 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@]2(O)CCSC2)c([O-])c1 ZINC000294955690 524334190 /nfs/dbraw/zinc/33/41/90/524334190.db2.gz YRSDPABPNZOAHQ-SWLSCSKDSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C2CCC(CO)CC2)c1[O-] ZINC000290358372 524375769 /nfs/dbraw/zinc/37/57/69/524375769.db2.gz GQXLIFVYBZQBHG-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+](C)C2CCC(CO)CC2)c1[O-] ZINC000290358372 524375777 /nfs/dbraw/zinc/37/57/77/524375777.db2.gz GQXLIFVYBZQBHG-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2)N(C)C ZINC000273568678 524748068 /nfs/dbraw/zinc/74/80/68/524748068.db2.gz KDUSNTFEQWBCEO-STQMWFEESA-N 0 3 276.424 2.872 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCOc2ccccc2)c1 ZINC000052092022 524749996 /nfs/dbraw/zinc/74/99/96/524749996.db2.gz TZUHMNSMBXACSP-UHFFFAOYSA-N 0 3 287.359 2.960 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCOCCC(C)C)c1 ZINC000045093978 524751116 /nfs/dbraw/zinc/75/11/16/524751116.db2.gz DGWDVRAZEHZVIH-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](OC)C(C)C)c1 ZINC000273619287 524762405 /nfs/dbraw/zinc/76/24/05/524762405.db2.gz YNDVPUSGILEUFY-ABAIWWIYSA-N 0 3 267.369 2.722 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCSC)c1 ZINC000069432700 524767910 /nfs/dbraw/zinc/76/79/10/524767910.db2.gz HFINHHCJNDAAHB-JTQLQIEISA-N 0 3 255.383 2.805 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2ccc(O)cc2)c1 ZINC000040735184 524768522 /nfs/dbraw/zinc/76/85/22/524768522.db2.gz YFBCITDWKSTKJI-LBPRGKRZSA-N 0 3 287.359 3.000 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCCSC2)c1 ZINC000168815920 524775480 /nfs/dbraw/zinc/77/54/80/524775480.db2.gz MMFDPCFUXMQVPF-QWRGUYRKSA-N 0 3 267.394 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC[C@@H](C)O)c1[O-] ZINC000279422196 524868406 /nfs/dbraw/zinc/86/84/06/524868406.db2.gz PEBWAUQWGZZTNS-SNVBAGLBSA-N 0 3 257.761 2.605 20 10 CFCDHN COc1ncccc1CN[C@H](C)c1cc(F)ccc1O ZINC000094617604 525062253 /nfs/dbraw/zinc/06/22/53/525062253.db2.gz YJRXXFHOTMTNPG-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@H]([NH2+]C1CCN(C2CC2)CC1)c1cc(F)ccc1[O-] ZINC000094617529 525292992 /nfs/dbraw/zinc/29/29/92/525292992.db2.gz SKBOGKPXPCWHEZ-NSHDSACASA-N 0 3 278.371 2.809 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@]3(CCOC3)C2)cc1C ZINC000151296827 525318988 /nfs/dbraw/zinc/31/89/88/525318988.db2.gz WNHBETFLECKPBT-MRXNPFEDSA-N 0 3 261.365 2.621 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@]3(CCOC3)C2)cc1C ZINC000151296827 525318993 /nfs/dbraw/zinc/31/89/93/525318993.db2.gz WNHBETFLECKPBT-MRXNPFEDSA-N 0 3 261.365 2.621 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC3(C2)CCOCC3)c1 ZINC000271181867 525343649 /nfs/dbraw/zinc/34/36/49/525343649.db2.gz CPVQXKTVJQCOBL-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC3(C2)CCOCC3)c1 ZINC000271181867 525343660 /nfs/dbraw/zinc/34/36/60/525343660.db2.gz CPVQXKTVJQCOBL-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@H](C)O[C@@H](C3CC3)C2)c1 ZINC000279773626 525344793 /nfs/dbraw/zinc/34/47/93/525344793.db2.gz ALORZYAJJPFSEF-MLGOLLRUSA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCC(=O)OC(C)(C)C)c1 ZINC000174435171 525348252 /nfs/dbraw/zinc/34/82/52/525348252.db2.gz JCBDPQLLOQFRPY-UHFFFAOYSA-N 0 3 265.353 2.522 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(O)CCCC2(C)C)c1 ZINC000292979828 525349655 /nfs/dbraw/zinc/34/96/55/525349655.db2.gz MZRHYNQQIGGFKT-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000289776072 525350764 /nfs/dbraw/zinc/35/07/64/525350764.db2.gz JEXCCMARBUQSGI-IEBWSBKVSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc(O)c(CN[C@H](CO)c2ccc(F)cc2)c1 ZINC000265258232 525355438 /nfs/dbraw/zinc/35/54/38/525355438.db2.gz QHLDWVJBUBCUHS-OAHLLOKOSA-N 0 3 275.323 2.663 20 10 CFCDHN C[C@H](NCCOCC1CC1)c1ccc(N(C)C)cc1 ZINC000223380753 525356461 /nfs/dbraw/zinc/35/64/61/525356461.db2.gz BJCQVEGDECTFLX-ZDUSSCGKSA-N 0 3 262.397 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CCN(C)C)c1 ZINC000049553876 525362572 /nfs/dbraw/zinc/36/25/72/525362572.db2.gz GKQBPAZUCDEVNY-CHWSQXEVSA-N 0 3 250.386 2.691 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCc3nccn3C2)c1 ZINC000278854734 525364648 /nfs/dbraw/zinc/36/46/48/525364648.db2.gz ALJNMCLWLDLXDE-UONOGXRCSA-N 0 3 285.391 2.810 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000278952788 525396856 /nfs/dbraw/zinc/39/68/56/525396856.db2.gz LONCYBWFWRGQJP-STQMWFEESA-N 0 3 271.364 2.502 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000094617771 525414117 /nfs/dbraw/zinc/41/41/17/525414117.db2.gz HXMJDDXJKLUAGI-WDEREUQCSA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@@H]([NH2+]CCCCO)c1cc2c(cc1[O-])CCCC2 ZINC000194216841 525434743 /nfs/dbraw/zinc/43/47/43/525434743.db2.gz XAJYZVPTKMRAAV-GFCCVEGCSA-N 0 3 263.381 2.694 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1[C@H]2COC[C@H]21)c1cc2c(cc1[O-])CCCC2 ZINC000367692560 525488542 /nfs/dbraw/zinc/48/85/42/525488542.db2.gz ZJVBWJPDGPRHRV-AHBIMHKDSA-N 0 3 287.403 2.814 20 10 CFCDHN C[C@H](NCc1ncccc1N(C)C)c1ccccc1O ZINC000289883984 525488865 /nfs/dbraw/zinc/48/88/65/525488865.db2.gz SDUHGFUJVCEKRL-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1ccccc1[O-] ZINC000183625569 525547603 /nfs/dbraw/zinc/54/76/03/525547603.db2.gz GGVMWLOGJAEMCM-SECBINFHSA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000163860952 525610234 /nfs/dbraw/zinc/61/02/34/525610234.db2.gz KZMNWSVTOKCYIP-QWHCGFSZSA-N 0 3 272.396 2.898 20 10 CFCDHN C[C@H]([NH2+][C@H]1Cc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000245821140 525640096 /nfs/dbraw/zinc/64/00/96/525640096.db2.gz ADPJSIWWFTVTLL-XNJJOIOASA-N 0 3 269.344 2.701 20 10 CFCDHN C[C@@H](O)CN(C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000291036095 525783454 /nfs/dbraw/zinc/78/34/54/525783454.db2.gz FTZNYFLJFUAYCE-SNVBAGLBSA-N 0 3 290.329 2.584 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccccc2[O-])o1 ZINC000272901893 525783736 /nfs/dbraw/zinc/78/37/36/525783736.db2.gz VDVSARKEXKHSRP-RISCZKNCSA-N 0 3 261.321 2.678 20 10 CFCDHN C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000280415668 525820407 /nfs/dbraw/zinc/82/04/07/525820407.db2.gz IHFORCZWUZGMAB-SMDDNHRTSA-N 0 3 267.344 2.657 20 10 CFCDHN C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000280415668 525820412 /nfs/dbraw/zinc/82/04/12/525820412.db2.gz IHFORCZWUZGMAB-SMDDNHRTSA-N 0 3 267.344 2.657 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)CN(C)C)c([O-])c1 ZINC000293613937 525925755 /nfs/dbraw/zinc/92/57/55/525925755.db2.gz JHNAXOJDXNTMSI-STQMWFEESA-N 0 3 250.386 2.549 20 10 CFCDHN COc1cccc(CN2CCCc3occc3C2)c1O ZINC000290218277 525943363 /nfs/dbraw/zinc/94/33/63/525943363.db2.gz RJLGLBDRFWLXCB-UHFFFAOYSA-N 0 3 273.332 2.942 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H]2C2CC2)c([O-])c1 ZINC000300419636 525945097 /nfs/dbraw/zinc/94/50/97/525945097.db2.gz ZCLZJXOJGRWCIO-PJODQICGSA-N 0 3 261.365 2.919 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@H](C)c2ccccc2[O-])o1 ZINC000272901889 525977348 /nfs/dbraw/zinc/97/73/48/525977348.db2.gz VDVSARKEXKHSRP-BXUZGUMPSA-N 0 3 261.321 2.678 20 10 CFCDHN COc1cccc(CNCc2ccc(F)nc2C)c1O ZINC000289394824 526023331 /nfs/dbraw/zinc/02/33/31/526023331.db2.gz FNUKPHNTEQBHRG-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000166374919 526328070 /nfs/dbraw/zinc/32/80/70/526328070.db2.gz FSCXSLPWTLEPGD-CQSZACIVSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000166374919 526328078 /nfs/dbraw/zinc/32/80/78/526328078.db2.gz FSCXSLPWTLEPGD-CQSZACIVSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000245980253 526349075 /nfs/dbraw/zinc/34/90/75/526349075.db2.gz PHBQOTYFAVJCKY-NHYWBVRUSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000245980253 526349078 /nfs/dbraw/zinc/34/90/78/526349078.db2.gz PHBQOTYFAVJCKY-NHYWBVRUSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCCc1nccs1 ZINC000272615406 526350253 /nfs/dbraw/zinc/35/02/53/526350253.db2.gz LBLGSOSWCJNAGI-UHFFFAOYSA-N 0 3 266.341 2.710 20 10 CFCDHN Cc1nc(CC[NH2+]Cc2cc(F)ccc2[O-])cs1 ZINC000226584299 526826891 /nfs/dbraw/zinc/82/68/91/526826891.db2.gz QFNSAWGWDIKIOS-UHFFFAOYSA-N 0 3 266.341 2.629 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]CCCCO ZINC000278820302 527537744 /nfs/dbraw/zinc/53/77/44/527537744.db2.gz TWMHABVZWIROIL-UHFFFAOYSA-N 0 3 271.360 2.921 20 10 CFCDHN c1nc2cc(CNCc3ccc4c(c3)CCO4)ccc2[nH]1 ZINC000727470705 574052081 /nfs/dbraw/zinc/05/20/81/574052081.db2.gz IMEZGAPCVGSCLW-UHFFFAOYSA-N 0 3 279.343 2.788 20 10 CFCDHN c1nc2ccc(CNCc3ccc4c(c3)CCO4)cc2[nH]1 ZINC000727470705 574052082 /nfs/dbraw/zinc/05/20/82/574052082.db2.gz IMEZGAPCVGSCLW-UHFFFAOYSA-N 0 3 279.343 2.788 20 10 CFCDHN COCCOCCC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756356982 574097508 /nfs/dbraw/zinc/09/75/08/574097508.db2.gz AOEMULOKIMQOJA-WCQYABFASA-N 0 3 297.370 2.722 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)ccc1[O-])C1CCOCC1 ZINC000746054657 574132316 /nfs/dbraw/zinc/13/23/16/574132316.db2.gz XHBIDRCGFGISLN-HNNXBMFYSA-N 0 3 263.381 2.995 20 10 CFCDHN CC(C)CN1CCN(Cc2ccc(N(C)C)cc2)CC1 ZINC000732577062 574161765 /nfs/dbraw/zinc/16/17/65/574161765.db2.gz WDPDXHINXBQPAY-UHFFFAOYSA-N 0 3 275.440 2.526 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCN(C)C[C@@H]2C(C)C)cc1C ZINC000738284631 574163124 /nfs/dbraw/zinc/16/31/24/574163124.db2.gz BFZDPRQXZRNMDJ-MRXNPFEDSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCN(C)C[C@@H]2C(C)C)cc1C ZINC000738284631 574163127 /nfs/dbraw/zinc/16/31/27/574163127.db2.gz BFZDPRQXZRNMDJ-MRXNPFEDSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCN2CCc3ccccc32)c1 ZINC000733325874 574221740 /nfs/dbraw/zinc/22/17/40/574221740.db2.gz VNEQDEOZPUHIER-UHFFFAOYSA-N 0 3 282.387 2.853 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756345466 574227844 /nfs/dbraw/zinc/22/78/44/574227844.db2.gz XQHSAINANZZUOZ-WCQYABFASA-N 0 3 289.354 2.956 20 10 CFCDHN C[C@@H](Cc1cccc(O)c1)[NH2+]Cc1ccccc1[O-] ZINC000729681200 574227963 /nfs/dbraw/zinc/22/79/63/574227963.db2.gz XEBDMOQTCPVMME-LBPRGKRZSA-N 0 3 257.333 2.819 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000756401407 574233790 /nfs/dbraw/zinc/23/37/90/574233790.db2.gz OYQCEIDIQUCNBS-SKDRFNHKSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1CO)c1cc(F)ccc1[O-] ZINC000756457754 574238628 /nfs/dbraw/zinc/23/86/28/574238628.db2.gz KWNFXFWRUAQWIC-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756457172 574238829 /nfs/dbraw/zinc/23/88/29/574238829.db2.gz HFWDBSYYANGGFS-PWSUYJOCSA-N 0 3 294.370 2.586 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN(C)C(C)C)c([O-])c1C ZINC000756523142 574243705 /nfs/dbraw/zinc/24/37/05/574243705.db2.gz ARZOKGWVKPYWJT-AWEZNQCLSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CC3)C2)c([O-])c1C ZINC000756545667 574245414 /nfs/dbraw/zinc/24/54/14/574245414.db2.gz NSQSSMWBNXLKAS-KGLIPLIRSA-N 0 3 274.408 2.896 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@](C)(O)C2CC2)c2c1c(F)ccc2[O-] ZINC000756568622 574248642 /nfs/dbraw/zinc/24/86/42/574248642.db2.gz GYJVSQLAZHSCMP-ABYOOWDOSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCOc2cccnc2)c1 ZINC000756570520 574248850 /nfs/dbraw/zinc/24/88/50/574248850.db2.gz DEAZAXLRMHWBAO-ZDUSSCGKSA-N 0 3 272.348 2.825 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)C2CC2)c([O-])c1C ZINC000756576304 574249529 /nfs/dbraw/zinc/24/95/29/574249529.db2.gz MDFYSUSZEXCMOA-WBMJQRKESA-N 0 3 263.381 2.821 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756605177 574251644 /nfs/dbraw/zinc/25/16/44/574251644.db2.gz RCKOWZLSSYLUDL-HOSYDEDBSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@H](CCCO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756647970 574255314 /nfs/dbraw/zinc/25/53/14/574255314.db2.gz URGQMKOIEPTCST-HOSYDEDBSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@H](Cn1cccn1)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756672785 574256777 /nfs/dbraw/zinc/25/67/77/574256777.db2.gz RFXUPWREKIGIFV-NQBHXWOUSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@H](Cn1cccn1)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756672787 574257133 /nfs/dbraw/zinc/25/71/33/574257133.db2.gz RFXUPWREKIGIFV-WZRBSPASSA-N 0 3 289.354 2.954 20 10 CFCDHN Cc1noc(CC[NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)n1 ZINC000756689133 574257708 /nfs/dbraw/zinc/25/77/08/574257708.db2.gz RPWLWNLLJLULNN-LDYMZIIASA-N 0 3 291.326 2.603 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H](CCO)C2CC2)c2c1c(F)ccc2[O-] ZINC000756740131 574260194 /nfs/dbraw/zinc/26/01/94/574260194.db2.gz PXHVFKJLHXZZIY-ICCXJUOJSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000756816821 574265082 /nfs/dbraw/zinc/26/50/82/574265082.db2.gz ARRSWYXKGIGVKN-YWVKMMECSA-N 0 3 267.344 2.829 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H](CO)C1CC1 ZINC000734160763 574277514 /nfs/dbraw/zinc/27/75/14/574277514.db2.gz GSKGUESUYOCSFF-QGZVFWFLSA-N 0 3 283.371 2.920 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](C)c2ccncc2)c1 ZINC000749293169 574288437 /nfs/dbraw/zinc/28/84/37/574288437.db2.gz BTZZYTDBZCELFI-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H](C)c2ccncc2)c1[O-] ZINC000749295131 574288601 /nfs/dbraw/zinc/28/86/01/574288601.db2.gz ISUJIQKYRSVYTI-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCCC(=O)OC)cc1 ZINC000734844599 574304161 /nfs/dbraw/zinc/30/41/61/574304161.db2.gz PYWGJJJZEYWTOS-UHFFFAOYSA-N 0 3 292.423 2.918 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)cc1C ZINC000742375352 574325623 /nfs/dbraw/zinc/32/56/23/574325623.db2.gz PZMMLPFMTFWWOT-UKRRQHHQSA-N 0 3 262.397 2.581 20 10 CFCDHN Cc1cc(O)c(CNC(C)(C)c2cnn(C)c2)cc1C ZINC000742373415 574325540 /nfs/dbraw/zinc/32/55/40/574325540.db2.gz CAEGZVJECYCQOV-UHFFFAOYSA-N 0 3 273.380 2.767 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C2(CCO)CCCCC2)c1 ZINC000751154489 574370119 /nfs/dbraw/zinc/37/01/19/574370119.db2.gz VVKXZEOOYORGBF-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN CO[C@H]1C[C@@H]([NH2+]Cc2cc(C)c(C)cc2[O-])C1(C)C ZINC000753372798 574401761 /nfs/dbraw/zinc/40/17/61/574401761.db2.gz IYZMIQUBUXPXMR-CABCVRRESA-N 0 3 263.381 2.912 20 10 CFCDHN Cc1nc2ccccn2c1CN(C)Cc1ccccc1O ZINC000160292309 617926758 /nfs/dbraw/zinc/92/67/58/617926758.db2.gz RUNBQFNZMCWHRB-UHFFFAOYSA-N 0 3 281.359 2.980 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000050182529 618083325 /nfs/dbraw/zinc/08/33/25/618083325.db2.gz KXSPFCMYVBUYIZ-GFCCVEGCSA-N 0 3 259.353 2.707 20 10 CFCDHN COc1cc(CN2CCS[C@H](C)C2)c(O)cc1C ZINC000160145963 617603719 /nfs/dbraw/zinc/60/37/19/617603719.db2.gz YTTPGJBYQMAKEK-LLVKDONJSA-N 0 3 267.394 2.647 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@]1(C)Br ZINC000891714050 617724633 /nfs/dbraw/zinc/72/46/33/617724633.db2.gz PZGDLXXBBILMGV-WCQYABFASA-N 0 3 284.197 2.998 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@]1(C)Br ZINC000891714050 617724636 /nfs/dbraw/zinc/72/46/36/617724636.db2.gz PZGDLXXBBILMGV-WCQYABFASA-N 0 3 284.197 2.998 20 10 CFCDHN C[C@@H]([NH2+]CCOC(C)(C)C)c1cc(F)ccc1[O-] ZINC000308690306 617787942 /nfs/dbraw/zinc/78/79/42/617787942.db2.gz HKLNSMAUOBCJDP-SNVBAGLBSA-N 0 3 255.333 2.997 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC(C1CC1)C1CC1)OCO2 ZINC000088456085 618137863 /nfs/dbraw/zinc/13/78/63/618137863.db2.gz JPOMXIFKXGFAQI-UHFFFAOYSA-N 0 3 275.348 2.647 20 10 CFCDHN CC[C@H](NCc1cncn1C)c1ccc(N(C)C)cc1 ZINC000289873374 618155778 /nfs/dbraw/zinc/15/57/78/618155778.db2.gz RPUPSSRWGKRBJU-INIZCTEOSA-N 0 3 272.396 2.727 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCc2cncn2C)cc1 ZINC000289971273 618232228 /nfs/dbraw/zinc/23/22/28/618232228.db2.gz XKIMJRWKXPTBGH-ZDUSSCGKSA-N 0 3 272.396 2.727 20 10 CFCDHN C[C@H]1CCSCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000191809879 618416149 /nfs/dbraw/zinc/41/61/49/618416149.db2.gz GFBGJOXKKJVZKT-JTQLQIEISA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@H]1CCSCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000191809879 618416151 /nfs/dbraw/zinc/41/61/51/618416151.db2.gz GFBGJOXKKJVZKT-JTQLQIEISA-N 0 3 255.358 2.859 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[S@](C)=O)c([O-])c1 ZINC000168847984 618718803 /nfs/dbraw/zinc/71/88/03/618718803.db2.gz LSNIJWBOEWEVMN-OAVHHTNSSA-N 0 3 269.410 2.508 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cncs2)c1 ZINC000168895085 618719113 /nfs/dbraw/zinc/71/91/13/618719113.db2.gz VDTVTEIOOXQSCN-VIFPVBQESA-N 0 3 264.350 2.708 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@H](C)C(=O)NC(C)C)cc1 ZINC000840890315 618724639 /nfs/dbraw/zinc/72/46/39/618724639.db2.gz LYXBAMVYODRXOQ-ZIAGYGMSSA-N 0 3 291.439 2.706 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1Cc3ccccc3O1)CC2 ZINC000314577977 618849598 /nfs/dbraw/zinc/84/95/98/618849598.db2.gz RIHHFIIQKGHENG-CABCVRRESA-N 0 3 281.355 2.973 20 10 CFCDHN C[C@@H](c1ccccc1[O-])[N@@H+]1CCOc2ccc(N)cc2C1 ZINC000925752211 619055818 /nfs/dbraw/zinc/05/58/18/619055818.db2.gz HCUBFGYXUXGVQS-LBPRGKRZSA-N 0 3 284.359 2.930 20 10 CFCDHN C[C@@H](c1ccccc1[O-])[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925752211 619055821 /nfs/dbraw/zinc/05/58/21/619055821.db2.gz HCUBFGYXUXGVQS-LBPRGKRZSA-N 0 3 284.359 2.930 20 10 CFCDHN C[C@@H]([NH2+]CCc1cscn1)c1cc(F)ccc1[O-] ZINC000094618224 619133035 /nfs/dbraw/zinc/13/30/35/619133035.db2.gz IIIGGFPIRQBUKQ-SECBINFHSA-N 0 3 266.341 2.881 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(C(F)(F)F)CCCN1)c1ccccc1[O-] ZINC000925851643 619183185 /nfs/dbraw/zinc/18/31/85/619183185.db2.gz BWUQFBABRWBZOP-MFKMUULPSA-N 0 3 288.313 2.727 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(O)CCCCC2)c([O-])c1 ZINC000726605954 619253085 /nfs/dbraw/zinc/25/30/85/619253085.db2.gz MSYYWKYBBWKJKO-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COc1cc(C)cc(CN[C@H](CO)c2ccccc2)c1O ZINC000894258995 619289200 /nfs/dbraw/zinc/28/92/00/619289200.db2.gz OLNBFEWORLCXND-OAHLLOKOSA-N 0 3 287.359 2.532 20 10 CFCDHN COc1ccc(CN[C@@H]2CCc3cccnc32)c(O)c1 ZINC000894636491 619433550 /nfs/dbraw/zinc/43/35/50/619433550.db2.gz KVMFXODADBSTKA-CQSZACIVSA-N 0 3 270.332 2.573 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCc3cccnc32)c([O-])c1 ZINC000894636491 619433551 /nfs/dbraw/zinc/43/35/51/619433551.db2.gz KVMFXODADBSTKA-CQSZACIVSA-N 0 3 270.332 2.573 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000895677548 619580481 /nfs/dbraw/zinc/58/04/81/619580481.db2.gz NWQJWFDRRAXEDF-ZDUSSCGKSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)Cc2ccc(F)cc2)c([O-])c1 ZINC000895753708 619599616 /nfs/dbraw/zinc/59/96/16/619599616.db2.gz UHGMBIAJXIWVDP-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895842036 619617042 /nfs/dbraw/zinc/61/70/42/619617042.db2.gz DWVQOAHCXHHZHT-GOEBONIOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895842036 619617045 /nfs/dbraw/zinc/61/70/45/619617045.db2.gz DWVQOAHCXHHZHT-GOEBONIOSA-N 0 3 261.365 2.702 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnn(C)c1C1CC1)c1ccccc1[O-] ZINC000895852589 619623455 /nfs/dbraw/zinc/62/34/55/619623455.db2.gz XFGWFFMGCCYEFG-LLVKDONJSA-N 0 3 271.364 2.854 20 10 CFCDHN Cn1ccc([C@@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n1 ZINC000896491822 619745151 /nfs/dbraw/zinc/74/51/51/619745151.db2.gz BMZHHCSIAYBIPK-CYBMUJFWSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1ccc([C@@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n1 ZINC000896491822 619745153 /nfs/dbraw/zinc/74/51/53/619745153.db2.gz BMZHHCSIAYBIPK-CYBMUJFWSA-N 0 3 271.364 2.505 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1([C@H]2CCCCO2)CC1 ZINC000897387124 620089631 /nfs/dbraw/zinc/08/96/31/620089631.db2.gz GPVDVSYJOVYTNS-CQSZACIVSA-N 0 3 265.328 2.723 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(CC(F)F)C1)c1ccccc1[O-] ZINC000841765148 620262886 /nfs/dbraw/zinc/26/28/86/620262886.db2.gz NHVPIXRMYCPGBC-AAEUAGOBSA-N 0 3 284.350 2.772 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@@H]1O ZINC000897684283 620271143 /nfs/dbraw/zinc/27/11/43/620271143.db2.gz LZWOIOCDGIXUJL-ACJLOTCBSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@@H]1O ZINC000897684283 620271145 /nfs/dbraw/zinc/27/11/45/620271145.db2.gz LZWOIOCDGIXUJL-ACJLOTCBSA-N 0 3 283.371 2.872 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1Cc2ncccc2N2CCC[C@H]2C1 ZINC000898167434 620342135 /nfs/dbraw/zinc/34/21/35/620342135.db2.gz DNGLDFPPAKSEAP-HNNXBMFYSA-N 0 3 295.386 2.772 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1Cc2ncccc2N2CCC[C@H]2C1 ZINC000898167434 620342137 /nfs/dbraw/zinc/34/21/37/620342137.db2.gz DNGLDFPPAKSEAP-HNNXBMFYSA-N 0 3 295.386 2.772 20 10 CFCDHN COC(=O)[C@@H](C[NH2+]Cc1ccccc1[O-])CC1CCCC1 ZINC000898342729 620373734 /nfs/dbraw/zinc/37/37/34/620373734.db2.gz MVEJIHHXJHVSNC-OAHLLOKOSA-N 0 3 291.391 2.851 20 10 CFCDHN CCN(CC)c1ccc(CN(C)C(COC)COC)cc1 ZINC000929185235 620410143 /nfs/dbraw/zinc/41/01/43/620410143.db2.gz QWCPJWNELULYHV-UHFFFAOYSA-N 0 3 294.439 2.626 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@H](CC)c1ccccc1[O-] ZINC000927015569 620439361 /nfs/dbraw/zinc/43/93/61/620439361.db2.gz GCMDMSYHUJPFIS-GXTWGEPZSA-N 0 3 251.370 2.984 20 10 CFCDHN COC[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(C)C ZINC000927096163 620452207 /nfs/dbraw/zinc/45/22/07/620452207.db2.gz JMGQFGVRSPSJHU-UONOGXRCSA-N 0 3 263.381 2.888 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000898420618 620462524 /nfs/dbraw/zinc/46/25/24/620462524.db2.gz ZOHWNOBAPZXENE-DOMZBBRYSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000898420618 620462526 /nfs/dbraw/zinc/46/25/26/620462526.db2.gz ZOHWNOBAPZXENE-DOMZBBRYSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cc(C)c(O)c(CN(C)Cc2cccc(=O)[nH]2)c1 ZINC000902570658 621127588 /nfs/dbraw/zinc/12/75/88/621127588.db2.gz WWWIVXAVRGHUHB-UHFFFAOYSA-N 0 3 272.348 2.742 20 10 CFCDHN CCc1cc(CN2CC[C@H]2CO)c(O)c(C(C)(C)C)c1 ZINC000902629996 621138971 /nfs/dbraw/zinc/13/89/71/621138971.db2.gz LXSXUJDSFROVNQ-AWEZNQCLSA-N 0 3 277.408 2.819 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c2c1c(F)ccc2[O-] ZINC000903286226 621318183 /nfs/dbraw/zinc/31/81/83/621318183.db2.gz DUQDQFKLMHLKTC-HBQHLAGGSA-N 0 3 289.350 2.845 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCOC1 ZINC000903358380 621347597 /nfs/dbraw/zinc/34/75/97/621347597.db2.gz VJHCMZNKLSUZKQ-YOEHRIQHSA-N 0 3 291.391 2.553 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCN(CC)C1=O)c1ccc(C)cc1[O-] ZINC000903387787 621358810 /nfs/dbraw/zinc/35/88/10/621358810.db2.gz JBJSTNVSYWUFBO-LSDHHAIUSA-N 0 3 290.407 2.752 20 10 CFCDHN Cc1ccc(CC[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000183507317 625507150 /nfs/dbraw/zinc/50/71/50/625507150.db2.gz FNARWSGZFQFXLB-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN C[C@@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1cc([O-])cs1 ZINC000912808435 622778393 /nfs/dbraw/zinc/77/83/93/622778393.db2.gz YRRHPBMDCACRJF-AAEUAGOBSA-N 0 3 296.436 2.646 20 10 CFCDHN C[C@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1cc([O-])cs1 ZINC000912808436 622778532 /nfs/dbraw/zinc/77/85/32/622778532.db2.gz YRRHPBMDCACRJF-DGCLKSJQSA-N 0 3 296.436 2.646 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000157652155 623044004 /nfs/dbraw/zinc/04/40/04/623044004.db2.gz VVICQYPDAIUQFK-MDZLAQPJSA-N 0 3 266.360 2.665 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1c(C)cccc1[O-])C(C)(C)C ZINC000877067273 623047535 /nfs/dbraw/zinc/04/75/35/623047535.db2.gz FLUJBIPUYLZIHV-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN COCC(C)(C)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000169086280 623113347 /nfs/dbraw/zinc/11/33/47/623113347.db2.gz XRMRBZMCZBECES-UHFFFAOYSA-N 0 3 273.760 2.569 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H](O)C2)c1[O-] ZINC000230934888 623310047 /nfs/dbraw/zinc/31/00/47/623310047.db2.gz DHMALYXWXRJOPD-ZWNOBZJWSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H](OC)C2(C)C)c1[O-] ZINC000230935103 623310415 /nfs/dbraw/zinc/31/04/15/623310415.db2.gz RQIPPNRSHKCMCK-OLZOCXBDSA-N 0 3 299.798 2.957 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@H](O)C2)c1[O-] ZINC000230934899 623310430 /nfs/dbraw/zinc/31/04/30/623310430.db2.gz DHMALYXWXRJOPD-GWCFXTLKSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1ccc(CNCc2ccc(OC)c(C)c2)cn1 ZINC000035256605 623444706 /nfs/dbraw/zinc/44/47/06/623444706.db2.gz XQERVZONPBCNSU-UHFFFAOYSA-N 0 3 272.348 2.697 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@](O)(C(F)F)C1 ZINC000824726831 623553399 /nfs/dbraw/zinc/55/33/99/623553399.db2.gz WKSNTIDZBREMTO-INIZCTEOSA-N 0 3 293.313 2.747 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@](O)(C(F)F)C1 ZINC000824726831 623553405 /nfs/dbraw/zinc/55/34/05/623553405.db2.gz WKSNTIDZBREMTO-INIZCTEOSA-N 0 3 293.313 2.747 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(CF)CCOCC2)c([O-])c1 ZINC000824795081 623567327 /nfs/dbraw/zinc/56/73/27/623567327.db2.gz OWYCVCKRVKQCIP-UHFFFAOYSA-N 0 3 297.370 2.647 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]([C@@H](CO)C2CC2)C2CC2)c1 ZINC000824847390 623577033 /nfs/dbraw/zinc/57/70/33/623577033.db2.gz YQMSUMLUIMHJPP-DOTOQJQBSA-N 0 3 275.392 2.587 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H](C)O ZINC000824921329 623588568 /nfs/dbraw/zinc/58/85/68/623588568.db2.gz JENFSBIXYZZYKO-BXKDBHETSA-N 0 3 257.761 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000825062329 623621656 /nfs/dbraw/zinc/62/16/56/623621656.db2.gz SQAGQELMVMLRAQ-SMDDNHRTSA-N 0 3 283.799 2.995 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](O)[C@H]2C)cc1F ZINC000825103373 623629582 /nfs/dbraw/zinc/62/95/82/623629582.db2.gz DFYBQSZJTVBUGX-MLGOLLRUSA-N 0 3 280.387 2.627 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CO)c1ccccc1)CC2 ZINC000313294622 623676318 /nfs/dbraw/zinc/67/63/18/623676318.db2.gz GLKHEWCDAQDPET-GJZGRUSLSA-N 0 3 269.344 2.703 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H](C)C[S@@](C)=O)cc1Cl ZINC000825505366 623704068 /nfs/dbraw/zinc/70/40/68/623704068.db2.gz XDTNPOCEKSDXFC-XTZNXHDOSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H](C)C[S@@](C)=O)cc1Cl ZINC000825505366 623704072 /nfs/dbraw/zinc/70/40/72/623704072.db2.gz XDTNPOCEKSDXFC-XTZNXHDOSA-N 0 3 289.828 2.553 20 10 CFCDHN CCCN1CC[C@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000827519409 624022003 /nfs/dbraw/zinc/02/20/03/624022003.db2.gz MMCXVAXZEWLKNM-AWEZNQCLSA-N 0 3 282.815 2.928 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(c2ccon2)CC1 ZINC000827629014 624048324 /nfs/dbraw/zinc/04/83/24/624048324.db2.gz DLYOERYQNRMFFJ-UHFFFAOYSA-N 0 3 258.321 2.760 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000827751923 624086197 /nfs/dbraw/zinc/08/61/97/624086197.db2.gz YVLKULSLRWEPJZ-GOEBONIOSA-N 0 3 295.354 2.743 20 10 CFCDHN C[C@H](O)[C@@H]([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000827855359 624112027 /nfs/dbraw/zinc/11/20/27/624112027.db2.gz BJHMQKXRQSXUET-MEDUHNTESA-N 0 3 275.323 2.743 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCN(CC(F)F)CC1)CC2 ZINC000834548033 625708512 /nfs/dbraw/zinc/70/85/12/625708512.db2.gz KKFKIDOVXRRBDQ-CYBMUJFWSA-N 0 3 296.361 2.699 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000185308449 625710509 /nfs/dbraw/zinc/71/05/09/625710509.db2.gz IXRJHKCTIAYULX-LLVKDONJSA-N 0 3 266.360 2.666 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000929977465 624340561 /nfs/dbraw/zinc/34/05/61/624340561.db2.gz UVSMBHDELREMHO-DGCLKSJQSA-N 0 3 289.297 2.934 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000929977465 624340564 /nfs/dbraw/zinc/34/05/64/624340564.db2.gz UVSMBHDELREMHO-DGCLKSJQSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H](NCc1cccnc1N)c1ccc(N(C)C)cc1 ZINC000828958761 624341359 /nfs/dbraw/zinc/34/13/59/624341359.db2.gz DBYUCRQFFHCHHV-GFCCVEGCSA-N 0 3 270.380 2.581 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])C(=O)Nc1ccccc1 ZINC000112100229 624653225 /nfs/dbraw/zinc/65/32/25/624653225.db2.gz CFKYECOVXBMEMS-LBPRGKRZSA-N 0 3 270.332 2.509 20 10 CFCDHN CC[C@H](C)[C@H](O)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000185439142 625727180 /nfs/dbraw/zinc/72/71/80/625727180.db2.gz KDLBLLPUBFJICM-SLEUVZQESA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@H](C)[C@@H](O)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000185439183 625727242 /nfs/dbraw/zinc/72/72/42/625727242.db2.gz KDLBLLPUBFJICM-HUBLWGQQSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834612839 625734800 /nfs/dbraw/zinc/73/48/00/625734800.db2.gz VKVODWPIXSNJOP-IACUBPJLSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1ncc(CC[NH2+][C@H]2CCc3cccc([O-])c32)s1 ZINC000834689921 625786419 /nfs/dbraw/zinc/78/64/19/625786419.db2.gz UJRXITRZXMFXET-ZDUSSCGKSA-N 0 3 274.389 2.977 20 10 CFCDHN CCCCOCCC[NH2+]Cc1ccc(C)cc1[O-] ZINC000083385382 625838424 /nfs/dbraw/zinc/83/84/24/625838424.db2.gz RAJJRNHQIRXUQC-UHFFFAOYSA-N 0 3 251.370 2.997 20 10 CFCDHN CCCN1CCC[C@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834798292 625865549 /nfs/dbraw/zinc/86/55/49/625865549.db2.gz ATFSKQIBKWEJKF-LSDHHAIUSA-N 0 3 274.408 2.844 20 10 CFCDHN Cn1nc2c(c1C[NH2+][C@H]1CCc3cccc([O-])c31)CCCC2 ZINC000834808207 625872569 /nfs/dbraw/zinc/87/25/69/625872569.db2.gz YDOBGRRNKIRQFE-HNNXBMFYSA-N 0 3 297.402 2.782 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)c1cc[nH]c(=O)c1 ZINC000834810223 625873057 /nfs/dbraw/zinc/87/30/57/625873057.db2.gz ALOKAZSMIAKIBS-GWCFXTLKSA-N 0 3 270.332 2.831 20 10 CFCDHN CC1(C)CCCN1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834908890 625920065 /nfs/dbraw/zinc/92/00/65/625920065.db2.gz IKYAXAZACJBFKH-AWEZNQCLSA-N 0 3 274.408 2.844 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2NCc1ccc2c(c1)CCCO2 ZINC000921527930 625978453 /nfs/dbraw/zinc/97/84/53/625978453.db2.gz QJLIUQWDLBFRGI-MRXNPFEDSA-N 0 3 297.402 2.912 20 10 CFCDHN COc1ccc(O)c(CNCc2ccnn2C2CCC2)c1 ZINC000921741526 626102949 /nfs/dbraw/zinc/10/29/49/626102949.db2.gz XVHAPTAYPZRUEO-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN CCCOc1ccc(CNCC2OCCCO2)cc1C ZINC000922281491 626258435 /nfs/dbraw/zinc/25/84/35/626258435.db2.gz XCMYPTBBXOMBAW-UHFFFAOYSA-N 0 3 279.380 2.636 20 10 CFCDHN Cc1cc(O)c(CNCc2n[nH]c(C(C)(C)C)n2)cc1C ZINC000839168252 626529224 /nfs/dbraw/zinc/52/92/24/626529224.db2.gz CZSIVAVARNZSIL-UHFFFAOYSA-N 0 3 288.395 2.714 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C2COC(C)(C)OC2)c([O-])c1 ZINC000757705618 626559925 /nfs/dbraw/zinc/55/99/25/626559925.db2.gz RLWGDYPERMEVJE-LLVKDONJSA-N 0 3 265.353 2.503 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2Cc3cccc(O)c3C2)c([O-])c1 ZINC000758559411 626598248 /nfs/dbraw/zinc/59/82/48/626598248.db2.gz IMRAKJAHTBGCQH-CQSZACIVSA-N 0 3 299.370 2.754 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H](CO)CC(F)F)c2c1c(F)ccc2[O-] ZINC000760037107 626710785 /nfs/dbraw/zinc/71/07/85/626710785.db2.gz HKIDFKHQPBLVRB-NQMVMOMDSA-N 0 3 289.297 2.685 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C[C@@H](C)O)C(C)C)c1[O-] ZINC000761200582 626815058 /nfs/dbraw/zinc/81/50/58/626815058.db2.gz WZAPLNDGONELKV-SNVBAGLBSA-N 0 3 287.787 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C[C@@H](C)O)C(C)C)c1[O-] ZINC000761200582 626815061 /nfs/dbraw/zinc/81/50/61/626815061.db2.gz WZAPLNDGONELKV-SNVBAGLBSA-N 0 3 287.787 2.645 20 10 CFCDHN CCC[N@H+](CCOC(F)F)Cc1ccccc1[O-] ZINC000851792297 634531670 /nfs/dbraw/zinc/53/16/70/634531670.db2.gz NFGQPNOVQLVMKD-UHFFFAOYSA-N 0 3 259.296 2.843 20 10 CFCDHN CCC[N@@H+](CCOC(F)F)Cc1ccccc1[O-] ZINC000851792297 634531674 /nfs/dbraw/zinc/53/16/74/634531674.db2.gz NFGQPNOVQLVMKD-UHFFFAOYSA-N 0 3 259.296 2.843 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000762142162 626896730 /nfs/dbraw/zinc/89/67/30/626896730.db2.gz KAKVXKDRGRSOFX-ABAIWWIYSA-N 0 3 289.375 2.583 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000762142162 626896731 /nfs/dbraw/zinc/89/67/31/626896731.db2.gz KAKVXKDRGRSOFX-ABAIWWIYSA-N 0 3 289.375 2.583 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)C2CCOCC2)c([O-])c1 ZINC000763559049 626997579 /nfs/dbraw/zinc/99/75/79/626997579.db2.gz QJCIKRMXKFNCCD-CJNGLKHVSA-N 0 3 293.407 2.529 20 10 CFCDHN CCCN(CC[NH+](CC)CC)C(=O)c1cc([O-])cs1 ZINC000764480539 627064952 /nfs/dbraw/zinc/06/49/52/627064952.db2.gz IMAMNABQJOTJES-UHFFFAOYSA-N 0 3 284.425 2.648 20 10 CFCDHN CCCN(CCN(CC)CC)C(=O)C1=CC(=O)CS1 ZINC000764480539 627064953 /nfs/dbraw/zinc/06/49/53/627064953.db2.gz IMAMNABQJOTJES-UHFFFAOYSA-N 0 3 284.425 2.648 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000767728789 627280248 /nfs/dbraw/zinc/28/02/48/627280248.db2.gz SGDVETKBVZFJLG-HNNXBMFYSA-N 0 3 269.344 2.745 20 10 CFCDHN CC1(C)CCCN(CC[NH2+]Cc2ccccc2[O-])C1 ZINC000767736282 627280881 /nfs/dbraw/zinc/28/08/81/627280881.db2.gz COKNETFHHKIYFS-UHFFFAOYSA-N 0 3 262.397 2.604 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000767927234 627295536 /nfs/dbraw/zinc/29/55/36/627295536.db2.gz ISEQVDTVBAVYKL-LBPRGKRZSA-N 0 3 277.364 2.592 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCCCCCC1)[C@@H](O)CO2 ZINC000768437681 627343060 /nfs/dbraw/zinc/34/30/60/627343060.db2.gz CTGJOBCJMKMJST-HNNXBMFYSA-N 0 3 277.364 2.584 20 10 CFCDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768446530 627344399 /nfs/dbraw/zinc/34/43/99/627344399.db2.gz YTGWINWBSGGQKY-CZUORRHYSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768446530 627344403 /nfs/dbraw/zinc/34/44/03/627344403.db2.gz YTGWINWBSGGQKY-CZUORRHYSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768446527 627344459 /nfs/dbraw/zinc/34/44/59/627344459.db2.gz YTGWINWBSGGQKY-CJNGLKHVSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768446527 627344461 /nfs/dbraw/zinc/34/44/61/627344461.db2.gz YTGWINWBSGGQKY-CJNGLKHVSA-N 0 3 291.391 2.829 20 10 CFCDHN CCC1(CC)CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464141 627345515 /nfs/dbraw/zinc/34/55/15/627345515.db2.gz NQQSYXXPYIPIIY-HNNXBMFYSA-N 0 3 291.391 2.830 20 10 CFCDHN CCC1(CC)CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464141 627345520 /nfs/dbraw/zinc/34/55/20/627345520.db2.gz NQQSYXXPYIPIIY-HNNXBMFYSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H](C)O)C2)c1[O-] ZINC000768519422 627349373 /nfs/dbraw/zinc/34/93/73/627349373.db2.gz PHICSTUQHPEWGR-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c1[O-] ZINC000768519422 627349377 /nfs/dbraw/zinc/34/93/77/627349377.db2.gz PHICSTUQHPEWGR-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000769141241 627406630 /nfs/dbraw/zinc/40/66/30/627406630.db2.gz LHKCMIBZTPTADO-PHIMTYICSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000769141241 627406632 /nfs/dbraw/zinc/40/66/32/627406632.db2.gz LHKCMIBZTPTADO-PHIMTYICSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000769389672 627433216 /nfs/dbraw/zinc/43/32/16/627433216.db2.gz LXDWTPCQQKUOKV-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000769389672 627433217 /nfs/dbraw/zinc/43/32/17/627433217.db2.gz LXDWTPCQQKUOKV-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN CCOc1cccc(CN[C@H](CO)c2ccsc2)c1O ZINC000769934817 627488924 /nfs/dbraw/zinc/48/89/24/627488924.db2.gz QIFBOEXPSOCOPD-CYBMUJFWSA-N 0 3 293.388 2.676 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2ccccc2[O-])[C@@H](CC)CN1C(C)=O ZINC000770504220 627525849 /nfs/dbraw/zinc/52/58/49/627525849.db2.gz BIPMTZBLVLLMLW-HOTGVXAUSA-N 0 3 290.407 2.614 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2ccccc2[O-])[C@@H](CC)CN1C(C)=O ZINC000770504220 627525853 /nfs/dbraw/zinc/52/58/53/627525853.db2.gz BIPMTZBLVLLMLW-HOTGVXAUSA-N 0 3 290.407 2.614 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000770506177 627526015 /nfs/dbraw/zinc/52/60/15/627526015.db2.gz WVQWSRNRTKWXQW-HIFRSBDPSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000770506177 627526018 /nfs/dbraw/zinc/52/60/18/627526018.db2.gz WVQWSRNRTKWXQW-HIFRSBDPSA-N 0 3 261.365 2.641 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](OCC)C2)c([O-])c1 ZINC000771941129 627652341 /nfs/dbraw/zinc/65/23/41/627652341.db2.gz YEIFIYSONQHKLG-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](OCC)C2)c([O-])c1 ZINC000771941129 627652342 /nfs/dbraw/zinc/65/23/42/627652342.db2.gz YEIFIYSONQHKLG-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)Cc1cnccn1)c1ccccc1[O-] ZINC000775495831 628031381 /nfs/dbraw/zinc/03/13/81/628031381.db2.gz CSWFKSOCLSIKEM-IUODEOHRSA-N 0 3 271.364 2.854 20 10 CFCDHN CCc1cc(C[NH2+][C@H](CC)c2ccccc2[O-])[nH]n1 ZINC000775507036 628032132 /nfs/dbraw/zinc/03/21/32/628032132.db2.gz GEBNMULJFDVTPS-CQSZACIVSA-N 0 3 259.353 2.919 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)CC2CC2)c1[O-] ZINC000776252201 628121810 /nfs/dbraw/zinc/12/18/10/628121810.db2.gz PLYOAGFONHPIHY-ZDUSSCGKSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCn3ccnc3C2)c([O-])c1 ZINC000779066592 628349624 /nfs/dbraw/zinc/34/96/24/628349624.db2.gz SKLDMQLQWFFPJU-OLZOCXBDSA-N 0 3 271.364 2.563 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC1Cc2ccccc2C1 ZINC000779079774 628350287 /nfs/dbraw/zinc/35/02/87/628350287.db2.gz YCSNFAPRVRXFKY-UHFFFAOYSA-N 0 3 253.345 2.897 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@H]1COc2ccccc2O1 ZINC000779092457 628352019 /nfs/dbraw/zinc/35/20/19/628352019.db2.gz BIOCTCRYFVDBJV-AWEZNQCLSA-N 0 3 285.343 2.712 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000783510720 628714823 /nfs/dbraw/zinc/71/48/23/628714823.db2.gz SHZFKDJVKQTBJT-JSGCOSHPSA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@@H](C)[C@H](C)O1 ZINC000783546825 628719649 /nfs/dbraw/zinc/71/96/49/628719649.db2.gz UFXZCNXGMDFKQV-AGIUHOORSA-N 0 3 275.392 2.879 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000784686724 628837082 /nfs/dbraw/zinc/83/70/82/628837082.db2.gz NNSAYDKXBKXZIO-SJORKVTESA-N 0 3 291.391 2.838 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(SC)CCC1 ZINC000788523987 629078919 /nfs/dbraw/zinc/07/89/19/629078919.db2.gz JQSDPGIBDYUBJL-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@]2(C)CO)c1[O-] ZINC000789556570 629166761 /nfs/dbraw/zinc/16/67/61/629166761.db2.gz CMXYHMFQBVBOGG-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@]2(C)CO)c1[O-] ZINC000789556570 629166764 /nfs/dbraw/zinc/16/67/64/629166764.db2.gz CMXYHMFQBVBOGG-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCOC(F)(F)F)c1[O-] ZINC000789581161 629168552 /nfs/dbraw/zinc/16/85/52/629168552.db2.gz PYKJVEAOOAYCPW-UHFFFAOYSA-N 0 3 283.677 2.980 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCCCCO)c2c1c(F)ccc2[O-] ZINC000790499450 629243234 /nfs/dbraw/zinc/24/32/34/629243234.db2.gz WWTOCIBGHNYZKW-PWSUYJOCSA-N 0 3 267.344 2.832 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCCCCO)c2c1c(F)ccc2[O-] ZINC000790499438 629243489 /nfs/dbraw/zinc/24/34/89/629243489.db2.gz WWTOCIBGHNYZKW-CMPLNLGQSA-N 0 3 267.344 2.832 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@H]1CC[N@H+](CC2CC2)C1 ZINC000790960913 629274237 /nfs/dbraw/zinc/27/42/37/629274237.db2.gz LLRNAUUWSHHTKY-NSHDSACASA-N 0 3 298.789 2.759 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000790960913 629274242 /nfs/dbraw/zinc/27/42/42/629274242.db2.gz LLRNAUUWSHHTKY-NSHDSACASA-N 0 3 298.789 2.759 20 10 CFCDHN C[C@H]1C[C@@H](NCc2c([O-])ccc(Cl)c2F)CC[N@@H+]1C ZINC000790972724 629276240 /nfs/dbraw/zinc/27/62/40/629276240.db2.gz GDUBEYZGEZJWFW-UWVGGRQHSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@H]1C[C@@H](NCc2c([O-])ccc(Cl)c2F)CC[N@H+]1C ZINC000790972724 629276241 /nfs/dbraw/zinc/27/62/41/629276241.db2.gz GDUBEYZGEZJWFW-UWVGGRQHSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CCCO1 ZINC000835024906 629321429 /nfs/dbraw/zinc/32/14/29/629321429.db2.gz ASADKHZBINEDSB-DRDHIDPGSA-N 0 3 274.408 2.877 20 10 CFCDHN CN(C)c1ccc(/C=C\CNC[C@@H](O)c2ccco2)cc1 ZINC000835036960 629332352 /nfs/dbraw/zinc/33/23/52/629332352.db2.gz SBBVNDHNIGYQFH-OICCZTGUSA-N 0 3 286.375 2.682 20 10 CFCDHN CC1(C)C[C@H](C[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000835060296 629365007 /nfs/dbraw/zinc/36/50/07/629365007.db2.gz RBTMVANXCJVSCH-LLVKDONJSA-N 0 3 267.344 2.826 20 10 CFCDHN CC[C@@H]1C[C@@H](C[NH2+]Cc2ccc(OC)cc2[O-])CCO1 ZINC000793388098 629535825 /nfs/dbraw/zinc/53/58/25/629535825.db2.gz LVKOMCDEWDIAHD-GXTWGEPZSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)CC2(OC)CCC2)c([O-])c1 ZINC000793391592 629536999 /nfs/dbraw/zinc/53/69/99/629536999.db2.gz ZRHHHVBVXRFTDW-GFCCVEGCSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1cc([C@@H](C)NCc2ccc(N(C)C)cc2)n(C)n1 ZINC000793519971 629560655 /nfs/dbraw/zinc/56/06/55/629560655.db2.gz SBPXAONILWWOQU-CYBMUJFWSA-N 0 3 272.396 2.645 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCN1C)c1ccc(C)cc1[O-] ZINC000794802042 629687751 /nfs/dbraw/zinc/68/77/51/629687751.db2.gz LVIQTISKZOABBE-UKRRQHHQSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)COCC1CC1)c1ccc(C)cc1[O-] ZINC000794802665 629687786 /nfs/dbraw/zinc/68/77/86/629687786.db2.gz GIDUPDKNPWINSN-ZBFHGGJFSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCN(C)C1)c1ccc(C)cc1[O-] ZINC000794804794 629688023 /nfs/dbraw/zinc/68/80/23/629688023.db2.gz WGGDTGIBXVXDOH-HIFRSBDPSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]CCC1(C)OCCO1)c1ccc(C)cc1[O-] ZINC000794811971 629689544 /nfs/dbraw/zinc/68/95/44/629689544.db2.gz AWDLTRGTKGXXQN-AWEZNQCLSA-N 0 3 279.380 2.894 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000794812225 629689583 /nfs/dbraw/zinc/68/95/83/629689583.db2.gz VJZYWYLQHJUBSJ-JSGCOSHPSA-N 0 3 299.436 2.565 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000798961059 630264976 /nfs/dbraw/zinc/26/49/76/630264976.db2.gz SKACAAJJLGPYLG-CYBMUJFWSA-N 0 3 281.371 2.810 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2([S@](C)=O)CC2)c2c1c(F)ccc2[O-] ZINC000799727516 630340091 /nfs/dbraw/zinc/34/00/91/630340091.db2.gz NCDSQOOWPHOBAW-MTTWPYTGSA-N 0 3 297.395 2.580 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC3(CCO3)CC2)c([O-])c1 ZINC000800537529 630394514 /nfs/dbraw/zinc/39/45/14/630394514.db2.gz CSVSGOOJCMSINH-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[NH+]2CC(C3CCOCC3)C2)c([O-])c1 ZINC000800532493 630394760 /nfs/dbraw/zinc/39/47/60/630394760.db2.gz XTGBKALXXIJSJK-UHFFFAOYSA-N 0 3 291.391 2.649 20 10 CFCDHN CCCN(Cc1ccc(OC)nn1)Cc1ccccc1O ZINC000801518909 630452615 /nfs/dbraw/zinc/45/26/15/630452615.db2.gz YMHKVGPGGYGOHS-UHFFFAOYSA-N 0 3 287.363 2.603 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CSC2(C)C)c([O-])c1 ZINC000801735880 630467927 /nfs/dbraw/zinc/46/79/27/630467927.db2.gz PMUNDSZGMLVHEV-ZDUSSCGKSA-N 0 3 267.394 2.775 20 10 CFCDHN COC[C@H]1CCN1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000840083101 630857743 /nfs/dbraw/zinc/85/77/43/630857743.db2.gz LUSFMXVQGVSISG-CYBMUJFWSA-N 0 3 293.407 2.919 20 10 CFCDHN CC[C@@H](CO)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672231 631026458 /nfs/dbraw/zinc/02/64/58/631026458.db2.gz HBSCNYMIZCAGKR-KOLCDFICSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2cnn(C)c2)c1[O-] ZINC000808678520 631027585 /nfs/dbraw/zinc/02/75/85/631027585.db2.gz SMMUZSTXXBSZBG-LLVKDONJSA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)Cn2cncn2)c1[O-] ZINC000808683429 631028217 /nfs/dbraw/zinc/02/82/17/631028217.db2.gz FUDUXCSTHCDUEL-QWRGUYRKSA-N 0 3 294.786 2.685 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)O)c1[O-] ZINC000808695607 631030209 /nfs/dbraw/zinc/03/02/09/631030209.db2.gz PBYYBUOXKQWEHU-SECBINFHSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)CCO)c1[O-] ZINC000808697670 631030774 /nfs/dbraw/zinc/03/07/74/631030774.db2.gz QQXKFHNQXFNJCJ-VHSXEESVSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1noc(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])n1 ZINC000808705682 631031227 /nfs/dbraw/zinc/03/12/27/631031227.db2.gz OEPGZJZOMQXTRA-SECBINFHSA-N 0 3 295.770 2.939 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)C(N)=O)c1[O-] ZINC000808709966 631032366 /nfs/dbraw/zinc/03/23/66/631032366.db2.gz JTIJUDBNJUBYMO-VIFPVBQESA-N 0 3 284.787 2.516 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H](O)C(C)C ZINC000840882999 631250150 /nfs/dbraw/zinc/25/01/50/631250150.db2.gz RCCHNWYIVZUVHS-XEGUGMAKSA-N 0 3 269.360 2.977 20 10 CFCDHN CC[C@@H](N[C@H](C)C(=O)NC(C)C)c1ccc(N(C)C)cc1 ZINC000840890421 631253254 /nfs/dbraw/zinc/25/32/54/631253254.db2.gz MLFYNIKCVFGMQX-CZUORRHYSA-N 0 3 291.439 2.706 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000840891929 631254187 /nfs/dbraw/zinc/25/41/87/631254187.db2.gz WFQPTFSBYWCHMF-JSGCOSHPSA-N 0 3 278.396 2.654 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1c2ccccc2C[C@@H]1O ZINC000840929670 631266565 /nfs/dbraw/zinc/26/65/65/631266565.db2.gz CSOTYSPGEWIYSE-RBUKOAKNSA-N 0 3 296.414 2.809 20 10 CFCDHN Cc1cc([O-])c(CN(C)CC[N@H+](C)C2CC2)c(Cl)c1 ZINC000840949005 631277162 /nfs/dbraw/zinc/27/71/62/631277162.db2.gz NRJDHGOQXUKVOF-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc([O-])c(CN(C)CC[N@@H+](C)C2CC2)c(Cl)c1 ZINC000840949005 631277173 /nfs/dbraw/zinc/27/71/73/631277173.db2.gz NRJDHGOQXUKVOF-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccccc1[O-] ZINC000840956588 631283286 /nfs/dbraw/zinc/28/32/86/631283286.db2.gz YSTIOKUQPGITPS-WBVHZDCISA-N 0 3 269.344 2.794 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CC)[C@H](O)C(C)C)c([O-])c1 ZINC000840967454 631287821 /nfs/dbraw/zinc/28/78/21/631287821.db2.gz NMEMZYMNKYRUKM-GDBMZVCRSA-N 0 3 281.396 2.676 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CC)[C@H](O)C(C)C)c([O-])c1 ZINC000840967455 631288412 /nfs/dbraw/zinc/28/84/12/631288412.db2.gz NMEMZYMNKYRUKM-GOEBONIOSA-N 0 3 281.396 2.676 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000809790545 631290795 /nfs/dbraw/zinc/29/07/95/631290795.db2.gz LABZNJFGYKDPND-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000809790545 631290800 /nfs/dbraw/zinc/29/08/00/631290800.db2.gz LABZNJFGYKDPND-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN [O-]c1c(Cl)cc(Cl)cc1C[NH2+]C1CCNCC1 ZINC000841026415 631309083 /nfs/dbraw/zinc/30/90/83/631309083.db2.gz AYXCMOUEQJJHQD-UHFFFAOYSA-N 0 3 275.179 2.541 20 10 CFCDHN Cc1cc([O-])c(CNC[C@@H]2CCCC[NH2+]2)c(Cl)c1 ZINC000841033088 631313123 /nfs/dbraw/zinc/31/31/23/631313123.db2.gz KGYWDIADSGRQTO-NSHDSACASA-N 0 3 268.788 2.586 20 10 CFCDHN C[C@H]1CNCC[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841062807 631328160 /nfs/dbraw/zinc/32/81/60/631328160.db2.gz CORTYXCDABCKIX-QPUJVOFHSA-N 0 3 289.206 2.787 20 10 CFCDHN Cc1cccc2c1C[NH2+]CCN2Cc1cccc(F)c1[O-] ZINC000841088722 631337138 /nfs/dbraw/zinc/33/71/38/631337138.db2.gz CIDRSYCASHCELD-UHFFFAOYSA-N 0 3 286.350 2.950 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@]3(CCSC3)C2)cc1C ZINC000842622591 631684511 /nfs/dbraw/zinc/68/45/11/631684511.db2.gz IDZUVOKXQJTCLO-MRXNPFEDSA-N 0 3 293.432 2.717 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc(CO)cc2)cc1F ZINC000842732882 631721356 /nfs/dbraw/zinc/72/13/56/631721356.db2.gz ZXVLEFVSWYAOBS-UHFFFAOYSA-N 0 3 288.366 2.674 20 10 CFCDHN COc1cc(Cl)cc(CN2CC(C3CC3)C2)c1O ZINC000812775111 631771161 /nfs/dbraw/zinc/77/11/61/631771161.db2.gz GFUKKBSMWDYLHP-UHFFFAOYSA-N 0 3 267.756 2.896 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)[NH2+][C@@H](C)C2)c(Cl)c1 ZINC000843049557 631815110 /nfs/dbraw/zinc/81/51/10/631815110.db2.gz PWFVZAYDYQXSRE-QWRGUYRKSA-N 0 3 268.788 2.536 20 10 CFCDHN CCN(Cc1ccc(N(C)C)cc1)Cc1ccc(N)nc1 ZINC000843059656 631821400 /nfs/dbraw/zinc/82/14/00/631821400.db2.gz OQDITQXJPRQLKL-UHFFFAOYSA-N 0 3 284.407 2.752 20 10 CFCDHN C[N@H+](Cc1cccc2c1NCC2)Cc1ccccc1[O-] ZINC000843060461 631823119 /nfs/dbraw/zinc/82/31/19/631823119.db2.gz KINUCKPDBPGRJM-UHFFFAOYSA-N 0 3 268.360 2.992 20 10 CFCDHN C[N@@H+](Cc1cccc2c1NCC2)Cc1ccccc1[O-] ZINC000843060461 631823123 /nfs/dbraw/zinc/82/31/23/631823123.db2.gz KINUCKPDBPGRJM-UHFFFAOYSA-N 0 3 268.360 2.992 20 10 CFCDHN [NH3+][C@@H]1CCC[C@H]2CN(Cc3c([O-])ccc(Cl)c3F)C[C@@H]21 ZINC000843059677 631823705 /nfs/dbraw/zinc/82/37/05/631823705.db2.gz PJYININPYKVAPD-OUJBWJOFSA-N 0 3 298.789 2.744 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@]3(C2)CCC[NH2+]C3)c(Cl)c1 ZINC000843118372 631840513 /nfs/dbraw/zinc/84/05/13/631840513.db2.gz HCHCXHWTYOXNEF-MRXNPFEDSA-N 0 3 294.826 2.930 20 10 CFCDHN [O-]c1c(Cl)cccc1CN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000843118651 631840618 /nfs/dbraw/zinc/84/06/18/631840618.db2.gz KWIPVPIMHIVFDY-OAHLLOKOSA-N 0 3 280.799 2.621 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[NH2+]CC[C@@H]3C2)c(Cl)c1 ZINC000843128450 631848078 /nfs/dbraw/zinc/84/80/78/631848078.db2.gz XQURSJROGBYHAB-BXUZGUMPSA-N 0 3 280.799 2.538 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419747 631949480 /nfs/dbraw/zinc/94/94/80/631949480.db2.gz SADVGASXQBBKCV-CYBMUJFWSA-N 0 3 272.323 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419747 631949483 /nfs/dbraw/zinc/94/94/83/631949483.db2.gz SADVGASXQBBKCV-CYBMUJFWSA-N 0 3 272.323 2.916 20 10 CFCDHN COc1cccc(O)c1CN1C[C@@H](C)OC2(CCCC2)C1 ZINC000843433593 631958668 /nfs/dbraw/zinc/95/86/68/631958668.db2.gz AKXAYBCFYAQTKM-CYBMUJFWSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1cccc(O)c1CN1C[C@H](C)OC2(CCCC2)C1 ZINC000843433594 631958788 /nfs/dbraw/zinc/95/87/88/631958788.db2.gz AKXAYBCFYAQTKM-ZDUSSCGKSA-N 0 3 291.391 2.934 20 10 CFCDHN C[N@@H+]1CCC[C@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000816642451 632500960 /nfs/dbraw/zinc/50/09/60/632500960.db2.gz ZUZYJECCKAAZMT-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@H+]1CCC[C@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000816642451 632500966 /nfs/dbraw/zinc/50/09/66/632500966.db2.gz ZUZYJECCKAAZMT-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccc(F)nc2)c1 ZINC000845973318 632607031 /nfs/dbraw/zinc/60/70/31/632607031.db2.gz YRFDGOAJLWYMCV-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@@](C)(O)c1ccccc1 ZINC000846038967 632620583 /nfs/dbraw/zinc/62/05/83/632620583.db2.gz OREDUGGEKRKPFT-CXAGYDPISA-N 0 3 271.360 2.778 20 10 CFCDHN C[C@@H](CO)C1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000846057716 632626405 /nfs/dbraw/zinc/62/64/05/632626405.db2.gz HUZCQLIVTOVOLC-ZDUSSCGKSA-N 0 3 294.414 2.732 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])[C@H](Cc2ccccc2)C1 ZINC000846067840 632628846 /nfs/dbraw/zinc/62/88/46/632628846.db2.gz YNBYHHDXYOBITJ-GOSISDBHSA-N 0 3 296.414 2.751 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])[C@H](Cc2ccccc2)C1 ZINC000846067840 632628848 /nfs/dbraw/zinc/62/88/48/632628848.db2.gz YNBYHHDXYOBITJ-GOSISDBHSA-N 0 3 296.414 2.751 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)COCC2CC2)c1[O-] ZINC000846072851 632629600 /nfs/dbraw/zinc/62/96/00/632629600.db2.gz JIFYGXYWCPJQNV-JTQLQIEISA-N 0 3 299.798 2.959 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)COCC2CC2)c([O-])c1 ZINC000846074172 632630176 /nfs/dbraw/zinc/63/01/76/632630176.db2.gz YSVXKZVKMDXDQW-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)CCO)c1[O-] ZINC000846111560 632634928 /nfs/dbraw/zinc/63/49/28/632634928.db2.gz QNCHOSRWYZJKQL-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@@H](C)CCO)c1[O-] ZINC000846111560 632634931 /nfs/dbraw/zinc/63/49/31/632634931.db2.gz QNCHOSRWYZJKQL-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN COc1cccc([C@@H](C)NCc2c(C)noc2C)c1O ZINC000846146938 632646691 /nfs/dbraw/zinc/64/66/91/632646691.db2.gz SYXHAHXREFXVMT-SECBINFHSA-N 0 3 276.336 2.856 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000846185830 632656509 /nfs/dbraw/zinc/65/65/09/632656509.db2.gz YMRVPTRTDFUVRS-COPLHBTASA-N 0 3 269.360 2.979 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCC1(CO)CCC1)CC2 ZINC000846209638 632661075 /nfs/dbraw/zinc/66/10/75/632661075.db2.gz GOYGJYODBGSUAZ-CYBMUJFWSA-N 0 3 261.365 2.522 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCc2c1ccc(=O)n2C)c1ccccc1[O-] ZINC000846216003 632663363 /nfs/dbraw/zinc/66/33/63/632663363.db2.gz OUHHBHIRVBHIRT-WFASDCNBSA-N 0 3 298.386 2.819 20 10 CFCDHN COC1([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000817588865 632672085 /nfs/dbraw/zinc/67/20/85/632672085.db2.gz RZMYVGSKPUYIHE-KGLIPLIRSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CCO1 ZINC000817587482 632672140 /nfs/dbraw/zinc/67/21/40/632672140.db2.gz YGYIVXGSHYIAOW-BFHYXJOUSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@H]([NH2+]CCNC1CC1)c1ccc2ccccc2c1[O-] ZINC000817953754 632753301 /nfs/dbraw/zinc/75/33/01/632753301.db2.gz QLULGKULEBPYBC-LBPRGKRZSA-N 0 3 270.376 2.948 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](N)c1ccccc1)c1cc(F)ccc1[O-] ZINC000817955374 632754575 /nfs/dbraw/zinc/75/45/75/632754575.db2.gz WQSIFPZQAIVHBW-XHDPSFHLSA-N 0 3 274.339 2.882 20 10 CFCDHN C[C@H]([NH2+][C@@H](CN)C1CC1)c1ccc2ccccc2c1[O-] ZINC000817960323 632758967 /nfs/dbraw/zinc/75/89/67/632758967.db2.gz LXCKCZMGQXIPRM-ZBEGNZNMSA-N 0 3 270.376 2.933 20 10 CFCDHN C[C@H]([NH2+][C@H](CN)C1CC1)c1ccc2ccccc2c1[O-] ZINC000817960322 632759301 /nfs/dbraw/zinc/75/93/01/632759301.db2.gz LXCKCZMGQXIPRM-MEDUHNTESA-N 0 3 270.376 2.933 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCCCNC1)c1ccc(F)cc1[O-] ZINC000817983574 632779542 /nfs/dbraw/zinc/77/95/42/632779542.db2.gz GSOAWVIFIADIKX-GXTWGEPZSA-N 0 3 266.360 2.714 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1cc(F)cc(F)c1[O-] ZINC000817985935 632782288 /nfs/dbraw/zinc/78/22/88/632782288.db2.gz OJHNLIHXXSNWPV-ZYHUDNBSSA-N 0 3 296.361 2.996 20 10 CFCDHN C[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(=O)OC(C)(C)C ZINC000848563340 633290299 /nfs/dbraw/zinc/29/02/99/633290299.db2.gz RTPJLCCAZGBNQQ-AAEUAGOBSA-N 0 3 291.391 2.947 20 10 CFCDHN CCc1cccc(CN2C[C@H](C)O[C@@H](C)[C@@H]2C)c1O ZINC000848905378 633392949 /nfs/dbraw/zinc/39/29/49/633392949.db2.gz JVAHEYUKMHTBQN-AVGNSLFASA-N 0 3 263.381 2.952 20 10 CFCDHN COCC1(C[NH2+]Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000848925133 633408869 /nfs/dbraw/zinc/40/88/69/633408869.db2.gz ONNMTPUILWLSQE-UHFFFAOYSA-N 0 3 269.772 2.870 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H]1CCCCO1 ZINC000848927743 633411359 /nfs/dbraw/zinc/41/13/59/633411359.db2.gz MLSXVQHSFPKTCQ-DZGCQCFKSA-N 0 3 267.344 2.969 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnc3n2CCC3)cc1 ZINC000850035118 633796602 /nfs/dbraw/zinc/79/66/02/633796602.db2.gz URIPMVQJRNBFRG-UHFFFAOYSA-N 0 3 298.434 2.965 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC2CC(OC)C2)c([O-])c1 ZINC000850341356 633945829 /nfs/dbraw/zinc/94/58/29/633945829.db2.gz HXCKPNCHGRCSFQ-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCOC(C)(C)C ZINC000850368516 633958191 /nfs/dbraw/zinc/95/81/91/633958191.db2.gz CBAFVZQLVNJPQC-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000850408599 633980789 /nfs/dbraw/zinc/98/07/89/633980789.db2.gz BNUGHPXRTDCPAG-HYVNUMGLSA-N 0 3 269.319 2.959 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H](CO)C2CCC2)c2c1c(F)ccc2[O-] ZINC000850487381 634014682 /nfs/dbraw/zinc/01/46/82/634014682.db2.gz IDIRYXUGAUHMHS-OASPWFOLSA-N 0 3 279.355 2.830 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2COC(C)(C)C2)cc1F ZINC000858186651 636150582 /nfs/dbraw/zinc/15/05/82/636150582.db2.gz BPKFHGKHNXKQIM-NSHDSACASA-N 0 3 284.350 2.688 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](C)=O)C1)c1cc(F)ccc1[O-] ZINC000850500460 634020347 /nfs/dbraw/zinc/02/03/47/634020347.db2.gz DNBZVHGMYGQNEA-SPQIJUHKSA-N 0 3 299.411 2.872 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)C1(CO)CC1 ZINC000850515803 634026170 /nfs/dbraw/zinc/02/61/70/634026170.db2.gz HZQAVECVQICEOF-CKYFFXLPSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000850555934 634052577 /nfs/dbraw/zinc/05/25/77/634052577.db2.gz KCNKYQZTOAFFEX-CHWSQXEVSA-N 0 3 290.407 2.690 20 10 CFCDHN CC[C@H](N[C@@H](C)c1nccn1C)c1ccccc1O ZINC000850572472 634056880 /nfs/dbraw/zinc/05/68/80/634056880.db2.gz KNHXGUKYZVAZBZ-AAEUAGOBSA-N 0 3 259.353 2.928 20 10 CFCDHN C[C@@]1(C2CC2)CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000853528862 635028101 /nfs/dbraw/zinc/02/81/01/635028101.db2.gz XDPKLEBOFHNQOE-SFHVURJKSA-N 0 3 287.403 2.882 20 10 CFCDHN CC[C@H]([NH2+]CC1(N)CCCC1)c1ccc(F)cc1[O-] ZINC000854221985 635262330 /nfs/dbraw/zinc/26/23/30/635262330.db2.gz BGYOBGPAIGRYHS-ZDUSSCGKSA-N 0 3 266.360 2.844 20 10 CFCDHN CNC[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233077 635268187 /nfs/dbraw/zinc/26/81/87/635268187.db2.gz WQXHXQRIIPQUTE-BDAKNGLRSA-N 0 3 276.302 2.670 20 10 CFCDHN C[NH2+]C[C@@H](C)N[C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233077 635268192 /nfs/dbraw/zinc/26/81/92/635268192.db2.gz WQXHXQRIIPQUTE-BDAKNGLRSA-N 0 3 276.302 2.670 20 10 CFCDHN CCC[C@@](C)(CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858139342 636136207 /nfs/dbraw/zinc/13/62/07/636136207.db2.gz RONCOHXPDCKJDA-HNNXBMFYSA-N 0 3 286.366 2.672 20 10 CFCDHN C[C@@H]1CSC[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858163750 636144116 /nfs/dbraw/zinc/14/41/16/636144116.db2.gz KVQNTMMLIDKSDF-NOZJJQNGSA-N 0 3 286.391 2.872 20 10 CFCDHN OCc1cc(NCc2ccc(N3CCCC3)cc2)ccn1 ZINC000858347334 636200972 /nfs/dbraw/zinc/20/09/72/636200972.db2.gz WBYTVQXZUVNTOV-UHFFFAOYSA-N 0 3 283.375 2.786 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000858485139 636267583 /nfs/dbraw/zinc/26/75/83/636267583.db2.gz KKFNEESJNCZJKJ-AAEUAGOBSA-N 0 3 269.360 2.979 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccnc(F)c2)c1 ZINC000859232554 636517628 /nfs/dbraw/zinc/51/76/28/636517628.db2.gz MCGZVAFKYZURCE-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)CC2CC2)cc1F ZINC000862229112 637292530 /nfs/dbraw/zinc/29/25/30/637292530.db2.gz PVDCHZMDTIEDKK-UHFFFAOYSA-N 0 3 254.324 2.873 20 10 CFCDHN Cc1cccc2c1C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])CO2 ZINC000862439083 637378729 /nfs/dbraw/zinc/37/87/29/637378729.db2.gz HUUREZIJCPSQMS-CQSZACIVSA-N 0 3 287.334 2.933 20 10 CFCDHN CCOC(=O)CC(C)(C)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000862479002 637395938 /nfs/dbraw/zinc/39/59/38/637395938.db2.gz YSFDPQAOOMWVGP-UHFFFAOYSA-N 0 3 279.380 2.770 20 10 CFCDHN CC1(C)CCC[C@@](CO)([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000862486325 637400739 /nfs/dbraw/zinc/40/07/39/637400739.db2.gz YAPSRTLARVNPKX-MRXNPFEDSA-N 0 3 281.371 2.952 20 10 CFCDHN CCCN(Cc1ccccc1O)C(=O)CN(C)C1CCC1 ZINC000863863817 637801001 /nfs/dbraw/zinc/80/10/01/637801001.db2.gz QVYCCJVXCRTGFS-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1ccccc1[O-] ZINC000865714348 638530098 /nfs/dbraw/zinc/53/00/98/638530098.db2.gz MYNGWFANKZVMNF-KRWDZBQOSA-N 0 3 289.350 2.615 20 10 CFCDHN CCOc1ccc(O)c(CNCc2ccnc(F)c2)c1 ZINC000865722185 638535549 /nfs/dbraw/zinc/53/55/49/638535549.db2.gz GDOSLOMLJMWWOY-UHFFFAOYSA-N 0 3 276.311 2.615 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](O)C(F)F)c1ccc(C)cc1[O-] ZINC000866442391 638821803 /nfs/dbraw/zinc/82/18/03/638821803.db2.gz KTXYURJBGCQGOA-RYUDHWBXSA-N 0 3 273.323 2.757 20 10 CFCDHN CC[C@H]([NH2+][C@H]1[C@@H]2OC[C@@H]3C[C@H]1C[C@@H]32)c1ccccc1[O-] ZINC000866444663 638822221 /nfs/dbraw/zinc/82/22/21/638822221.db2.gz JJAJIVBXKUVNFY-LFDYHEEJSA-N 0 3 273.376 2.856 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@H](O)C(F)(F)F)c1ccccc1[O-] ZINC000866464905 638825717 /nfs/dbraw/zinc/82/57/17/638825717.db2.gz ZSNCOYDWBSDTKP-QRTLGDNMSA-N 0 3 277.286 2.745 20 10 CFCDHN CC[C@H]([NH2+]CCCO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000121092581 638832654 /nfs/dbraw/zinc/83/26/54/638832654.db2.gz YVQGMINKRZNJMK-HIFRSBDPSA-N 0 3 279.380 2.629 20 10 CFCDHN CCN(C)c1ccc(CN(C)Cc2ccccc2O)cn1 ZINC000191253573 650485730 /nfs/dbraw/zinc/48/57/30/650485730.db2.gz YRAKKDODJYEHGP-UHFFFAOYSA-N 0 3 285.391 2.875 20 10 CFCDHN COC(=O)[C@@](C)(C[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000191587470 650512218 /nfs/dbraw/zinc/51/22/18/650512218.db2.gz NGPDMTFPHRUJKL-SFHVURJKSA-N 0 3 299.370 2.613 20 10 CFCDHN Cc1ccc(CN2CCO[C@@H](C(F)F)CC2)c(O)c1 ZINC000872254101 641719284 /nfs/dbraw/zinc/71/92/84/641719284.db2.gz RNARHSTVAABGQL-CYBMUJFWSA-N 0 3 271.307 2.557 20 10 CFCDHN C[C@@H]([NH2+]CCCOC(F)F)c1cc(F)ccc1[O-] ZINC000194041636 650714124 /nfs/dbraw/zinc/71/41/24/650714124.db2.gz GUKSHWVLQHBUQN-MRVPVSSYSA-N 0 3 263.259 2.811 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1Cc2ccccc2CN1)c1ccccc1[O-] ZINC000873294464 642125904 /nfs/dbraw/zinc/12/59/04/642125904.db2.gz SYWCHSGBJKKDNI-CJNGLKHVSA-N 0 3 282.387 2.757 20 10 CFCDHN C[NH2+]CCCN(C)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000124793943 642322965 /nfs/dbraw/zinc/32/29/65/642322965.db2.gz YEDAJXPZTGFAHU-UHFFFAOYSA-N 0 3 277.195 2.740 20 10 CFCDHN CCOC(=O)[C@@]1(C(C)C)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000195196109 650741061 /nfs/dbraw/zinc/74/10/61/650741061.db2.gz LZHXSEYRLGLMMF-KRWDZBQOSA-N 0 3 291.391 2.803 20 10 CFCDHN CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000195196109 650741062 /nfs/dbraw/zinc/74/10/62/650741062.db2.gz LZHXSEYRLGLMMF-KRWDZBQOSA-N 0 3 291.391 2.803 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c([O-])c1 ZINC000876618990 642947769 /nfs/dbraw/zinc/94/77/69/642947769.db2.gz LEMUFQHGRKNLMO-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c([O-])c1 ZINC000876618990 642947773 /nfs/dbraw/zinc/94/77/73/642947773.db2.gz LEMUFQHGRKNLMO-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(c3cn[nH]c3)CC2)c([O-])c1 ZINC000876633257 642951446 /nfs/dbraw/zinc/95/14/46/642951446.db2.gz PLRPGPHEPYRSIC-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCCOC(C)C ZINC000876752290 642994327 /nfs/dbraw/zinc/99/43/27/642994327.db2.gz LEJXXZLNBIFSED-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCCOC(C)C ZINC000876752290 642994331 /nfs/dbraw/zinc/99/43/31/642994331.db2.gz LEJXXZLNBIFSED-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN CN1CCCC[C@H]1CC[N@H+](C)Cc1ccc(F)c(F)c1[O-] ZINC000876766274 643001117 /nfs/dbraw/zinc/00/11/17/643001117.db2.gz GVMCSPUNHIQEAF-ZDUSSCGKSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@H]1CC[N@@H+](C)Cc1ccc(F)c(F)c1[O-] ZINC000876766274 643001121 /nfs/dbraw/zinc/00/11/21/643001121.db2.gz GVMCSPUNHIQEAF-ZDUSSCGKSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(F)c(F)c1[O-] ZINC000876766274 643001125 /nfs/dbraw/zinc/00/11/25/643001125.db2.gz GVMCSPUNHIQEAF-ZDUSSCGKSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(F)c(F)c1[O-] ZINC000876766274 643001126 /nfs/dbraw/zinc/00/11/26/643001126.db2.gz GVMCSPUNHIQEAF-ZDUSSCGKSA-N 0 3 298.377 2.977 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)c([O-])c1 ZINC000876790265 643010982 /nfs/dbraw/zinc/01/09/82/643010982.db2.gz XMVPKVVBZZIROR-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@H](CO)C(C)(C)C)c([O-])c1 ZINC000876790265 643010987 /nfs/dbraw/zinc/01/09/87/643010987.db2.gz XMVPKVVBZZIROR-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]3COCC[C@@H]32)c([O-])c1 ZINC000876804672 643015818 /nfs/dbraw/zinc/01/58/18/643015818.db2.gz RMQYYDZPEDGQOF-GJZGRUSLSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c([O-])c1 ZINC000876804672 643015827 /nfs/dbraw/zinc/01/58/27/643015827.db2.gz RMQYYDZPEDGQOF-GJZGRUSLSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]CCCN2CCCCCC2=O)c([O-])c1 ZINC000876891746 643054867 /nfs/dbraw/zinc/05/48/67/643054867.db2.gz DTSAEFHRXJROJQ-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2Cc3ccccc3O2)c([O-])c1 ZINC000876915824 643063317 /nfs/dbraw/zinc/06/33/17/643063317.db2.gz CTBDZJLLNNZJIG-OAHLLOKOSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1ccc(C[NH2+]CCCN(C)CC(F)(F)F)c([O-])c1 ZINC000876932094 643070233 /nfs/dbraw/zinc/07/02/33/643070233.db2.gz CVYHYEWDZCPTSP-UHFFFAOYSA-N 0 3 290.329 2.674 20 10 CFCDHN Cc1ccc(C[NH2+]CCC(=O)NC2CCCCC2)c([O-])c1 ZINC000876956368 643079778 /nfs/dbraw/zinc/07/97/78/643079778.db2.gz IHUZFERINIFNSH-UHFFFAOYSA-N 0 3 290.407 2.629 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCC(=O)NC1CCCCC1 ZINC000876956759 643080210 /nfs/dbraw/zinc/08/02/10/643080210.db2.gz MUIYWQGTDVGXBB-UHFFFAOYSA-N 0 3 290.407 2.629 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)c1ccccc1F ZINC000876958682 643080958 /nfs/dbraw/zinc/08/09/58/643080958.db2.gz AQXPPKBWINKXED-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000876960115 643082386 /nfs/dbraw/zinc/08/23/86/643082386.db2.gz UJYNIWFLHUZXCZ-INIZCTEOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccccc2O)c([O-])c1 ZINC000876995846 643098634 /nfs/dbraw/zinc/09/86/34/643098634.db2.gz KRMRTCPKQDETLQ-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)c1cccs1 ZINC000877047513 643119362 /nfs/dbraw/zinc/11/93/62/643119362.db2.gz BNXQQHFXRZNRDM-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN COc1cc(CC[NH2+]Cc2c(C)cccc2[O-])ccc1O ZINC000877046489 643119458 /nfs/dbraw/zinc/11/94/58/643119458.db2.gz NUFXGMZHSYMEEM-UHFFFAOYSA-N 0 3 287.359 2.747 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(O)CCCCCC1 ZINC000877049574 643120409 /nfs/dbraw/zinc/12/04/09/643120409.db2.gz TYNHLSHAXWLOTQ-UHFFFAOYSA-N 0 3 263.381 2.876 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(O)CCCCCC2)c([O-])c1 ZINC000877048439 643121012 /nfs/dbraw/zinc/12/10/12/643121012.db2.gz LAUIMIHFWJFBHQ-UHFFFAOYSA-N 0 3 263.381 2.876 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2c(C)cccc2[O-])c(C)o1 ZINC000877060106 643126278 /nfs/dbraw/zinc/12/62/78/643126278.db2.gz GLKPRNKWSCOANP-KRWDZBQOSA-N 0 3 289.375 2.908 20 10 CFCDHN CO[C@H](C[NH2+]Cc1ccc(C)cc1[O-])C(C)(C)C ZINC000877068070 643132097 /nfs/dbraw/zinc/13/20/97/643132097.db2.gz PYFRAJRQXXXFBZ-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c([O-])c1 ZINC000877070832 643134453 /nfs/dbraw/zinc/13/44/53/643134453.db2.gz WXCDKUUEEUJKRS-BMFZPTHFSA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCNc1ccccc1 ZINC000877076622 643138419 /nfs/dbraw/zinc/13/84/19/643138419.db2.gz ZIDKBZXBZVKWHJ-UHFFFAOYSA-N 0 3 256.349 2.902 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000877135545 643170528 /nfs/dbraw/zinc/17/05/28/643170528.db2.gz GICMVZJFGADPAZ-GOEBONIOSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc(CO)cc2)c([O-])c1 ZINC000877137131 643172025 /nfs/dbraw/zinc/17/20/25/643172025.db2.gz DDAAHGATMDFPSR-UHFFFAOYSA-N 0 3 271.360 2.525 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000877167208 643185183 /nfs/dbraw/zinc/18/51/83/643185183.db2.gz QFBVKEYGJGUPCC-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000877167208 643185187 /nfs/dbraw/zinc/18/51/87/643185187.db2.gz QFBVKEYGJGUPCC-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN COCC1(C)CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000877172633 643189054 /nfs/dbraw/zinc/18/90/54/643189054.db2.gz RXQUWSVLWVFMAO-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000877305964 643228503 /nfs/dbraw/zinc/22/85/03/643228503.db2.gz BGEBPFWOQBADQX-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H]1CCO[C@H](C)C1 ZINC000877310037 643232086 /nfs/dbraw/zinc/23/20/86/643232086.db2.gz YAXOZKAJFPDSDX-ZIAGYGMSSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H]1CCO[C@@H](C)C1 ZINC000877310034 643232334 /nfs/dbraw/zinc/23/23/34/643232334.db2.gz YAXOZKAJFPDSDX-KBPBESRZSA-N 0 3 263.381 2.995 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2c(C)cccc2[O-])C1 ZINC000877468999 643288755 /nfs/dbraw/zinc/28/87/55/643288755.db2.gz PEGPOOUIKBPXJE-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2Cc3cccc(O)c3C2)c([O-])c1 ZINC000877477009 643294953 /nfs/dbraw/zinc/29/49/53/643294953.db2.gz UAOKVEUPRZAVOK-CQSZACIVSA-N 0 3 269.344 2.663 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1ccc(C)cc1[O-] ZINC000877479443 643296225 /nfs/dbraw/zinc/29/62/25/643296225.db2.gz CWQKDMTXJVXGDE-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1ccc(C)cc1[O-] ZINC000877479443 643296229 /nfs/dbraw/zinc/29/62/29/643296229.db2.gz CWQKDMTXJVXGDE-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCCCN2C2CC2)c([O-])c1 ZINC000877479517 643297099 /nfs/dbraw/zinc/29/70/99/643297099.db2.gz WRDRGTWQRICZAQ-INIZCTEOSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000877481095 643298679 /nfs/dbraw/zinc/29/86/79/643298679.db2.gz UVYLSMOVZGBEHW-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000877481095 643298682 /nfs/dbraw/zinc/29/86/82/643298682.db2.gz UVYLSMOVZGBEHW-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CCO)Cc2ccccc2)c([O-])c1 ZINC000877499081 643311834 /nfs/dbraw/zinc/31/18/34/643311834.db2.gz YIWRWSDTLQZCEZ-KRWDZBQOSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1ccc(C[N@@H+](CC2CCC2)[C@@H](C)CO)c([O-])c1 ZINC000877505423 643315823 /nfs/dbraw/zinc/31/58/23/643315823.db2.gz CURVTKOOKMWNSR-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+](CC2CCC2)[C@@H](C)CO)c([O-])c1 ZINC000877505423 643315827 /nfs/dbraw/zinc/31/58/27/643315827.db2.gz CURVTKOOKMWNSR-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1c(C)cccc1[O-] ZINC000877526949 643331340 /nfs/dbraw/zinc/33/13/40/643331340.db2.gz HAKFEBBFBJPATJ-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1c(C)cccc1[O-] ZINC000877526949 643331345 /nfs/dbraw/zinc/33/13/45/643331345.db2.gz HAKFEBBFBJPATJ-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1COc2ccccc21 ZINC000877537687 643340945 /nfs/dbraw/zinc/34/09/45/643340945.db2.gz OWIJGVOSIASHTF-ZDUSSCGKSA-N 0 3 269.344 2.966 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c([O-])c1 ZINC000877545551 643347944 /nfs/dbraw/zinc/34/79/44/643347944.db2.gz IFXDOYJGABZJBI-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c([O-])c1 ZINC000877545551 643347946 /nfs/dbraw/zinc/34/79/46/643347946.db2.gz IFXDOYJGABZJBI-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)c2cc[nH]c(=O)c2)c([O-])c1 ZINC000877550998 643350584 /nfs/dbraw/zinc/35/05/84/643350584.db2.gz QBRCIYYQADFZNI-NSHDSACASA-N 0 3 258.321 2.652 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(CF)CCOCC1 ZINC000877565566 643365286 /nfs/dbraw/zinc/36/52/86/643365286.db2.gz KAFVJQDEQRBBDF-UHFFFAOYSA-N 0 3 267.344 2.557 20 10 CFCDHN COCC1(C[NH2+]Cc2ccc(C)cc2[O-])CCCC1 ZINC000877574647 643372750 /nfs/dbraw/zinc/37/27/50/643372750.db2.gz QLTHLXGYPXCYTP-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CO[C@@H]1C[C@H]([NH2+]Cc2c(C)cccc2[O-])C12CCC2 ZINC000877585121 643380576 /nfs/dbraw/zinc/38/05/76/643380576.db2.gz PYLCNQHGJHWDAE-LSDHHAIUSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2cnn(C)c2)c([O-])c1 ZINC000877631290 643416054 /nfs/dbraw/zinc/41/60/54/643416054.db2.gz OTEOMSMXTRFXJM-DOTOQJQBSA-N 0 3 299.418 2.935 20 10 CFCDHN CO[C@H](C[NH2+]Cc1c(C)cccc1[O-])C1CCCC1 ZINC000877638829 643423922 /nfs/dbraw/zinc/42/39/22/643423922.db2.gz PKDMHIZASVEVGM-MRXNPFEDSA-N 0 3 263.381 2.995 20 10 CFCDHN CCC(O)(CC)C[N@H+](C)Cc1c(C)cccc1[O-] ZINC000877659599 643438491 /nfs/dbraw/zinc/43/84/91/643438491.db2.gz XKSVSKTZSJSAOT-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC(O)(CC)C[N@@H+](C)Cc1c(C)cccc1[O-] ZINC000877659599 643438495 /nfs/dbraw/zinc/43/84/95/643438495.db2.gz XKSVSKTZSJSAOT-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC[C@H](CCO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000877667787 643443796 /nfs/dbraw/zinc/44/37/96/643443796.db2.gz QSNDBFUCNFRYLS-CYBMUJFWSA-N 0 3 271.788 2.995 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](O)C(F)(F)F)c1[O-] ZINC000877693602 643459395 /nfs/dbraw/zinc/45/93/95/643459395.db2.gz LTBKYXQZJPSPIS-WRWORJQWSA-N 0 3 297.704 2.755 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1Cl ZINC000877741045 643510777 /nfs/dbraw/zinc/51/07/77/643510777.db2.gz MGSDNYAKWWIUHU-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@H](CC[N@@H+]3C)C2)cc1Cl ZINC000877741045 643510782 /nfs/dbraw/zinc/51/07/82/643510782.db2.gz MGSDNYAKWWIUHU-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c(Cl)c1 ZINC000877742991 643517026 /nfs/dbraw/zinc/51/70/26/643517026.db2.gz SPTGFQOOPSKNQW-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c(Cl)c1 ZINC000877742991 643517033 /nfs/dbraw/zinc/51/70/33/643517033.db2.gz SPTGFQOOPSKNQW-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN COC(=O)c1[nH]c(C[NH2+][C@H](C)c2ccccc2[O-])cc1C ZINC000877755690 643535880 /nfs/dbraw/zinc/53/58/80/643535880.db2.gz LQQZMABLSPURJY-LLVKDONJSA-N 0 3 288.347 2.666 20 10 CFCDHN COc1cc(C)nc(CN[C@H](C)c2ccccc2O)c1 ZINC000877756599 643537388 /nfs/dbraw/zinc/53/73/88/643537388.db2.gz WXPDOLIOIIFTTB-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN C[C@H](NCc1ncc(CN(C)C)s1)c1ccccc1O ZINC000877758099 643538332 /nfs/dbraw/zinc/53/83/32/643538332.db2.gz ISDCGCIVODDGAI-NSHDSACASA-N 0 3 291.420 2.761 20 10 CFCDHN C[C@H]([NH2+]Cc1cn(C)nc1C(F)F)c1ccccc1[O-] ZINC000877758381 643539198 /nfs/dbraw/zinc/53/91/98/643539198.db2.gz XDGADDNGCCEJBR-VIFPVBQESA-N 0 3 281.306 2.914 20 10 CFCDHN COc1cc(Cl)cc(CN[C@@H](C)c2ccnn2C)c1O ZINC000877763280 643542514 /nfs/dbraw/zinc/54/25/14/643542514.db2.gz SWGRRDNHZFHXBD-VIFPVBQESA-N 0 3 295.770 2.639 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CC(C)(C)O ZINC000878566008 643943096 /nfs/dbraw/zinc/94/30/96/643943096.db2.gz YGSSFRJSLRYXSZ-OAHLLOKOSA-N 0 3 295.423 2.516 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CC(C)(C)O ZINC000878566008 643943099 /nfs/dbraw/zinc/94/30/99/643943099.db2.gz YGSSFRJSLRYXSZ-OAHLLOKOSA-N 0 3 295.423 2.516 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N[C@@H]1CCCC[C@H]1C)c1ccccc1[O-] ZINC000879647612 644361996 /nfs/dbraw/zinc/36/19/96/644361996.db2.gz GCTNYFIJNOJTJK-UMVBOHGHSA-N 0 3 290.407 2.738 20 10 CFCDHN CCS(=O)(=O)CCCCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649411 644362584 /nfs/dbraw/zinc/36/25/84/644362584.db2.gz RENDEIXWEBTXJH-CYBMUJFWSA-N 0 3 299.436 2.648 20 10 CFCDHN CCC(C)(C)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649075 644363424 /nfs/dbraw/zinc/36/34/24/644363424.db2.gz LHFAWKFPFRAXTM-VXGBXAGGSA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)C(=O)NC1CCCCC1)c1ccccc1[O-] ZINC000879648962 644363507 /nfs/dbraw/zinc/36/35/07/644363507.db2.gz HQHMKMDMMNYSHZ-OLZOCXBDSA-N 0 3 290.407 2.880 20 10 CFCDHN C[C@H]([NH2+]CCCCn1ccnc1)c1cc(F)ccc1[O-] ZINC000094618011 650960416 /nfs/dbraw/zinc/96/04/16/650960416.db2.gz BKLCJDFZRGPJEW-LBPRGKRZSA-N 0 3 277.343 2.859 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618029 650960434 /nfs/dbraw/zinc/96/04/34/650960434.db2.gz YFJIWNZXTJSDDR-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC3(CCC3)O2)c([O-])c1 ZINC000883365220 645771941 /nfs/dbraw/zinc/77/19/41/645771941.db2.gz WOAUYGAZOXNINB-OAHLLOKOSA-N 0 3 291.391 2.982 20 10 CFCDHN CN(C)c1ccc(CN(C)C[C@H]2CCCCO2)cc1F ZINC000131909095 645849398 /nfs/dbraw/zinc/84/93/98/645849398.db2.gz ITLZEASVQFYZAC-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN C[C@H](NC1CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000132666422 645948462 /nfs/dbraw/zinc/94/84/62/645948462.db2.gz ATBIHAITKAEIJK-NSHDSACASA-N 0 3 280.799 2.990 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2[O-])cc1C ZINC000134236380 646309772 /nfs/dbraw/zinc/30/97/72/646309772.db2.gz YTJVFIGGEOSARJ-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN COc1ccc(C[NH2+]CC2CCSCC2)c([O-])c1 ZINC000134608919 646370504 /nfs/dbraw/zinc/37/05/04/646370504.db2.gz BJYYXNQITRDIHB-UHFFFAOYSA-N 0 3 267.394 2.634 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504300 647022436 /nfs/dbraw/zinc/02/24/36/647022436.db2.gz ZSSZFXGRVKZPLO-FPMFFAJLSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504300 647022441 /nfs/dbraw/zinc/02/24/41/647022441.db2.gz ZSSZFXGRVKZPLO-FPMFFAJLSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504300 647022443 /nfs/dbraw/zinc/02/24/43/647022443.db2.gz ZSSZFXGRVKZPLO-FPMFFAJLSA-N 0 3 278.371 2.809 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886612669 647066850 /nfs/dbraw/zinc/06/68/50/647066850.db2.gz QZLVEFBXJSFEKM-NEPJUHHUSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@H+](C)C[C@@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886612669 647066858 /nfs/dbraw/zinc/06/68/58/647066858.db2.gz QZLVEFBXJSFEKM-NEPJUHHUSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@@H+](C)C[C@@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886612669 647066861 /nfs/dbraw/zinc/06/68/61/647066861.db2.gz QZLVEFBXJSFEKM-NEPJUHHUSA-N 0 3 268.376 2.911 20 10 CFCDHN CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1(C)C ZINC000300419443 647331287 /nfs/dbraw/zinc/33/12/87/647331287.db2.gz WPUIUIWGUOULFR-OWYVNGRQSA-N 0 3 267.344 2.995 20 10 CFCDHN COc1cc([C@H](C)NCCCSc2nccs2)on1 ZINC000925103405 648106031 /nfs/dbraw/zinc/10/60/31/648106031.db2.gz QIQVPSVGSQBUTR-VIFPVBQESA-N 0 3 299.421 2.973 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCO[C@H]2CCOC2)c1[O-] ZINC000927081040 648701517 /nfs/dbraw/zinc/70/15/17/648701517.db2.gz MVLQARPCEBMAKN-YPMHNXCESA-N 0 3 299.798 2.810 20 10 CFCDHN CCC[N@H+](Cc1cnn(CCF)c1)Cc1ccccc1[O-] ZINC000929753700 649111820 /nfs/dbraw/zinc/11/18/20/649111820.db2.gz UUPJQDRGCYJQTL-UHFFFAOYSA-N 0 3 291.370 2.970 20 10 CFCDHN CCC[N@@H+](Cc1cnn(CCF)c1)Cc1ccccc1[O-] ZINC000929753700 649111824 /nfs/dbraw/zinc/11/18/24/649111824.db2.gz UUPJQDRGCYJQTL-UHFFFAOYSA-N 0 3 291.370 2.970 20 10 CFCDHN CC(C)(O)c1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000187504464 649820094 /nfs/dbraw/zinc/82/00/94/649820094.db2.gz XCUUQHABVGQRGA-UHFFFAOYSA-N 0 3 271.360 2.909 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc(F)ccc2[O-])CCC[C@@]1(C)O ZINC001140057722 770114865 /nfs/dbraw/zinc/11/48/65/770114865.db2.gz LGGRUDZDDRRXDU-XHDPSFHLSA-N 0 3 267.344 2.514 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc(F)ccc2[O-])CCC[C@@]1(C)O ZINC001140057722 770114869 /nfs/dbraw/zinc/11/48/69/770114869.db2.gz LGGRUDZDDRRXDU-XHDPSFHLSA-N 0 3 267.344 2.514 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000721417640 770136078 /nfs/dbraw/zinc/13/60/78/770136078.db2.gz RHSLNQBYXLPMNM-ZYHUDNBSSA-N 0 3 275.270 2.592 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C2CC2)[C@H]2CCCOC2)c1 ZINC000724011809 770748810 /nfs/dbraw/zinc/74/88/10/770748810.db2.gz SCAJJJKPFHCUJS-WMLDXEAASA-N 0 3 275.392 2.995 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)c1[O-] ZINC000724814577 775114224 /nfs/dbraw/zinc/11/42/24/775114224.db2.gz ROUHLDMEZNCYLV-MFKMUULPSA-N 0 3 297.782 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1[O-] ZINC000724814577 775114233 /nfs/dbraw/zinc/11/42/33/775114233.db2.gz ROUHLDMEZNCYLV-MFKMUULPSA-N 0 3 297.782 2.665 20 10 CFCDHN C[C@@H]([NH2+]CC1SCCS1)c1ccccc1[O-] ZINC000692825135 776346034 /nfs/dbraw/zinc/34/60/34/776346034.db2.gz AMJSZKOHBOWZSJ-SECBINFHSA-N 0 3 255.408 2.849 20 10 CFCDHN COc1ccc(C[N@@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC000711475646 777210552 /nfs/dbraw/zinc/21/05/52/777210552.db2.gz JTWPZNXUFDVNLX-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN COc1ccc(C[N@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC000711475646 777210556 /nfs/dbraw/zinc/21/05/56/777210556.db2.gz JTWPZNXUFDVNLX-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN COC1(C)CN(Cc2c(O)ccc3ccccc32)C1 ZINC001231588950 777268374 /nfs/dbraw/zinc/26/83/74/777268374.db2.gz ZNJRXXXIRNYSGC-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@]12CCOC2 ZINC001231589635 777269124 /nfs/dbraw/zinc/26/91/24/777269124.db2.gz NWHHOAWHHUEKKF-KRWDZBQOSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@]12CCOC2 ZINC001231589635 777269130 /nfs/dbraw/zinc/26/91/30/777269130.db2.gz NWHHOAWHHUEKKF-KRWDZBQOSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCC[C@@H]1CO ZINC001231588139 777269364 /nfs/dbraw/zinc/26/93/64/777269364.db2.gz MUDNECDGXOQRRT-CQSZACIVSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCC[C@@H]1CO ZINC001231588139 777269369 /nfs/dbraw/zinc/26/93/69/777269369.db2.gz MUDNECDGXOQRRT-CQSZACIVSA-N 0 3 271.360 2.892 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCc3cccc([O-])c3C2)c1O ZINC001231592140 777271281 /nfs/dbraw/zinc/27/12/81/777271281.db2.gz DAVVGWBTKNDCSY-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1cccc(C[N@H+]2CCc3cccc([O-])c3C2)c1O ZINC001231592140 777271288 /nfs/dbraw/zinc/27/12/88/777271288.db2.gz DAVVGWBTKNDCSY-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1cc(C)c(CN2CCc3cnccc3C2)c(O)c1 ZINC001231842173 777344377 /nfs/dbraw/zinc/34/43/77/777344377.db2.gz KMLIKHMWLARFQE-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN [O-]c1c(C[N@H+]2C[C@H](F)C[C@H](CO)C2)ccc2ccccc12 ZINC001231879619 777363876 /nfs/dbraw/zinc/36/38/76/777363876.db2.gz KWJLIOHSYHSTRS-SWLSCSKDSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1c(C[N@@H+]2C[C@H](F)C[C@H](CO)C2)ccc2ccccc12 ZINC001231879619 777363882 /nfs/dbraw/zinc/36/38/82/777363882.db2.gz KWJLIOHSYHSTRS-SWLSCSKDSA-N 0 3 289.350 2.698 20 10 CFCDHN CN1CC2(C1)CC[NH+](Cc1cccc(Cl)c1[O-])CC2 ZINC001231914434 777382603 /nfs/dbraw/zinc/38/26/03/777382603.db2.gz LKIHLRWJPWDLIL-UHFFFAOYSA-N 0 3 280.799 2.573 20 10 CFCDHN CCCN(C)Cc1c2ccccc2n(C)c1C(=O)OC ZINC001232402048 777549045 /nfs/dbraw/zinc/54/90/45/777549045.db2.gz SATYWKHFIVBGQX-UHFFFAOYSA-N 0 3 274.364 2.807 20 10 CFCDHN COC(=O)c1c(CN(C)C(C)C)c2ccccc2n1C ZINC001232402658 777549225 /nfs/dbraw/zinc/54/92/25/777549225.db2.gz ZNUOVUSUTMGIDL-UHFFFAOYSA-N 0 3 274.364 2.805 20 10 CFCDHN CC[N@H+](Cc1c[nH]c2ncncc12)Cc1ccccc1[O-] ZINC001232658957 777632824 /nfs/dbraw/zinc/63/28/24/777632824.db2.gz OSGUTFBANNPEIY-UHFFFAOYSA-N 0 3 282.347 2.637 20 10 CFCDHN CC[N@@H+](Cc1c[nH]c2ncncc12)Cc1ccccc1[O-] ZINC001232658957 777632828 /nfs/dbraw/zinc/63/28/28/777632828.db2.gz OSGUTFBANNPEIY-UHFFFAOYSA-N 0 3 282.347 2.637 20 10 CFCDHN COCOc1cccc(C[N@@H+]2CCc3cccc([O-])c3C2)c1 ZINC001233282629 777864302 /nfs/dbraw/zinc/86/43/02/777864302.db2.gz YQESKEKJNYOVLT-UHFFFAOYSA-N 0 3 299.370 2.933 20 10 CFCDHN COCOc1cccc(C[N@H+]2CCc3cccc([O-])c3C2)c1 ZINC001233282629 777864312 /nfs/dbraw/zinc/86/43/12/777864312.db2.gz YQESKEKJNYOVLT-UHFFFAOYSA-N 0 3 299.370 2.933 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c1[O-] ZINC001233287801 777870796 /nfs/dbraw/zinc/87/07/96/777870796.db2.gz HVJFXPPBKBUESH-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@@H]2CO)c1[O-] ZINC001233287801 777870803 /nfs/dbraw/zinc/87/08/03/777870803.db2.gz HVJFXPPBKBUESH-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CC[C@H](C)SC2)c([O-])c1 ZINC000689522292 778225404 /nfs/dbraw/zinc/22/54/04/778225404.db2.gz SEDGKCXHJVXHQR-CMPLNLGQSA-N 0 3 267.394 2.775 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235676906 778534101 /nfs/dbraw/zinc/53/41/01/778534101.db2.gz WVUBUUCXCZBKLJ-BXUZGUMPSA-N 0 3 263.381 2.645 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235676906 778534104 /nfs/dbraw/zinc/53/41/04/778534104.db2.gz WVUBUUCXCZBKLJ-BXUZGUMPSA-N 0 3 263.381 2.645 20 10 CFCDHN C[N@H+](CCC1OCCO1)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680089 778534429 /nfs/dbraw/zinc/53/44/29/778534429.db2.gz SCNNVOWOVNHNHI-UHFFFAOYSA-N 0 3 293.407 2.885 20 10 CFCDHN C[N@@H+](CCC1OCCO1)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680089 778534433 /nfs/dbraw/zinc/53/44/33/778534433.db2.gz SCNNVOWOVNHNHI-UHFFFAOYSA-N 0 3 293.407 2.885 20 10 CFCDHN Cc1ccc(C)n1-c1ccc(CN2C[C@@H](N)[C@@H](F)C2)cc1 ZINC001235894199 778595009 /nfs/dbraw/zinc/59/50/09/778595009.db2.gz VWWIEYFDGLTCEX-DLBZAZTESA-N 0 3 287.382 2.575 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN(C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236236710 778746794 /nfs/dbraw/zinc/74/67/94/778746794.db2.gz LNKPVEHVHVLWFE-AWEZNQCLSA-N 0 3 280.799 2.762 20 10 CFCDHN C[N@H+](CCO)Cc1cc(-c2ccc(F)cc2)ccc1[O-] ZINC001236257321 778755575 /nfs/dbraw/zinc/75/55/75/778755575.db2.gz ZUWZOGTURXPYJL-UHFFFAOYSA-N 0 3 275.323 2.622 20 10 CFCDHN C[N@@H+](CCO)Cc1cc(-c2ccc(F)cc2)ccc1[O-] ZINC001236257321 778755578 /nfs/dbraw/zinc/75/55/78/778755578.db2.gz ZUWZOGTURXPYJL-UHFFFAOYSA-N 0 3 275.323 2.622 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3C[NH2+]C[C@H]32)cc1Cl ZINC001236285661 778761078 /nfs/dbraw/zinc/76/10/78/778761078.db2.gz BDMLGWKTHZQWMQ-SMDDNHRTSA-N 0 3 294.826 2.747 20 10 CFCDHN C[NH2+]C[C@H]1CCCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001236422357 778817286 /nfs/dbraw/zinc/81/72/86/778817286.db2.gz RFUAWQMCCUUOMF-GFCCVEGCSA-N 0 3 288.313 2.595 20 10 CFCDHN CC(C)(C)OC(=O)NC/C=C/C[NH2+]Cc1ccccc1[O-] ZINC000227753000 778865783 /nfs/dbraw/zinc/86/57/83/778865783.db2.gz IJRWNOVZGPQLLI-VOTSOKGWSA-N 0 3 292.379 2.563 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](F)(CO)CC2)c([O-])c1 ZINC001236783596 778934936 /nfs/dbraw/zinc/93/49/36/778934936.db2.gz MSFRLAIJUZMBLR-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](F)(CO)CC2)c([O-])c1 ZINC001236783596 778934937 /nfs/dbraw/zinc/93/49/37/778934937.db2.gz MSFRLAIJUZMBLR-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(C[C@H]3CCO)CC2)c([O-])c1 ZINC001236787385 778937559 /nfs/dbraw/zinc/93/75/59/778937559.db2.gz UEGIXCUINARQCP-MRXNPFEDSA-N 0 3 289.419 2.939 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC001236791376 778937881 /nfs/dbraw/zinc/93/78/81/778937881.db2.gz HAQOBBSBSFUWHC-KRWDZBQOSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC001236791376 778937884 /nfs/dbraw/zinc/93/78/84/778937884.db2.gz HAQOBBSBSFUWHC-KRWDZBQOSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)c([O-])c1 ZINC001236792833 778938826 /nfs/dbraw/zinc/93/88/26/778938826.db2.gz RUIIFCPSLBYQKD-ZBFHGGJFSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c([O-])c1 ZINC001236792833 778938833 /nfs/dbraw/zinc/93/88/33/778938833.db2.gz RUIIFCPSLBYQKD-ZBFHGGJFSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@]3(C2)CC(F)(F)CO3)c([O-])c1 ZINC001236793023 778939786 /nfs/dbraw/zinc/93/97/86/778939786.db2.gz VHJOQIASCDPTSG-OAHLLOKOSA-N 0 3 297.345 2.955 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@]3(C2)CC(F)(F)CO3)c([O-])c1 ZINC001236793023 778939789 /nfs/dbraw/zinc/93/97/89/778939789.db2.gz VHJOQIASCDPTSG-OAHLLOKOSA-N 0 3 297.345 2.955 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](C)(C(=O)OC)C2)c([O-])c1 ZINC001236795629 778940471 /nfs/dbraw/zinc/94/04/71/778940471.db2.gz XCZMEDYQEVIGFE-QGZVFWFLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](C)(C(=O)OC)C2)c([O-])c1 ZINC001236795629 778940477 /nfs/dbraw/zinc/94/04/77/778940477.db2.gz XCZMEDYQEVIGFE-QGZVFWFLSA-N 0 3 291.391 2.730 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236808270 778948152 /nfs/dbraw/zinc/94/81/52/778948152.db2.gz OHKJNZNGVYFVSU-GUYCJALGSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236808270 778948154 /nfs/dbraw/zinc/94/81/54/778948154.db2.gz OHKJNZNGVYFVSU-GUYCJALGSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC001236813356 778949917 /nfs/dbraw/zinc/94/99/17/778949917.db2.gz IZXQGDALJWYCPT-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC001236813356 778949920 /nfs/dbraw/zinc/94/99/20/778949920.db2.gz IZXQGDALJWYCPT-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN OC[C@@H]1C[C@H](F)CN(Cc2cc3ccccc3cc2O)C1 ZINC001236826186 778955595 /nfs/dbraw/zinc/95/55/95/778955595.db2.gz HUTQTKXXGHFJRH-WBMJQRKESA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@H](CO)C[C@H](F)C1 ZINC001236826186 778955599 /nfs/dbraw/zinc/95/55/99/778955599.db2.gz HUTQTKXXGHFJRH-WBMJQRKESA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@H](CO)C[C@H](F)C1 ZINC001236826186 778955602 /nfs/dbraw/zinc/95/56/02/778955602.db2.gz HUTQTKXXGHFJRH-WBMJQRKESA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC001236830200 778956311 /nfs/dbraw/zinc/95/63/11/778956311.db2.gz NFCCHDLCAFFJGA-IYBDPMFKSA-N 0 3 269.344 2.624 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@@H]2COC[C@@H]2C1 ZINC001236830200 778956316 /nfs/dbraw/zinc/95/63/16/778956316.db2.gz NFCCHDLCAFFJGA-IYBDPMFKSA-N 0 3 269.344 2.624 20 10 CFCDHN C[C@@]1(O)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236828056 778956332 /nfs/dbraw/zinc/95/63/32/778956332.db2.gz ZCNQXTUHSSFHCR-MRXNPFEDSA-N 0 3 257.333 2.502 20 10 CFCDHN C[C@@]1(O)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236828056 778956337 /nfs/dbraw/zinc/95/63/37/778956337.db2.gz ZCNQXTUHSSFHCR-MRXNPFEDSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC[C@H](O)C1 ZINC001236828084 778956423 /nfs/dbraw/zinc/95/64/23/778956423.db2.gz ZTFNLDGKBZTHOF-INIZCTEOSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC[C@H](O)C1 ZINC001236828084 778956429 /nfs/dbraw/zinc/95/64/29/778956429.db2.gz ZTFNLDGKBZTHOF-INIZCTEOSA-N 0 3 271.360 2.892 20 10 CFCDHN COC(=O)C[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834684 778959198 /nfs/dbraw/zinc/95/91/98/778959198.db2.gz DVPZOLIJOUXNGD-CYBMUJFWSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)C[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834684 778959201 /nfs/dbraw/zinc/95/92/01/778959201.db2.gz DVPZOLIJOUXNGD-CYBMUJFWSA-N 0 3 299.370 2.930 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834028 778959871 /nfs/dbraw/zinc/95/98/71/778959871.db2.gz RWOSJLBHYFLJCG-HNNXBMFYSA-N 0 3 299.370 2.930 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834028 778959873 /nfs/dbraw/zinc/95/98/73/778959873.db2.gz RWOSJLBHYFLJCG-HNNXBMFYSA-N 0 3 299.370 2.930 20 10 CFCDHN CC(=O)[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236836496 778960655 /nfs/dbraw/zinc/96/06/55/778960655.db2.gz KCYNFJCBCRCRGW-OAHLLOKOSA-N 0 3 269.344 2.956 20 10 CFCDHN CC(=O)[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236836496 778960662 /nfs/dbraw/zinc/96/06/62/778960662.db2.gz KCYNFJCBCRCRGW-OAHLLOKOSA-N 0 3 269.344 2.956 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001237040453 778995971 /nfs/dbraw/zinc/99/59/71/778995971.db2.gz DFTRUCIEJLVISL-RHSMWYFYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001237040453 778995975 /nfs/dbraw/zinc/99/59/75/778995975.db2.gz DFTRUCIEJLVISL-RHSMWYFYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)CCn2cccn2)c([O-])c1 ZINC001237042029 778996284 /nfs/dbraw/zinc/99/62/84/778996284.db2.gz CYSFCJCDNPMOHE-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)CCn2cccn2)c([O-])c1 ZINC001237042029 778996286 /nfs/dbraw/zinc/99/62/86/778996286.db2.gz CYSFCJCDNPMOHE-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(C(C)=O)CC2)c([O-])c1 ZINC001237042752 778996408 /nfs/dbraw/zinc/99/64/08/778996408.db2.gz GUIBKECELUIHRM-UHFFFAOYSA-N 0 3 277.364 2.592 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@H](O)CC2)c([O-])c1 ZINC001237044913 778997174 /nfs/dbraw/zinc/99/71/74/778997174.db2.gz FRUFLSGMUFCHSZ-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@H](O)CC2)c([O-])c1 ZINC001237044913 778997177 /nfs/dbraw/zinc/99/71/77/778997177.db2.gz FRUFLSGMUFCHSZ-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC(C)(C)C[C@]1(C)CO ZINC001237484356 779117549 /nfs/dbraw/zinc/11/75/49/779117549.db2.gz CSDZPDVMQVEVGV-MRXNPFEDSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC(C)(C)C[C@]1(C)CO ZINC001237484356 779117553 /nfs/dbraw/zinc/11/75/53/779117553.db2.gz CSDZPDVMQVEVGV-MRXNPFEDSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C)[C@@](C)(O)CC1 ZINC001237485811 779117813 /nfs/dbraw/zinc/11/78/13/779117813.db2.gz UGFYMIUOSRAYDW-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C)[C@@](C)(O)CC1 ZINC001237485811 779117815 /nfs/dbraw/zinc/11/78/15/779117815.db2.gz UGFYMIUOSRAYDW-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(O)c1CN(C)Cc1cnc2ccccn12 ZINC001237484341 779118360 /nfs/dbraw/zinc/11/83/60/779118360.db2.gz CEXGJELBKYQZTL-UHFFFAOYSA-N 0 3 281.359 2.980 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237493143 779120460 /nfs/dbraw/zinc/12/04/60/779120460.db2.gz VQSNAXZGXNMICD-QGZVFWFLSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237493143 779120461 /nfs/dbraw/zinc/12/04/61/779120461.db2.gz VQSNAXZGXNMICD-QGZVFWFLSA-N 0 3 291.391 2.866 20 10 CFCDHN CO[C@@H](C)C1C[NH+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237690678 779162990 /nfs/dbraw/zinc/16/29/90/779162990.db2.gz ZJRIEZBSAHGESN-JTQLQIEISA-N 0 3 269.772 2.821 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC001238055780 779240886 /nfs/dbraw/zinc/24/08/86/779240886.db2.gz DFSPKWMXGHESPX-SWLSCSKDSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC001238055780 779240893 /nfs/dbraw/zinc/24/08/93/779240893.db2.gz DFSPKWMXGHESPX-SWLSCSKDSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(CO)CC2)c1[O-] ZINC001238064454 779242273 /nfs/dbraw/zinc/24/22/73/779242273.db2.gz PIKRGIZOJIIREX-INIZCTEOSA-N 0 3 281.371 2.824 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(CO)CC2)c1[O-] ZINC001238064454 779242280 /nfs/dbraw/zinc/24/22/80/779242280.db2.gz PIKRGIZOJIIREX-INIZCTEOSA-N 0 3 281.371 2.824 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238063595 779242925 /nfs/dbraw/zinc/24/29/25/779242925.db2.gz ZJXPQOWQACAYRK-NEPJUHHUSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238063595 779242929 /nfs/dbraw/zinc/24/29/29/779242929.db2.gz ZJXPQOWQACAYRK-NEPJUHHUSA-N 0 3 295.354 2.613 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@@H](C)C1 ZINC001238065842 779244469 /nfs/dbraw/zinc/24/44/69/779244469.db2.gz FQDLTDXBRXLHPR-FZMZJTMJSA-N 0 3 267.344 2.839 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@@H](C)C1 ZINC001238065842 779244475 /nfs/dbraw/zinc/24/44/75/779244475.db2.gz FQDLTDXBRXLHPR-FZMZJTMJSA-N 0 3 267.344 2.839 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC001238071067 779246829 /nfs/dbraw/zinc/24/68/29/779246829.db2.gz RKNINMANZFYJHA-INIZCTEOSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC001238071067 779246832 /nfs/dbraw/zinc/24/68/32/779246832.db2.gz RKNINMANZFYJHA-INIZCTEOSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(CCO3)CC2)c1[O-] ZINC001238070830 779247042 /nfs/dbraw/zinc/24/70/42/779247042.db2.gz PSNQRMRCXMSXDI-UHFFFAOYSA-N 0 3 265.328 2.595 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccccc1[O-] ZINC000690299828 779822084 /nfs/dbraw/zinc/82/20/84/779822084.db2.gz NXWMOMPDSFRQNQ-OLZOCXBDSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCC2(C1)OCCO2)c1ccccc1[O-] ZINC000715714438 780316269 /nfs/dbraw/zinc/31/62/69/780316269.db2.gz CPBRSNVMSNAKHJ-QWHCGFSZSA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCC2(C1)OCCO2)c1ccccc1[O-] ZINC000715714433 780316534 /nfs/dbraw/zinc/31/65/34/780316534.db2.gz CPBRSNVMSNAKHJ-CHWSQXEVSA-N 0 3 277.364 2.729 20 10 CFCDHN CC(C)(C)c1cccc(CN2CCN(C3CC3)CC2)c1O ZINC001143104292 780387072 /nfs/dbraw/zinc/38/70/72/780387072.db2.gz RSBIAXPEHRJVFI-UHFFFAOYSA-N 0 3 288.435 2.970 20 10 CFCDHN CN1CC=C(c2cc(F)c(N3CCOCC3)c(F)c2)CC1 ZINC001241333027 780787357 /nfs/dbraw/zinc/78/73/57/780787357.db2.gz PXYAGTVRGUXVFW-UHFFFAOYSA-N 0 3 294.345 2.520 20 10 CFCDHN C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000701923118 780856621 /nfs/dbraw/zinc/85/66/21/780856621.db2.gz GYMLKNSPVZRHSS-GFCCVEGCSA-N 0 3 294.395 2.737 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@@H]1CCSC1 ZINC000704918738 781129382 /nfs/dbraw/zinc/12/93/82/781129382.db2.gz NHUKDMUHUKTNJC-SNVBAGLBSA-N 0 3 255.358 2.764 20 10 CFCDHN CN(C)[C@@H]1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000708421153 781273811 /nfs/dbraw/zinc/27/38/11/781273811.db2.gz PXBXWARZJADONC-QWHCGFSZSA-N 0 3 284.350 2.633 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccns1)CC2 ZINC000709996562 781325172 /nfs/dbraw/zinc/32/51/72/781325172.db2.gz KGCRXRYBJHQKFO-GFCCVEGCSA-N 0 3 260.362 2.668 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000711412853 781429905 /nfs/dbraw/zinc/42/99/05/781429905.db2.gz HALHUQYSZJNLHM-ZDUSSCGKSA-N 0 3 265.328 2.723 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CCC1)[C@@H]1CCOC1 ZINC000711832348 781474028 /nfs/dbraw/zinc/47/40/28/781474028.db2.gz GQNGGHKLXLPGKS-ZBFHGGJFSA-N 0 3 261.365 2.687 20 10 CFCDHN CCCCOCCC[NH2+]Cc1cccc(C)c1[O-] ZINC000083385380 178393846 /nfs/dbraw/zinc/39/38/46/178393846.db2.gz FLKPFGBFJCMCDZ-UHFFFAOYSA-N 0 3 251.370 2.997 20 10 CFCDHN CO[C@@H](CNCc1ccc(N(C)C)c(F)c1)C(C)C ZINC000072924816 346949487 /nfs/dbraw/zinc/94/94/87/346949487.db2.gz XTLICQWAHUKCHW-HNNXBMFYSA-N 0 3 268.376 2.652 20 10 CFCDHN Cc1cccc(N(C)C(=O)c2cccc3c2CCNC3)c1 ZINC000124248408 539540166 /nfs/dbraw/zinc/54/01/66/539540166.db2.gz CWEFPEQOWINZMD-UHFFFAOYSA-N 0 3 280.371 2.917 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2cscn2)c1 ZINC000104448656 186006011 /nfs/dbraw/zinc/00/60/11/186006011.db2.gz LDVLRMSKWRFWJK-SNVBAGLBSA-N 0 3 278.377 2.751 20 10 CFCDHN Cn1cc2c(n1)CCC[C@H]2[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296470113 282697832 /nfs/dbraw/zinc/69/78/32/282697832.db2.gz OJHCHLYFXLLAHQ-UKRRQHHQSA-N 0 3 283.375 2.780 20 10 CFCDHN C[C@H](O)CC(C)(C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296818488 200006960 /nfs/dbraw/zinc/00/69/60/200006960.db2.gz MAAXENINJISPJZ-WCQYABFASA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@H](CCO)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000297378496 200168179 /nfs/dbraw/zinc/16/81/79/200168179.db2.gz QVJJJNFCXUTIBC-MNOVXSKESA-N 0 3 255.333 2.591 20 10 CFCDHN C[C@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000297583648 200233388 /nfs/dbraw/zinc/23/33/88/200233388.db2.gz HGCVTJJUYHEIJH-YJBOKZPZSA-N 0 3 283.371 2.877 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCN1CC)c1ccccc1[O-] ZINC000019960449 372215536 /nfs/dbraw/zinc/21/55/36/372215536.db2.gz QKHDDYWIPPPXHV-HIFRSBDPSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)Cn1ccnc1)c1ccccc1[O-] ZINC000037157346 372658664 /nfs/dbraw/zinc/65/86/64/372658664.db2.gz FWTUSJKDFUYDQE-TZMCWYRMSA-N 0 3 259.353 2.718 20 10 CFCDHN C[C@@H](CN1CCCCC1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000037154257 372657066 /nfs/dbraw/zinc/65/70/66/372657066.db2.gz BMHHXGBJBXNVIP-KBPBESRZSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H](C)[C@@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880441 372963482 /nfs/dbraw/zinc/96/34/82/372963482.db2.gz ZKMICAGICRMYKU-VHSXEESVSA-N 0 3 251.326 2.645 20 10 CFCDHN C[C@H]1CCCC[C@@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879270 372963897 /nfs/dbraw/zinc/96/38/97/372963897.db2.gz XFNRBTYFQFULRZ-JQWIXIFHSA-N 0 3 263.337 2.789 20 10 CFCDHN CC[C@@H](CSC)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000091024907 375038508 /nfs/dbraw/zinc/03/85/08/375038508.db2.gz CHGURMZNULZTCY-NSHDSACASA-N 0 3 283.393 2.694 20 10 CFCDHN CC[C@@H](CSC)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000091024907 375038514 /nfs/dbraw/zinc/03/85/14/375038514.db2.gz CHGURMZNULZTCY-NSHDSACASA-N 0 3 283.393 2.694 20 10 CFCDHN CS[C@H]1CCCC[N@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000092064256 375085531 /nfs/dbraw/zinc/08/55/31/375085531.db2.gz REXVEKQQNGOULE-LBPRGKRZSA-N 0 3 295.404 2.838 20 10 CFCDHN CS[C@H]1CCCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000092064256 375085537 /nfs/dbraw/zinc/08/55/37/375085537.db2.gz REXVEKQQNGOULE-LBPRGKRZSA-N 0 3 295.404 2.838 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](n3cccn3)C2)c1 ZINC000092968144 375170099 /nfs/dbraw/zinc/17/00/99/375170099.db2.gz XZXCDBRUHVNKOV-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](n3cccn3)C2)c1 ZINC000092968144 375170103 /nfs/dbraw/zinc/17/01/03/375170103.db2.gz XZXCDBRUHVNKOV-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc(O)c(CN(C)[C@@H]2CCCc3c2cnn3C)c1 ZINC000093864251 375322939 /nfs/dbraw/zinc/32/29/39/375322939.db2.gz XADIXCBKVWWWDN-OAHLLOKOSA-N 0 3 285.391 2.944 20 10 CFCDHN COCCCOC1CC[NH+](Cc2cc(C)ccc2[O-])CC1 ZINC000093561545 375267631 /nfs/dbraw/zinc/26/76/31/375267631.db2.gz CMDMDCMLKDVYIP-UHFFFAOYSA-N 0 3 293.407 2.718 20 10 CFCDHN COC(=O)CC[N@H+](Cc1cc(C)c(C)cc1[O-])C(C)C ZINC000112958951 375979224 /nfs/dbraw/zinc/97/92/24/375979224.db2.gz ALOXARNDNANXHK-UHFFFAOYSA-N 0 3 279.380 2.783 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1cc(C)c(C)cc1[O-])C(C)C ZINC000112958951 375979229 /nfs/dbraw/zinc/97/92/29/375979229.db2.gz ALOXARNDNANXHK-UHFFFAOYSA-N 0 3 279.380 2.783 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1ccccc1[O-])c1ccc(F)cc1F ZINC000114509263 376073266 /nfs/dbraw/zinc/07/32/66/376073266.db2.gz CTTWUKPLGZXMQR-MRXNPFEDSA-N 0 3 293.313 2.668 20 10 CFCDHN CS[C@H]1CCC[C@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000117394444 376241068 /nfs/dbraw/zinc/24/10/68/376241068.db2.gz RCACWVLSQUYYDH-RYUDHWBXSA-N 0 3 295.404 2.885 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)N1CCCCC1)c1cc(F)ccc1[O-] ZINC000123762495 376977415 /nfs/dbraw/zinc/97/74/15/376977415.db2.gz VFWATCUNFGNVGD-LBPRGKRZSA-N 0 3 294.370 2.585 20 10 CFCDHN C[C@@H](NCc1cccc(C(N)=O)c1)c1ccc(N(C)C)cc1 ZINC000124224805 377027484 /nfs/dbraw/zinc/02/74/84/377027484.db2.gz PMXSOXUNWNIVRY-CYBMUJFWSA-N 0 3 297.402 2.702 20 10 CFCDHN CCCOc1ccc(CN2CCSCC2)c(O)c1 ZINC000126217786 377217358 /nfs/dbraw/zinc/21/73/58/377217358.db2.gz OTXQEGJKVPQYMA-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CC1CC1)C[C@@H]1CCCO1 ZINC000126957089 377256089 /nfs/dbraw/zinc/25/60/89/377256089.db2.gz VNCLUIJPFSUCEO-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CC1CC1)C[C@@H]1CCCO1 ZINC000126957089 377256098 /nfs/dbraw/zinc/25/60/98/377256098.db2.gz VNCLUIJPFSUCEO-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H](N[C@@H](C)CO)c1ccc(N2CCCCC2)c(F)c1 ZINC000127530954 377287970 /nfs/dbraw/zinc/28/79/70/377287970.db2.gz LYSNFEQSXMFSIV-QWHCGFSZSA-N 0 3 280.387 2.847 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H]2CCSC2)c1[O-] ZINC000130543382 377573238 /nfs/dbraw/zinc/57/32/38/377573238.db2.gz MGROGRJPYSUJCC-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H]2CCSC2)c1[O-] ZINC000130543382 377573246 /nfs/dbraw/zinc/57/32/46/377573246.db2.gz MGROGRJPYSUJCC-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@H]2CCCO2)c([O-])c1 ZINC000132968912 377890839 /nfs/dbraw/zinc/89/08/39/377890839.db2.gz IHTZVWZDRMDWAH-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@H]2CCCO2)c([O-])c1 ZINC000132968912 377890846 /nfs/dbraw/zinc/89/08/46/377890846.db2.gz IHTZVWZDRMDWAH-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCF)C[C@@H]1CCCO1 ZINC000137266583 378222053 /nfs/dbraw/zinc/22/20/53/378222053.db2.gz ODNOBKJDWJTFHA-AWEZNQCLSA-N 0 3 267.344 2.733 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCF)C[C@@H]1CCCO1 ZINC000137266583 378222057 /nfs/dbraw/zinc/22/20/57/378222057.db2.gz ODNOBKJDWJTFHA-AWEZNQCLSA-N 0 3 267.344 2.733 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCC(F)(F)F)c1 ZINC000148681987 378259173 /nfs/dbraw/zinc/25/91/73/378259173.db2.gz PGQMOBQZBUQZGD-UHFFFAOYSA-N 0 3 263.259 2.833 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCc2cnn(C)c2)cc1 ZINC000151147401 378300851 /nfs/dbraw/zinc/30/08/51/378300851.db2.gz KKGQDVVTUYEIJZ-CYBMUJFWSA-N 0 3 272.396 2.727 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)c1 ZINC000151438598 378326466 /nfs/dbraw/zinc/32/64/66/378326466.db2.gz KHQGBPNBWILCPU-GDBMZVCRSA-N 0 3 293.432 2.845 20 10 CFCDHN CCc1cccc(C[NH2+]CC[C@H]2CCCOC2)c1[O-] ZINC000529636881 383739438 /nfs/dbraw/zinc/73/94/38/383739438.db2.gz KOVPITYHRNRTLW-CYBMUJFWSA-N 0 3 263.381 2.861 20 10 CFCDHN COCCC1CC[NH+](Cc2cccc(C)c2[O-])CC1 ZINC000529638697 383739635 /nfs/dbraw/zinc/73/96/35/383739635.db2.gz VSGMCXVZGWCKOI-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc(CNC[C@H](n2cccn2)C(F)(F)F)c1O ZINC000529636638 383739897 /nfs/dbraw/zinc/73/98/97/383739897.db2.gz FRGMQLDIYLYABI-LBPRGKRZSA-N 0 3 299.296 2.790 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@H]2CCCO2)c1[O-] ZINC000179671152 380570493 /nfs/dbraw/zinc/57/04/93/380570493.db2.gz XEIZKOFCTDAFIZ-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CCCO2)c1[O-] ZINC000179671152 380570498 /nfs/dbraw/zinc/57/04/98/380570498.db2.gz XEIZKOFCTDAFIZ-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180207953 380633719 /nfs/dbraw/zinc/63/37/19/380633719.db2.gz GFQAMIHFRDOTDG-LLVKDONJSA-N 0 3 295.354 2.695 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180207953 380633723 /nfs/dbraw/zinc/63/37/23/380633723.db2.gz GFQAMIHFRDOTDG-LLVKDONJSA-N 0 3 295.354 2.695 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccccc1[O-] ZINC000179882369 380591843 /nfs/dbraw/zinc/59/18/43/380591843.db2.gz FROJRWTVQNPDCY-HIFRSBDPSA-N 0 3 271.360 2.646 20 10 CFCDHN Cc1ccc(C[N@H+](CCO)Cc2ccccc2[O-])cc1 ZINC000180845718 380705468 /nfs/dbraw/zinc/70/54/68/380705468.db2.gz VBBHAIJBZHFEDY-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN Cc1ccc(C[N@@H+](CCO)Cc2ccccc2[O-])cc1 ZINC000180845718 380705474 /nfs/dbraw/zinc/70/54/74/380705474.db2.gz VBBHAIJBZHFEDY-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN CCN1CC[C@H]([N@H+](C)Cc2cccc(C)c2[O-])[C@H](C)C1 ZINC000180415398 380654513 /nfs/dbraw/zinc/65/45/13/380654513.db2.gz OAEDDICGDOKFFR-ZBFHGGJFSA-N 0 3 276.424 2.863 20 10 CFCDHN CCN1CC[C@H]([N@@H+](C)Cc2cccc(C)c2[O-])[C@H](C)C1 ZINC000180415398 380654516 /nfs/dbraw/zinc/65/45/16/380654516.db2.gz OAEDDICGDOKFFR-ZBFHGGJFSA-N 0 3 276.424 2.863 20 10 CFCDHN CCC(C)(C)[NH2+]Cc1cc(OC)c(OC)cc1[O-] ZINC000181376284 380784107 /nfs/dbraw/zinc/78/41/07/380784107.db2.gz RFCRONXMMMWLNF-UHFFFAOYSA-N 0 3 253.342 2.688 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCOC[C@H]2C)c1[O-] ZINC000289207555 381028880 /nfs/dbraw/zinc/02/88/80/381028880.db2.gz BTQPBAVPFGQBEP-MNOVXSKESA-N 0 3 299.798 2.816 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@H](C)C2)c1 ZINC000182449903 381091698 /nfs/dbraw/zinc/09/16/98/381091698.db2.gz OFXQEQFZGCLCIQ-KBPBESRZSA-N 0 3 292.423 2.783 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295861582 381122608 /nfs/dbraw/zinc/12/26/08/381122608.db2.gz GOHMIDODKWTGBM-AWEZNQCLSA-N 0 3 271.364 2.633 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)c1cccc(F)c1)CC2 ZINC000295999215 381205025 /nfs/dbraw/zinc/20/50/25/381205025.db2.gz OFOQGMYATCLYGD-GDBMZVCRSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccccc1[O-] ZINC000183427472 381271489 /nfs/dbraw/zinc/27/14/89/381271489.db2.gz FGWQFIJKAVKCKE-LBPRGKRZSA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccccc1[O-] ZINC000183431212 381272305 /nfs/dbraw/zinc/27/23/05/381272305.db2.gz RUVXMIYEBGIBJL-ZDUSSCGKSA-N 0 3 274.408 2.917 20 10 CFCDHN COC(=O)C1CCN(Cc2cc(Cl)cc(C)c2O)CC1 ZINC000183486880 381277070 /nfs/dbraw/zinc/27/70/70/381277070.db2.gz LYNBUCVYXLJANE-UHFFFAOYSA-N 0 3 297.782 2.739 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(Oc3cnccn3)CC2)c1 ZINC000369697877 381317483 /nfs/dbraw/zinc/31/74/83/381317483.db2.gz SXZDHNKLOHNCBF-UHFFFAOYSA-N 0 3 299.374 2.534 20 10 CFCDHN Cc1ccc(O)c(CN2CCC(Oc3cnccn3)CC2)c1 ZINC000369697877 381317489 /nfs/dbraw/zinc/31/74/89/381317489.db2.gz SXZDHNKLOHNCBF-UHFFFAOYSA-N 0 3 299.374 2.534 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC(C)(CO)CC2)c1[O-] ZINC000184073276 381365522 /nfs/dbraw/zinc/36/55/22/381365522.db2.gz QFEPNLIXFDSHQF-UHFFFAOYSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cccc(CN(C)CCNC(=O)OC(C)(C)C)c1O ZINC000296474808 381411850 /nfs/dbraw/zinc/41/18/50/381411850.db2.gz HSWACUBUCIRRQA-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@H](OC)C2)c1O ZINC000184681134 381458716 /nfs/dbraw/zinc/45/87/16/381458716.db2.gz FURMOEOCMQTZGL-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184692935 381461316 /nfs/dbraw/zinc/46/13/16/381461316.db2.gz JIFHLZVYZIQNAJ-LLVKDONJSA-N 0 3 299.798 2.913 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184692935 381461323 /nfs/dbraw/zinc/46/13/23/381461323.db2.gz JIFHLZVYZIQNAJ-LLVKDONJSA-N 0 3 299.798 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)CCOCC2CC2)c1[O-] ZINC000184700871 381462758 /nfs/dbraw/zinc/46/27/58/381462758.db2.gz PTOCEMVVNMEQML-UHFFFAOYSA-N 0 3 299.798 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)CCOCC2CC2)c1[O-] ZINC000184700871 381462763 /nfs/dbraw/zinc/46/27/63/381462763.db2.gz PTOCEMVVNMEQML-UHFFFAOYSA-N 0 3 299.798 2.913 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000296596614 381464759 /nfs/dbraw/zinc/46/47/59/381464759.db2.gz VIZXAYSMSMYBNT-TVQRCGJNSA-N 0 3 253.317 2.749 20 10 CFCDHN CC[C@@H](C[NH2+][C@H](C)c1cc(OC)ccc1[O-])N1CCCC1 ZINC000184990854 381508170 /nfs/dbraw/zinc/50/81/70/381508170.db2.gz NLXDVMXUTMLREX-KGLIPLIRSA-N 0 3 292.423 2.926 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCOC1CCOCC1)CC2 ZINC000296706044 381514662 /nfs/dbraw/zinc/51/46/62/381514662.db2.gz HXGGMKFVYXFYKH-HNNXBMFYSA-N 0 3 291.391 2.555 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185030531 381516511 /nfs/dbraw/zinc/51/65/11/381516511.db2.gz YHYINZDLZDWNTK-LBPRGKRZSA-N 0 3 296.386 2.831 20 10 CFCDHN CCCN1CC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000185112754 381539855 /nfs/dbraw/zinc/53/98/55/381539855.db2.gz KBEXTNOYDXOSFR-QWHCGFSZSA-N 0 3 280.387 2.914 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCNC(=O)c2ccccc2)c1 ZINC000185203008 381562642 /nfs/dbraw/zinc/56/26/42/381562642.db2.gz MOVJPCZZTXIXGT-AWEZNQCLSA-N 0 3 298.386 2.781 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1ccc(C)cc1[O-])C1CC1 ZINC000185308207 381593540 /nfs/dbraw/zinc/59/35/40/381593540.db2.gz XREQEXAVJAWPCR-CYBMUJFWSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)O)c1cc2c(cc1[O-])CCCC2 ZINC000185413936 381626084 /nfs/dbraw/zinc/62/60/84/381626084.db2.gz NDTIOBGKGRQBLF-LLVKDONJSA-N 0 3 263.381 2.693 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c([O-])c1 ZINC000185475617 381644021 /nfs/dbraw/zinc/64/40/21/381644021.db2.gz YFWSAZNZXRZESX-BUXKBTBVSA-N 0 3 283.437 2.898 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c1 ZINC000185474870 381644369 /nfs/dbraw/zinc/64/43/69/381644369.db2.gz CUMJPXJJXLONOX-HXPMCKFVSA-N 0 3 283.437 2.898 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909360 381671900 /nfs/dbraw/zinc/67/19/00/381671900.db2.gz YXXNKVGQUCWZQB-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909360 381671910 /nfs/dbraw/zinc/67/19/10/381671910.db2.gz YXXNKVGQUCWZQB-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909360 381671914 /nfs/dbraw/zinc/67/19/14/381671914.db2.gz YXXNKVGQUCWZQB-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909360 381671919 /nfs/dbraw/zinc/67/19/19/381671919.db2.gz YXXNKVGQUCWZQB-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[C@H](CCO)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185500369 381651911 /nfs/dbraw/zinc/65/19/11/381651911.db2.gz RAWMOKCKSOXMCS-NEPJUHHUSA-N 0 3 263.381 2.693 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185605599 381678499 /nfs/dbraw/zinc/67/84/99/381678499.db2.gz IDIVBPBEDWJDHW-CHWSQXEVSA-N 0 3 281.396 2.850 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185605542 381679303 /nfs/dbraw/zinc/67/93/03/381679303.db2.gz IDIVBPBEDWJDHW-STQMWFEESA-N 0 3 281.396 2.850 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@]2(C)CCCC[C@@H]2O)c1 ZINC000185644166 381692120 /nfs/dbraw/zinc/69/21/20/381692120.db2.gz ANPVKUUBMRBLHJ-AFAVFJNCSA-N 0 3 293.407 2.993 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C2(CO)Cc3ccccc3C2)cc1C ZINC000371799019 381703124 /nfs/dbraw/zinc/70/31/24/381703124.db2.gz IOLMOIRNPPGERA-UHFFFAOYSA-N 0 3 297.398 2.629 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000360023391 381734555 /nfs/dbraw/zinc/73/45/55/381734555.db2.gz ZBWTUDCPFRFRRK-UHFFFAOYSA-N 0 3 275.327 2.634 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1cc2c(cc1[O-])CCCC2 ZINC000185830612 381748055 /nfs/dbraw/zinc/74/80/55/381748055.db2.gz UVGMPPJONPGEGW-DVOMOZLQSA-N 0 3 287.403 2.859 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CC(=O)N(C(C)(C)C)C2)c1 ZINC000186085921 381821043 /nfs/dbraw/zinc/82/10/43/381821043.db2.gz ZRWFSZPKKQNSKE-QWHCGFSZSA-N 0 3 290.407 2.751 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CC(=O)N(C(C)(C)C)C1)c1cc(F)ccc1[O-] ZINC000186086630 381821423 /nfs/dbraw/zinc/82/14/23/381821423.db2.gz WRKHDYNHHGFTBT-PWSUYJOCSA-N 0 3 294.370 2.581 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)NCCS(=O)(=O)C(C)(C)C)c1 ZINC000186027642 381805398 /nfs/dbraw/zinc/80/53/98/381805398.db2.gz LOFFNXKHOLUBPY-GFCCVEGCSA-N 0 3 299.436 2.565 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1C[C@H](CO)c2ccccc21 ZINC000373636707 382023214 /nfs/dbraw/zinc/02/32/14/382023214.db2.gz XIPBNODSAUYMPV-CZUORRHYSA-N 0 3 269.344 2.703 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1[O-])C(C)(C)O ZINC000293574510 382181129 /nfs/dbraw/zinc/18/11/29/382181129.db2.gz HHBXPUZOGDCVMX-GFCCVEGCSA-N 0 3 287.787 2.693 20 10 CFCDHN COCC(C)(C)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000293672863 382225652 /nfs/dbraw/zinc/22/56/52/382225652.db2.gz MTTABUXBCMUBJP-NSHDSACASA-N 0 3 267.369 2.724 20 10 CFCDHN COC1(C[NH2+]Cc2cc(F)ccc2[O-])CCCCC1 ZINC000187462813 382188933 /nfs/dbraw/zinc/18/89/33/382188933.db2.gz TZPKCDGXMWCHLJ-UHFFFAOYSA-N 0 3 267.344 2.970 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000293728710 382254850 /nfs/dbraw/zinc/25/48/50/382254850.db2.gz OFDYQHCGTSAMCP-STQMWFEESA-N 0 3 278.396 2.595 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCc2cnn(C)c2)c([O-])c1 ZINC000293751787 382264070 /nfs/dbraw/zinc/26/40/70/382264070.db2.gz OENWACKVEVPLLM-ZDUSSCGKSA-N 0 3 273.380 2.636 20 10 CFCDHN CCC[C@@H](CNCc1ccc(OC)c(C)c1)OC ZINC000293763571 382269443 /nfs/dbraw/zinc/26/94/43/382269443.db2.gz VCMLYQVWWIZURN-AWEZNQCLSA-N 0 3 251.370 2.908 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000377633983 382306971 /nfs/dbraw/zinc/30/69/71/382306971.db2.gz WESRWBMANAPYOP-GUYCJALGSA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000377633983 382306975 /nfs/dbraw/zinc/30/69/75/382306975.db2.gz WESRWBMANAPYOP-GUYCJALGSA-N 0 3 291.391 2.964 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCSCCCO)c([O-])c1 ZINC000293960337 382353771 /nfs/dbraw/zinc/35/37/71/382353771.db2.gz ZWKOQCIYXQDTHJ-ZDUSSCGKSA-N 0 3 283.437 2.775 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCc3nc(C)ncc3C2)cc1C ZINC000377836412 382355499 /nfs/dbraw/zinc/35/54/99/382355499.db2.gz ALNXUMKYOGPABP-INIZCTEOSA-N 0 3 297.402 2.755 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c1 ZINC000294025091 382383549 /nfs/dbraw/zinc/38/35/49/382383549.db2.gz NTWLQPXLXWZQKQ-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)c1 ZINC000294025091 382383554 /nfs/dbraw/zinc/38/35/54/382383554.db2.gz NTWLQPXLXWZQKQ-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cccc(C)c1[O-])OC ZINC000294141324 382432100 /nfs/dbraw/zinc/43/21/00/382432100.db2.gz GKSGZLPVLSHCFL-SMDDNHRTSA-N 0 3 251.370 2.851 20 10 CFCDHN COC[C@]1(C)CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000294175073 382446414 /nfs/dbraw/zinc/44/64/14/382446414.db2.gz JROTYKYXDKNGPC-OAHLLOKOSA-N 0 3 299.798 2.913 20 10 CFCDHN COC[C@]1(C)CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000294175073 382446418 /nfs/dbraw/zinc/44/64/18/382446418.db2.gz JROTYKYXDKNGPC-OAHLLOKOSA-N 0 3 299.798 2.913 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@H](C)c1ccccc1[O-])C2 ZINC000378617600 382491558 /nfs/dbraw/zinc/49/15/58/382491558.db2.gz BEPUDEKXRZJMGG-OLZOCXBDSA-N 0 3 271.364 2.563 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])OC ZINC000294320328 382508174 /nfs/dbraw/zinc/50/81/74/382508174.db2.gz WQRLZZMCPKCKFD-IINYFYTJSA-N 0 3 255.333 2.682 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCO2)c1[O-] ZINC000295126287 382576343 /nfs/dbraw/zinc/57/63/43/382576343.db2.gz XJTDGNREAUTYJW-GFCCVEGCSA-N 0 3 255.745 2.623 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@]2(CCO[C@H]2C)C1 ZINC000367294854 382562525 /nfs/dbraw/zinc/56/25/25/382562525.db2.gz NKOQMNZZRCUELY-YSVLISHTSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@]2(CCO[C@H]2C)C1 ZINC000367294854 382562527 /nfs/dbraw/zinc/56/25/27/382562527.db2.gz NKOQMNZZRCUELY-YSVLISHTSA-N 0 3 291.391 2.723 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])CC1(C)C ZINC000295122700 382577248 /nfs/dbraw/zinc/57/72/48/382577248.db2.gz XOOBYEBEVFAKST-CQSZACIVSA-N 0 3 267.344 2.778 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])CC1(C)C ZINC000295122700 382577250 /nfs/dbraw/zinc/57/72/50/382577250.db2.gz XOOBYEBEVFAKST-CQSZACIVSA-N 0 3 267.344 2.778 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1 ZINC000295253360 382600120 /nfs/dbraw/zinc/60/01/20/382600120.db2.gz QNQQPVMYKCMPGN-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c1 ZINC000295253360 382600124 /nfs/dbraw/zinc/60/01/24/382600124.db2.gz QNQQPVMYKCMPGN-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN CC1(C)C[C@@H](O)CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000295254840 382601139 /nfs/dbraw/zinc/60/11/39/382601139.db2.gz QQMQXBNFIOSOIK-ZDUSSCGKSA-N 0 3 267.344 2.514 20 10 CFCDHN CC1(C)C[C@@H](O)CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000295254840 382601144 /nfs/dbraw/zinc/60/11/44/382601144.db2.gz QQMQXBNFIOSOIK-ZDUSSCGKSA-N 0 3 267.344 2.514 20 10 CFCDHN C[C@](O)(CC[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000189827978 382642032 /nfs/dbraw/zinc/64/20/32/382642032.db2.gz JQZUXLXNIKMPBE-KRWDZBQOSA-N 0 3 271.360 2.780 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCC[C@H]2CCO)c([O-])c1 ZINC000189968488 382647575 /nfs/dbraw/zinc/64/75/75/382647575.db2.gz YAACVJFCGWKEDH-BBRMVZONSA-N 0 3 293.407 2.822 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)[C@H]2CCOC2)c([O-])c1 ZINC000266139867 384091640 /nfs/dbraw/zinc/09/16/40/384091640.db2.gz GQSXHMDKHSEYDU-JSGCOSHPSA-N 0 3 279.380 2.696 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)[C@@H]2CCOC2)c([O-])c1 ZINC000266139877 384092687 /nfs/dbraw/zinc/09/26/87/384092687.db2.gz GQSXHMDKHSEYDU-TZMCWYRMSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC[N@H+](CCC(C)(C)O)Cc1ccccc1[O-] ZINC000267360691 384367745 /nfs/dbraw/zinc/36/77/45/384367745.db2.gz CHZBYSYWSNFKBM-UHFFFAOYSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[N@@H+](CCC(C)(C)O)Cc1ccccc1[O-] ZINC000267360691 384367750 /nfs/dbraw/zinc/36/77/50/384367750.db2.gz CHZBYSYWSNFKBM-UHFFFAOYSA-N 0 3 251.370 2.765 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1cccc(F)c1 ZINC000267219155 384327517 /nfs/dbraw/zinc/32/75/17/384327517.db2.gz SJLJDHTUVANQNN-BZNIZROVSA-N 0 3 275.323 2.743 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@](C)(O)CC2)cc1F ZINC000279693987 384725333 /nfs/dbraw/zinc/72/53/33/384725333.db2.gz QDMKGOZFYXFREO-INIZCTEOSA-N 0 3 280.387 2.629 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NC[C@@H](O)C(F)(F)F)cc1 ZINC000268859544 384679258 /nfs/dbraw/zinc/67/92/58/384679258.db2.gz RPOJTFAIYRBOAV-GXFFZTMASA-N 0 3 290.329 2.717 20 10 CFCDHN Cc1nccn1CCN(Cc1ccc(N(C)C)cc1)C1CC1 ZINC000270658502 385178621 /nfs/dbraw/zinc/17/86/21/385178621.db2.gz OABPHJXANOCODU-UHFFFAOYSA-N 0 3 298.434 2.922 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)CN(CC)CC ZINC000282406836 385303876 /nfs/dbraw/zinc/30/38/76/385303876.db2.gz FRFKZHWOVOJHPB-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c1[O-] ZINC000282367600 385295570 /nfs/dbraw/zinc/29/55/70/385295570.db2.gz QCVKUIVTXUMPOX-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](OC)C[C@@H]2C)c1[O-] ZINC000282367600 385295574 /nfs/dbraw/zinc/29/55/74/385295574.db2.gz QCVKUIVTXUMPOX-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000271083466 385333083 /nfs/dbraw/zinc/33/30/83/385333083.db2.gz XVOKEKWCHDIKGY-GFCCVEGCSA-N 0 3 257.333 2.530 20 10 CFCDHN CCCC[N@H+](CCOCCOC)Cc1ccccc1[O-] ZINC000282526470 385334455 /nfs/dbraw/zinc/33/44/55/385334455.db2.gz ULDZKHXLTFBWCD-UHFFFAOYSA-N 0 3 281.396 2.657 20 10 CFCDHN CCCC[N@@H+](CCOCCOC)Cc1ccccc1[O-] ZINC000282526470 385334459 /nfs/dbraw/zinc/33/44/59/385334459.db2.gz ULDZKHXLTFBWCD-UHFFFAOYSA-N 0 3 281.396 2.657 20 10 CFCDHN CN(C)c1ccc(CN2CCC3(C2)CCOCC3)cc1F ZINC000271233493 385378054 /nfs/dbraw/zinc/37/80/54/385378054.db2.gz VJWGANIRONBEGU-UHFFFAOYSA-N 0 3 292.398 2.894 20 10 CFCDHN C[C@H](NC[C@](C)(O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000271450038 385382800 /nfs/dbraw/zinc/38/28/00/385382800.db2.gz FZXJNABFYGSSFJ-GWCFXTLKSA-N 0 3 290.329 2.717 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1 ZINC000271524597 385385292 /nfs/dbraw/zinc/38/52/92/385385292.db2.gz NJNLZAWZXGMYCC-ZBFHGGJFSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H]2CCO[C@@H](C)C2)cc1C ZINC000271554445 385385624 /nfs/dbraw/zinc/38/56/24/385385624.db2.gz UZCRGCONNAAHST-KBPBESRZSA-N 0 3 263.381 2.914 20 10 CFCDHN CCCC[N@H+](CCn1ccnc1)Cc1ccccc1[O-] ZINC000282500325 385327633 /nfs/dbraw/zinc/32/76/33/385327633.db2.gz QUPGTEHBGAKADQ-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN CCCC[N@@H+](CCn1ccnc1)Cc1ccccc1[O-] ZINC000282500325 385327636 /nfs/dbraw/zinc/32/76/36/385327636.db2.gz QUPGTEHBGAKADQ-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN CSC[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000271829576 385394051 /nfs/dbraw/zinc/39/40/51/385394051.db2.gz OOYDCZXOQPZRQV-CYBMUJFWSA-N 0 3 289.828 2.558 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H]3CCN(C)C[C@@H]32)cc1C ZINC000272329878 385511970 /nfs/dbraw/zinc/51/19/70/385511970.db2.gz VKWRRRCRMBWPFB-HOCLYGCPSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H]3CCN(C)C[C@@H]32)cc1C ZINC000272329878 385511973 /nfs/dbraw/zinc/51/19/73/385511973.db2.gz VKWRRRCRMBWPFB-HOCLYGCPSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCn2ccnc2)c([O-])c1 ZINC000284281246 385547610 /nfs/dbraw/zinc/54/76/10/385547610.db2.gz XJIFLKHDGBLKOY-AWEZNQCLSA-N 0 3 273.380 2.946 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC(C)(C)O)c([O-])c1 ZINC000284980803 385551061 /nfs/dbraw/zinc/55/10/61/385551061.db2.gz GEGFSQPBBWZRKW-LBPRGKRZSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2([S@](C)=O)CCC2)c([O-])c1 ZINC000285219851 385552246 /nfs/dbraw/zinc/55/22/46/385552246.db2.gz OVWHRSJBGGGFKT-XCLFUZPHSA-N 0 3 295.448 2.961 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@H](O)C2(C)C)c([O-])c1 ZINC000285402644 385555255 /nfs/dbraw/zinc/55/52/55/385555255.db2.gz XGPREKOBOOURGM-UBHSHLNASA-N 0 3 263.381 2.819 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1 ZINC000285414311 385555519 /nfs/dbraw/zinc/55/55/19/385555519.db2.gz XXAKQANZCZCTDM-GWCFXTLKSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C2(CCO)CCCC2)cc1C ZINC000285453329 385555592 /nfs/dbraw/zinc/55/55/92/385555592.db2.gz JEFMQDGHDKHYRT-UHFFFAOYSA-N 0 3 263.381 2.794 20 10 CFCDHN C[C@H]([NH2+]CC1(CCO)CCCC1)c1ccccc1[O-] ZINC000272869905 385637630 /nfs/dbraw/zinc/63/76/30/385637630.db2.gz OLEMZSYWKMZFIV-ZDUSSCGKSA-N 0 3 263.381 2.986 20 10 CFCDHN C[C@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000273175465 385673109 /nfs/dbraw/zinc/67/31/09/385673109.db2.gz NBXVTJQJSOSDMC-NWDGAFQWSA-N 0 3 267.344 2.826 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000273188430 385673290 /nfs/dbraw/zinc/67/32/90/385673290.db2.gz YUNUTWDSXLCLQW-SJORKVTESA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](O)CCc2ccccc2)c1 ZINC000273184071 385673587 /nfs/dbraw/zinc/67/35/87/385673587.db2.gz YBVHJUKOJIYSFY-QGZVFWFLSA-N 0 3 285.387 2.784 20 10 CFCDHN CCn1cc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])cn1 ZINC000273356886 385678391 /nfs/dbraw/zinc/67/83/91/385678391.db2.gz CWADLDLVJBOKJL-GFCCVEGCSA-N 0 3 259.353 2.768 20 10 CFCDHN Cc1noc(CCC[NH2+][C@@H](C)c2ccc(C)cc2[O-])n1 ZINC000273472239 385685321 /nfs/dbraw/zinc/68/53/21/385685321.db2.gz KAHQESDTTLIRED-NSHDSACASA-N 0 3 275.352 2.675 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000273540948 385687641 /nfs/dbraw/zinc/68/76/41/385687641.db2.gz YICZVWPQUQSROK-SCVCMEIPSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CCSCC2)c([O-])c1C ZINC000273612511 385690896 /nfs/dbraw/zinc/69/08/96/385690896.db2.gz WNOFUAAVFTYREE-AWEZNQCLSA-N 0 3 294.464 2.708 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(C)c2[O-])[C@]12CCCO2 ZINC000273712772 385694337 /nfs/dbraw/zinc/69/43/37/385694337.db2.gz GNHIVTWOQCVJOA-ZMSDIMECSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CN(C)C)c([O-])c1C ZINC000286895816 385733941 /nfs/dbraw/zinc/73/39/41/385733941.db2.gz DGXVAJMXLVELHO-AAEUAGOBSA-N 0 3 250.386 2.610 20 10 CFCDHN COc1ccc(CN[C@@H]2COc3ccccc3[C@@H]2O)cc1C ZINC000288504580 197097709 /nfs/dbraw/zinc/09/77/09/197097709.db2.gz IGIDNTWRHYYLPT-QAPCUYQASA-N 0 3 299.370 2.588 20 10 CFCDHN COc1ccc(CN[C@H]2COc3ccccc3[C@@H]2O)cc1C ZINC000288504583 197097419 /nfs/dbraw/zinc/09/74/19/197097419.db2.gz IGIDNTWRHYYLPT-YJBOKZPZSA-N 0 3 299.370 2.588 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CO)C1CCCC1)CC2 ZINC000297183858 285271711 /nfs/dbraw/zinc/27/17/11/285271711.db2.gz DZYSETMLEJXKQK-UONOGXRCSA-N 0 3 261.365 2.520 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCN2CCC[C@@H]2C1 ZINC000211615857 260021194 /nfs/dbraw/zinc/02/11/94/260021194.db2.gz SKQFNTHLHKWLDC-HIFRSBDPSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCN2CCC[C@@H]2C1 ZINC000211615857 260021195 /nfs/dbraw/zinc/02/11/95/260021195.db2.gz SKQFNTHLHKWLDC-HIFRSBDPSA-N 0 3 260.381 2.623 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1[O-] ZINC000360042753 130580527 /nfs/dbraw/zinc/58/05/27/130580527.db2.gz YELGLIWQKOEKRB-NUEKZKHPSA-N 0 3 275.392 2.994 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000374255038 393489697 /nfs/dbraw/zinc/48/96/97/393489697.db2.gz OTVLEKMHKVUTBI-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000374255038 393489703 /nfs/dbraw/zinc/48/97/03/393489703.db2.gz OTVLEKMHKVUTBI-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185122604 393531759 /nfs/dbraw/zinc/53/17/59/393531759.db2.gz JQWMTTACNIOXSO-PZDALLCQSA-N 0 3 287.334 2.840 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CC(F)(F)F ZINC000189480857 393572425 /nfs/dbraw/zinc/57/24/25/393572425.db2.gz BKYLVYJSZNGIIJ-GFCCVEGCSA-N 0 3 291.313 2.918 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CC(F)(F)F ZINC000189480857 393572430 /nfs/dbraw/zinc/57/24/30/393572430.db2.gz BKYLVYJSZNGIIJ-GFCCVEGCSA-N 0 3 291.313 2.918 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C)CC(C)(C)OC)c1 ZINC000119076031 393913911 /nfs/dbraw/zinc/91/39/11/393913911.db2.gz ZQYZORSNVHFQGK-LLVKDONJSA-N 0 3 267.369 2.694 20 10 CFCDHN COCC1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000119294614 393917142 /nfs/dbraw/zinc/91/71/42/393917142.db2.gz UBSLPUHAMOIPJL-UHFFFAOYSA-N 0 3 280.387 2.750 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CCO)Cc2ccccc2)c1 ZINC000271018802 394015947 /nfs/dbraw/zinc/01/59/47/394015947.db2.gz SRXTYFCZQZRZRS-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CCO)Cc2ccccc2)c1 ZINC000271018802 394015951 /nfs/dbraw/zinc/01/59/51/394015951.db2.gz SRXTYFCZQZRZRS-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN Cc1ccc(O)c(CN(CCO)Cc2ccccc2)c1 ZINC000271018802 394015954 /nfs/dbraw/zinc/01/59/54/394015954.db2.gz SRXTYFCZQZRZRS-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@](C)(O)C(F)(F)F ZINC000282003619 394109285 /nfs/dbraw/zinc/10/92/85/394109285.db2.gz NTEOXNUHIOUPBA-ZDUSSCGKSA-N 0 3 291.313 2.918 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@](C)(O)C(F)(F)F ZINC000282003619 394109290 /nfs/dbraw/zinc/10/92/90/394109290.db2.gz NTEOXNUHIOUPBA-ZDUSSCGKSA-N 0 3 291.313 2.918 20 10 CFCDHN OC[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000364435027 394212632 /nfs/dbraw/zinc/21/26/32/394212632.db2.gz JPRJNOHSGZMPSY-MAUKXSAKSA-N 0 3 295.382 2.932 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000298794808 260162395 /nfs/dbraw/zinc/16/23/95/260162395.db2.gz UTAFKBVDBKWSII-ZDUSSCGKSA-N 0 3 285.343 2.540 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000298794808 260162396 /nfs/dbraw/zinc/16/23/96/260162396.db2.gz UTAFKBVDBKWSII-ZDUSSCGKSA-N 0 3 285.343 2.540 20 10 CFCDHN CN1CCc2cc(CNCc3cnn4ccccc34)ccc21 ZINC000364445484 262240684 /nfs/dbraw/zinc/24/06/84/262240684.db2.gz NZIFSTOOTSWHCA-UHFFFAOYSA-N 0 3 292.386 2.616 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H](n2cncn2)C1 ZINC000364622237 262255377 /nfs/dbraw/zinc/25/53/77/262255377.db2.gz JTZUYYLMNKPRGM-ZFWWWQNUSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H](n2cncn2)C1 ZINC000364622237 262255379 /nfs/dbraw/zinc/25/53/79/262255379.db2.gz JTZUYYLMNKPRGM-ZFWWWQNUSA-N 0 3 286.379 2.772 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1COc2ccc(F)cc2C1 ZINC000367685314 267108584 /nfs/dbraw/zinc/10/85/84/267108584.db2.gz KFVZILDIEVTVRN-AWEZNQCLSA-N 0 3 291.297 2.764 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC23CCC(CO)CC3)c1 ZINC000367741702 267114706 /nfs/dbraw/zinc/11/47/06/267114706.db2.gz UZPJHKSHHULAGG-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC23CCC(CO)CC3)c1 ZINC000367741702 267114707 /nfs/dbraw/zinc/11/47/07/267114707.db2.gz UZPJHKSHHULAGG-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCN(c2ccncn2)C1)c1ccccc1[O-] ZINC000367829695 267120571 /nfs/dbraw/zinc/12/05/71/267120571.db2.gz BWUZADREADQHBA-KGLIPLIRSA-N 0 3 298.390 2.502 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[NH+]1CC([C@H]2CCOC2)C1 ZINC000368038751 267140393 /nfs/dbraw/zinc/14/03/93/267140393.db2.gz CZHUQNWSIUCAJI-SWLSCSKDSA-N 0 3 261.365 2.812 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@]2(CCCOC2)C1 ZINC000368052469 267143111 /nfs/dbraw/zinc/14/31/11/267143111.db2.gz WDOVNGZKCWIWSH-NVXWUHKLSA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@]2(CCCOC2)C1 ZINC000368052469 267143112 /nfs/dbraw/zinc/14/31/12/267143112.db2.gz WDOVNGZKCWIWSH-NVXWUHKLSA-N 0 3 291.391 2.725 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C2 ZINC000368316267 267161480 /nfs/dbraw/zinc/16/14/80/267161480.db2.gz ORBUIJHMDOTLEC-AAEUAGOBSA-N 0 3 289.354 2.702 20 10 CFCDHN Cc1c([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[O-])cnn1C ZINC000368461257 267173690 /nfs/dbraw/zinc/17/36/90/267173690.db2.gz HSJPZZPSVQKNER-OAHLLOKOSA-N 0 3 289.354 2.910 20 10 CFCDHN Cc1c([C@H]2CCC[N@H+]2Cc2cc(F)ccc2[O-])cnn1C ZINC000368461257 267173693 /nfs/dbraw/zinc/17/36/93/267173693.db2.gz HSJPZZPSVQKNER-OAHLLOKOSA-N 0 3 289.354 2.910 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOC2(CCOCC2)C1 ZINC000369594786 267252819 /nfs/dbraw/zinc/25/28/19/267252819.db2.gz LEINODMCXRZMFL-OAHLLOKOSA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOC2(CCOCC2)C1 ZINC000369594786 267252821 /nfs/dbraw/zinc/25/28/21/267252821.db2.gz LEINODMCXRZMFL-OAHLLOKOSA-N 0 3 291.391 2.725 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1C[C@@H](CO)c2ccccc21 ZINC000370392375 267315969 /nfs/dbraw/zinc/31/59/69/267315969.db2.gz YLKJCOMWIKQZKE-LRDDRELGSA-N 0 3 287.334 2.842 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCO[C@H]2C2CC2)c([O-])c1 ZINC000371219340 267374527 /nfs/dbraw/zinc/37/45/27/267374527.db2.gz KVRGKQCQGLVCLD-RDJZCZTQSA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCOC(C)(C)C2)c1 ZINC000371331850 267392477 /nfs/dbraw/zinc/39/24/77/267392477.db2.gz LCCYQSHCYRDYAN-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCOC(C)(C)C2)c1 ZINC000371331850 267392479 /nfs/dbraw/zinc/39/24/79/267392479.db2.gz LCCYQSHCYRDYAN-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)n1ncc2c1C[C@@H]([NH2+]Cc1ccccc1[O-])CC2 ZINC000365142815 276089157 /nfs/dbraw/zinc/08/91/57/276089157.db2.gz UFEKRPNPHZRVQR-HNNXBMFYSA-N 0 3 285.391 2.817 20 10 CFCDHN CCN1CCCC[C@@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297962721 276364686 /nfs/dbraw/zinc/36/46/86/276364686.db2.gz ZIQMTUBUBLRFNX-CABCVRRESA-N 0 3 274.408 2.844 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2cccc([O-])c21)C1CCOCC1 ZINC000296652297 278375563 /nfs/dbraw/zinc/37/55/63/278375563.db2.gz DLYVQYBRSRQHBL-BXUZGUMPSA-N 0 3 261.365 2.784 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000248527995 279336260 /nfs/dbraw/zinc/33/62/60/279336260.db2.gz IKZGMFLHAAAXCA-KGLIPLIRSA-N 0 3 262.397 2.836 20 10 CFCDHN COC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCO1 ZINC000278623336 293157814 /nfs/dbraw/zinc/15/78/14/293157814.db2.gz CGOIIRWZCWZTSA-RRQGHBQHSA-N 0 3 292.423 2.597 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)CC2 ZINC000295969623 304845772 /nfs/dbraw/zinc/84/57/72/304845772.db2.gz MQOPSPGBNYWSMI-GJZGRUSLSA-N 0 3 291.391 2.555 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cc(OC)ccc2[O-])C12CCC2 ZINC000181966010 329238488 /nfs/dbraw/zinc/23/84/88/329238488.db2.gz FRBIUUTUOBPLGV-JKSUJKDBSA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c([O-])c1 ZINC000527804512 330284326 /nfs/dbraw/zinc/28/43/26/330284326.db2.gz QKOXAVHLHBDPNB-YMEQNVIZSA-N 0 3 279.380 2.692 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@H]1CCCOC1)CC2 ZINC000527927045 330296745 /nfs/dbraw/zinc/29/67/45/330296745.db2.gz QRNDUDIBORPFEP-TZMCWYRMSA-N 0 3 261.365 2.786 20 10 CFCDHN COc1ccc(CC[NH2+][C@H](C)c2cc(C)ccc2[O-])cn1 ZINC000527989908 330299174 /nfs/dbraw/zinc/29/91/74/330299174.db2.gz HXKNVDWWDNVROB-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)N[C@H]2Cc3ccccc3NC2=O)c1 ZINC000528000004 330300087 /nfs/dbraw/zinc/30/00/87/330300087.db2.gz MIYLRSSNMAPNFL-WBMJQRKESA-N 0 3 296.370 2.915 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CC ZINC000282363446 520548723 /nfs/dbraw/zinc/54/87/23/520548723.db2.gz DMICEMDQTJTNAK-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CC ZINC000282363446 520548739 /nfs/dbraw/zinc/54/87/39/520548739.db2.gz DMICEMDQTJTNAK-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CCOCC(C)(C)NCc1ccc(OC)c(C)c1 ZINC000292907367 521670775 /nfs/dbraw/zinc/67/07/75/521670775.db2.gz HBXHYNZENBBJQX-UHFFFAOYSA-N 0 3 251.370 2.908 20 10 CFCDHN CN(C)c1ccc(CN(C)Cc2ccn(C)c2)cc1 ZINC000156470020 522169764 /nfs/dbraw/zinc/16/97/64/522169764.db2.gz BMXSGSBPRVUHPC-UHFFFAOYSA-N 0 3 257.381 2.723 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](CCO)C(C)C)c1[O-] ZINC000230934911 522541696 /nfs/dbraw/zinc/54/16/96/522541696.db2.gz AJILWDWDWIGICG-LBPRGKRZSA-N 0 3 287.787 2.551 20 10 CFCDHN CC(C)C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])N(C)C ZINC000226584315 519211897 /nfs/dbraw/zinc/21/18/97/519211897.db2.gz GJQFOHIGFAJAHO-AWEZNQCLSA-N 0 3 268.376 2.597 20 10 CFCDHN CC(C)CC[C@H](O)C[N@H+](C)Cc1ccccc1[O-] ZINC000280277784 519692809 /nfs/dbraw/zinc/69/28/09/519692809.db2.gz RUMKVWNWCCTRSQ-AWEZNQCLSA-N 0 3 251.370 2.621 20 10 CFCDHN CC(C)CC[C@H](O)C[N@@H+](C)Cc1ccccc1[O-] ZINC000280277784 519692812 /nfs/dbraw/zinc/69/28/12/519692812.db2.gz RUMKVWNWCCTRSQ-AWEZNQCLSA-N 0 3 251.370 2.621 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@]2(O)CCC[C@@H]2C)c([O-])c1 ZINC000293237986 520366418 /nfs/dbraw/zinc/36/64/18/520366418.db2.gz ZQMYEOGNQYTAII-GUYCJALGSA-N 0 3 293.407 2.822 20 10 CFCDHN CC1(C)CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1O ZINC000280470055 520480487 /nfs/dbraw/zinc/48/04/87/520480487.db2.gz MZDKWEBGMUNBPE-QGZVFWFLSA-N 0 3 288.435 2.880 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000293613777 520611542 /nfs/dbraw/zinc/61/15/42/520611542.db2.gz FHKFETNYUKHZLM-HIFRSBDPSA-N 0 3 292.423 2.985 20 10 CFCDHN CC[N@H+](CCOC)Cc1cc(Cl)cc(OC)c1[O-] ZINC000228593137 521134366 /nfs/dbraw/zinc/13/43/66/521134366.db2.gz VUTMYFMPPZEVIY-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN CC[N@@H+](CCOC)Cc1cc(Cl)cc(OC)c1[O-] ZINC000228593137 521134373 /nfs/dbraw/zinc/13/43/73/521134373.db2.gz VUTMYFMPPZEVIY-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000280913326 521139778 /nfs/dbraw/zinc/13/97/78/521139778.db2.gz DBKIAADFTDLECX-UPJWGTAASA-N 0 3 277.364 2.775 20 10 CFCDHN CCC[C@H](O)C[N@H+](CCC)Cc1ccccc1[O-] ZINC000295054145 521181526 /nfs/dbraw/zinc/18/15/26/521181526.db2.gz OXAFOTMYNQXZBN-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[C@H](O)C[N@@H+](CCC)Cc1ccccc1[O-] ZINC000295054145 521181536 /nfs/dbraw/zinc/18/15/36/521181536.db2.gz OXAFOTMYNQXZBN-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290464723 521338064 /nfs/dbraw/zinc/33/80/64/521338064.db2.gz NFLUJHVYHZRPMU-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290464723 521338076 /nfs/dbraw/zinc/33/80/76/521338076.db2.gz NFLUJHVYHZRPMU-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOC(C)(C)CNCc1ccc(N(C)C)c(F)c1 ZINC000275744852 521626136 /nfs/dbraw/zinc/62/61/36/521626136.db2.gz CJOLHIVAIOCDPI-UHFFFAOYSA-N 0 3 268.376 2.796 20 10 CFCDHN CCSCCN(C)Cc1ccc(N2CCOCC2)cc1 ZINC000158638450 521706190 /nfs/dbraw/zinc/70/61/90/521706190.db2.gz BLGSCGVJZUYWID-UHFFFAOYSA-N 0 3 294.464 2.708 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000245916295 521711667 /nfs/dbraw/zinc/71/16/67/521711667.db2.gz YKSOLVQLMLLCKU-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN CCc1cnc(CNCCc2ccc(N)cc2)s1 ZINC000234222260 522035377 /nfs/dbraw/zinc/03/53/77/522035377.db2.gz WBSOARRHKGYAMR-UHFFFAOYSA-N 0 3 261.394 2.620 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2c([O-])cccc2Cl)CC1 ZINC000277485171 522040779 /nfs/dbraw/zinc/04/07/79/522040779.db2.gz MYYRFQDXPHRPGO-GFCCVEGCSA-N 0 3 282.815 2.962 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c1[O-] ZINC000289675237 522536760 /nfs/dbraw/zinc/53/67/60/522536760.db2.gz ZKMAXLDYJDTMDS-TXEJJXNPSA-N 0 3 285.771 2.663 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)[C@H]2C[C@@H](OC)C2)c1[O-] ZINC000289675237 522536773 /nfs/dbraw/zinc/53/67/73/522536773.db2.gz ZKMAXLDYJDTMDS-TXEJJXNPSA-N 0 3 285.771 2.663 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](CO)CC(C)C)c1[O-] ZINC000228672120 522540817 /nfs/dbraw/zinc/54/08/17/522540817.db2.gz UEYDYVPEAHZCDA-GFCCVEGCSA-N 0 3 287.787 2.551 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2(CCO)CCCC2)c1[O-] ZINC000289510953 522541165 /nfs/dbraw/zinc/54/11/65/522541165.db2.gz OSTPGPWMUGPBCW-UHFFFAOYSA-N 0 3 299.798 2.839 20 10 CFCDHN CC[C@H]([NH2+]CCS(=O)(=O)C(C)(C)C)c1ccccc1[O-] ZINC000156558076 522595955 /nfs/dbraw/zinc/59/59/55/522595955.db2.gz VCLMWYBBMKLTLL-ZDUSSCGKSA-N 0 3 299.436 2.646 20 10 CFCDHN CC[C@@H](CSC)[N@H+](C)Cc1cccc(OC)c1[O-] ZINC000290333225 522604630 /nfs/dbraw/zinc/60/46/30/522604630.db2.gz DWQUPUXPZISYKK-LBPRGKRZSA-N 0 3 269.410 2.974 20 10 CFCDHN CC[C@@H](CSC)[N@@H+](C)Cc1cccc(OC)c1[O-] ZINC000290333225 522604637 /nfs/dbraw/zinc/60/46/37/522604637.db2.gz DWQUPUXPZISYKK-LBPRGKRZSA-N 0 3 269.410 2.974 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)C(C)C)c1ccc(C)cc1[O-] ZINC000280063975 522611260 /nfs/dbraw/zinc/61/12/60/522611260.db2.gz KOAZPWNDLZIRFZ-DZGCQCFKSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)C(F)(F)F)c1ccc(C)cc1[O-] ZINC000280121774 522628266 /nfs/dbraw/zinc/62/82/66/522628266.db2.gz OHGLBYFQMNRZKK-JQWIXIFHSA-N 0 3 277.286 2.665 20 10 CFCDHN CC[C@H]([NH2+]C[C@]1(O)CCSC1)c1ccc(C)cc1[O-] ZINC000279957416 522639405 /nfs/dbraw/zinc/63/94/05/522639405.db2.gz CDTANZMUWPHWSR-DZGCQCFKSA-N 0 3 281.421 2.609 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279996373 522688884 /nfs/dbraw/zinc/68/88/84/522688884.db2.gz FRPXPELQNDZWTK-LZWOXQAQSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1[O-])C(C)(C)O ZINC000295059989 522696416 /nfs/dbraw/zinc/69/64/16/522696416.db2.gz RBDNFTWGMDCJDP-HZMBPMFUSA-N 0 3 267.369 2.601 20 10 CFCDHN CC[C@@H]([NH2+]CCCO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279981385 522828101 /nfs/dbraw/zinc/82/81/01/522828101.db2.gz DQNYRTXHRHOJOU-GDBMZVCRSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@@H]([NH2+]CCSCCCO)c1ccc(C)cc1[O-] ZINC000280140112 522840132 /nfs/dbraw/zinc/84/01/32/522840132.db2.gz POQBFCOFJPRUJF-CQSZACIVSA-N 0 3 283.437 2.857 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000280022396 522989510 /nfs/dbraw/zinc/98/95/10/522989510.db2.gz HNVVNDFVFFASLM-TZMCWYRMSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000365836042 523107888 /nfs/dbraw/zinc/10/78/88/523107888.db2.gz GYPYUMZTQPPFAM-ZFWWWQNUSA-N 0 3 271.364 2.987 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@H](n2cccn2)C1 ZINC000365836042 523107895 /nfs/dbraw/zinc/10/78/95/523107895.db2.gz GYPYUMZTQPPFAM-ZFWWWQNUSA-N 0 3 271.364 2.987 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000228183261 523858174 /nfs/dbraw/zinc/85/81/74/523858174.db2.gz XZIJPZZQSAQDIR-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000228183261 523858179 /nfs/dbraw/zinc/85/81/79/523858179.db2.gz XZIJPZZQSAQDIR-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CO[C@H](C)C[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000289580592 523878175 /nfs/dbraw/zinc/87/81/75/523878175.db2.gz JYOGRKVAARORMR-SNVBAGLBSA-N 0 3 257.761 2.821 20 10 CFCDHN CO[C@H](C)C[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000289580592 523878177 /nfs/dbraw/zinc/87/81/77/523878177.db2.gz JYOGRKVAARORMR-SNVBAGLBSA-N 0 3 257.761 2.821 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2Cc1cc(C)ccc1[O-] ZINC000289638318 524023803 /nfs/dbraw/zinc/02/38/03/524023803.db2.gz MHHTUUXKNIQPGJ-RFLUGMABSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1cc(C)ccc1[O-] ZINC000289638318 524023804 /nfs/dbraw/zinc/02/38/04/524023804.db2.gz MHHTUUXKNIQPGJ-RFLUGMABSA-N 0 3 273.376 2.556 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2ccccc2O)c(OC)n1 ZINC000289597685 524083775 /nfs/dbraw/zinc/08/37/75/524083775.db2.gz BJWIFIKJOWAVOZ-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000062748265 524167709 /nfs/dbraw/zinc/16/77/09/524167709.db2.gz XNKJHDZPFZZJFF-GHMZBOCLSA-N 0 3 254.349 2.522 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c1[O-] ZINC000291306521 524404802 /nfs/dbraw/zinc/40/48/02/524404802.db2.gz RFCABEHJJCEREU-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c1[O-] ZINC000291306521 524404809 /nfs/dbraw/zinc/40/48/09/524404809.db2.gz RFCABEHJJCEREU-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c1[O-] ZINC000291306518 524407993 /nfs/dbraw/zinc/40/79/93/524407993.db2.gz RFCABEHJJCEREU-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c1[O-] ZINC000291306518 524408001 /nfs/dbraw/zinc/40/80/01/524408001.db2.gz RFCABEHJJCEREU-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)c1[O-] ZINC000291609343 524433835 /nfs/dbraw/zinc/43/38/35/524433835.db2.gz QXODIJHZVYCOLP-HKUYNNGSSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c1[O-] ZINC000290273426 524435179 /nfs/dbraw/zinc/43/51/79/524435179.db2.gz YDNOQDBVNWWIBL-SUMWQHHRSA-N 0 3 271.360 2.912 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2(O)CCCCCC2)c1 ZINC000087088710 524750214 /nfs/dbraw/zinc/75/02/14/524750214.db2.gz IMKFGPPTOVUTPC-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2COc3ccccc32)c1 ZINC000070528442 524755398 /nfs/dbraw/zinc/75/53/98/524755398.db2.gz KXIOYSRIUWAYPC-CQSZACIVSA-N 0 3 271.316 2.624 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCc2c[nH]nc2C)c1 ZINC000050182441 524762945 /nfs/dbraw/zinc/76/29/45/524762945.db2.gz KFTOUESWMOSTSK-GFCCVEGCSA-N 0 3 289.379 2.716 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCSC2)c1 ZINC000230667612 524765745 /nfs/dbraw/zinc/76/57/45/524765745.db2.gz PCBOFWPVDARNKL-ZJUUUORDSA-N 0 3 253.367 2.557 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCCCC2)c1 ZINC000049574525 524770338 /nfs/dbraw/zinc/77/03/38/524770338.db2.gz RHKCOZUWKOFMRJ-ZDUSSCGKSA-N 0 3 278.396 2.537 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccnc(OC)c2)c1 ZINC000062057811 524771846 /nfs/dbraw/zinc/77/18/46/524771846.db2.gz HYYJIMWHJCZVDJ-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCCC[C@@H]2O)c1 ZINC000085976861 524772115 /nfs/dbraw/zinc/77/21/15/524772115.db2.gz MQVRLCKZQXJFEJ-HUBLWGQQSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccsc1CNCc1cccc(OC)c1O ZINC000289418145 524878170 /nfs/dbraw/zinc/87/81/70/524878170.db2.gz IRPHKIZPCLGPDH-UHFFFAOYSA-N 0 3 279.361 2.761 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(F)cc1[O-] ZINC000062744774 525309574 /nfs/dbraw/zinc/30/95/74/525309574.db2.gz VBRNPYOEJMFTPM-NSHDSACASA-N 0 3 268.376 2.770 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](CO)CC2CCC2)cc1C ZINC000279676575 525323276 /nfs/dbraw/zinc/32/32/76/525323276.db2.gz IMOYMKUVEFTEKP-HNNXBMFYSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCC(=O)OC(C)(C)C)cc1C ZINC000174434362 525323714 /nfs/dbraw/zinc/32/37/14/525323714.db2.gz LUXRRFCBZFEOMO-UHFFFAOYSA-N 0 3 279.380 2.830 20 10 CFCDHN CSC1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000297076618 525338034 /nfs/dbraw/zinc/33/80/34/525338034.db2.gz WPJCOLMHJTURHH-ZDUSSCGKSA-N 0 3 293.432 2.881 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2(CO)CC3(CCC3)C2)c1 ZINC000278624209 525345825 /nfs/dbraw/zinc/34/58/25/525345825.db2.gz JZUUFONMUMHING-UHFFFAOYSA-N 0 3 275.392 2.733 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCN3CCCC[C@H]23)c1 ZINC000036997084 525365149 /nfs/dbraw/zinc/36/51/49/525365149.db2.gz MAUUJODTONCJNA-CWRNSKLLSA-N 0 3 274.408 2.978 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H](O)c1ccccc1 ZINC000290242825 525434554 /nfs/dbraw/zinc/43/45/54/525434554.db2.gz UUNVGLDYJWYLDT-MEDUHNTESA-N 0 3 275.323 2.743 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094616946 525439139 /nfs/dbraw/zinc/43/91/39/525439139.db2.gz LBNZOBSQWWKTBX-OCCSQVGLSA-N 0 3 297.370 2.768 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCCN2C)c1ccnn1C ZINC000192780806 525451208 /nfs/dbraw/zinc/45/12/08/525451208.db2.gz JOJVNUKUBSDAKQ-ZDUSSCGKSA-N 0 3 284.407 2.653 20 10 CFCDHN C[C@@H]([NH2+]CCOc1ncccc1F)c1cc(F)ccc1[O-] ZINC000273496033 525456431 /nfs/dbraw/zinc/45/64/31/525456431.db2.gz PAWVHKKKQWRWBB-SNVBAGLBSA-N 0 3 294.301 2.795 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1ccccc1[O-] ZINC000272916030 525507439 /nfs/dbraw/zinc/50/74/39/525507439.db2.gz XKNQTHRQQHXAKC-OLZOCXBDSA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)C1CCCC1)c1cc(F)ccc1[O-] ZINC000290122892 525540332 /nfs/dbraw/zinc/54/03/32/525540332.db2.gz JLCDNIIWCLOAMO-HZMBPMFUSA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000062999531 525595258 /nfs/dbraw/zinc/59/52/58/525595258.db2.gz XNEKQJUDDODELO-SWLSCSKDSA-N 0 3 257.333 2.776 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCOCC1)c1cc(F)ccc1[O-] ZINC000186235012 525606925 /nfs/dbraw/zinc/60/69/25/525606925.db2.gz KWQZZLRLEASNJA-JQWIXIFHSA-N 0 3 253.317 2.751 20 10 CFCDHN C[C@H](N[C@H]1CCCc2c[nH]nc21)c1ccccc1O ZINC000272846849 525614405 /nfs/dbraw/zinc/61/44/05/525614405.db2.gz KJQLNZQIMVKFNT-GWCFXTLKSA-N 0 3 257.337 2.844 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCN(c2ncccn2)C1)c1ccccc1[O-] ZINC000192815484 525676218 /nfs/dbraw/zinc/67/62/18/525676218.db2.gz YSYXNZDGMWGVJK-KGLIPLIRSA-N 0 3 298.390 2.502 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cn[nH]c2)c([O-])c1C ZINC000289997202 525728070 /nfs/dbraw/zinc/72/80/70/525728070.db2.gz YWDFDNXXRQPXNE-GFCCVEGCSA-N 0 3 259.353 2.625 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC[C@@H]2CCCO2)c([O-])c1 ZINC000020146915 525920133 /nfs/dbraw/zinc/92/01/33/525920133.db2.gz SGXHEXYEMCGHHS-GJZGRUSLSA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000037649050 525923066 /nfs/dbraw/zinc/92/30/66/525923066.db2.gz IAACUQGPBGHZGM-KBPBESRZSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])cnn1C ZINC000094617582 525924833 /nfs/dbraw/zinc/92/48/33/525924833.db2.gz WBFJDLJJMCSHCB-ZJUUUORDSA-N 0 3 277.343 2.985 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cn2cccn2)c([O-])c1 ZINC000037154475 525939760 /nfs/dbraw/zinc/93/97/60/525939760.db2.gz FZTXLAKBRYVUIW-OLZOCXBDSA-N 0 3 259.353 2.636 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@H](O)c2ccccc2)c1[O-] ZINC000289562264 526017370 /nfs/dbraw/zinc/01/73/70/526017370.db2.gz YTYSHZPMIVRLFS-HNNXBMFYSA-N 0 3 287.359 2.614 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)CC2(OC)CCC2)c1[O-] ZINC000289448572 526033922 /nfs/dbraw/zinc/03/39/22/526033922.db2.gz MVESXVLGKXRJKE-GFCCVEGCSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1nnc(CC[NH2+][C@H](C)c2cc(C)ccc2[O-])s1 ZINC000289657490 526329272 /nfs/dbraw/zinc/32/92/72/526329272.db2.gz GOCUAEGUZUFFQL-SNVBAGLBSA-N 0 3 277.393 2.754 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCc1ccccn1)CC2 ZINC000297103605 526368652 /nfs/dbraw/zinc/36/86/52/526368652.db2.gz XTHKOMXTLCCPFV-HNNXBMFYSA-N 0 3 268.360 2.997 20 10 CFCDHN OCCN(Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000271051867 527549980 /nfs/dbraw/zinc/54/99/80/527549980.db2.gz APYSJYOIKYDOJX-UHFFFAOYSA-N 0 3 274.408 2.634 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(CCO)CCCC2)c([O-])c1 ZINC000744448595 574074802 /nfs/dbraw/zinc/07/48/02/574074802.db2.gz MBYSSWICUOAAFB-UHFFFAOYSA-N 0 3 293.407 2.823 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCSC[C@@H](C)C1 ZINC000754156305 574078485 /nfs/dbraw/zinc/07/84/85/574078485.db2.gz PBRFZJJHLGCTAY-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCSC[C@@H](C)C1 ZINC000754156305 574078487 /nfs/dbraw/zinc/07/84/87/574078487.db2.gz PBRFZJJHLGCTAY-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN CC[N@@H+](Cc1cc(C)cc(OC)c1[O-])C[C@@H]1CCOC1 ZINC000754731408 574117312 /nfs/dbraw/zinc/11/73/12/574117312.db2.gz AWDUMMOPVNKFSU-ZDUSSCGKSA-N 0 3 279.380 2.568 20 10 CFCDHN CC[N@H+](Cc1cc(C)cc(OC)c1[O-])C[C@@H]1CCOC1 ZINC000754731408 574117314 /nfs/dbraw/zinc/11/73/14/574117314.db2.gz AWDUMMOPVNKFSU-ZDUSSCGKSA-N 0 3 279.380 2.568 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCCC[C@H]2C2OCCO2)c1 ZINC000754731856 574117645 /nfs/dbraw/zinc/11/76/45/574117645.db2.gz KLKQGNGJFKONRC-HNNXBMFYSA-N 0 3 291.391 2.736 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)CC2CC2)c([O-])c1C ZINC000756768600 574129374 /nfs/dbraw/zinc/12/93/74/574129374.db2.gz FRDCKZIRWOFSIZ-OCCSQVGLSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)CC2CC2)c([O-])c1C ZINC000756768602 574129388 /nfs/dbraw/zinc/12/93/88/574129388.db2.gz FRDCKZIRWOFSIZ-TZMCWYRMSA-N 0 3 263.381 2.821 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC([NH+]2CCCCC2)CC1 ZINC000732276639 574149328 /nfs/dbraw/zinc/14/93/28/574149328.db2.gz NZUIKDGABDAJTK-UHFFFAOYSA-N 0 3 294.420 2.544 20 10 CFCDHN CN(C)CCOc1ccc(N(C)Cc2ccccn2)cc1 ZINC000732410901 574156625 /nfs/dbraw/zinc/15/66/25/574156625.db2.gz MEXBWPQGPYEYBK-UHFFFAOYSA-N 0 3 285.391 2.658 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])CC1(O)CCCC1 ZINC000747619801 574203480 /nfs/dbraw/zinc/20/34/80/574203480.db2.gz STNZFIDHADQXGQ-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])CC1(O)CCCC1 ZINC000747619801 574203481 /nfs/dbraw/zinc/20/34/81/574203481.db2.gz STNZFIDHADQXGQ-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN Cc1nn(C)c2ncc(C[NH2+]Cc3cc(C)ccc3[O-])cc12 ZINC000733326906 574221617 /nfs/dbraw/zinc/22/16/17/574221617.db2.gz CWISKNXOZOLPOP-UHFFFAOYSA-N 0 3 296.374 2.581 20 10 CFCDHN Cc1nn(C)c2ncc(CNCc3cc(C)ccc3O)cc12 ZINC000733326906 574221621 /nfs/dbraw/zinc/22/16/21/574221621.db2.gz CWISKNXOZOLPOP-UHFFFAOYSA-N 0 3 296.374 2.581 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCCC(=O)N(C)C)c2c1c(F)ccc2[O-] ZINC000756480145 574239830 /nfs/dbraw/zinc/23/98/30/574239830.db2.gz REORXHAIMDWJAG-CMPLNLGQSA-N 0 3 294.370 2.538 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@](C)(CC)CC(=O)OC)c1 ZINC000748242179 574242440 /nfs/dbraw/zinc/24/24/40/574242440.db2.gz JIINVANOGLPRQV-INIZCTEOSA-N 0 3 295.379 2.612 20 10 CFCDHN C[C@@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)N(C)C ZINC000756537014 574244389 /nfs/dbraw/zinc/24/43/89/574244389.db2.gz YVJBJGMCSSAHIN-JFGNBEQYSA-N 0 3 266.360 2.619 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCSCCCO)c2c1c(F)ccc2[O-] ZINC000756541649 574245119 /nfs/dbraw/zinc/24/51/19/574245119.db2.gz GNGKEIWYASDAKI-CMPLNLGQSA-N 0 3 299.411 2.785 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000756551715 574246223 /nfs/dbraw/zinc/24/62/23/574246223.db2.gz ALLIJQBASXQTAI-JFGNBEQYSA-N 0 3 265.328 2.848 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756552541 574246668 /nfs/dbraw/zinc/24/66/68/574246668.db2.gz GFXNJGPSRVJTNC-VPJDZLOFSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOc2cccnc2)c([O-])c1 ZINC000756572287 574249398 /nfs/dbraw/zinc/24/93/98/574249398.db2.gz MLZPJSULHYFLFN-CYBMUJFWSA-N 0 3 272.348 2.825 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000756576639 574249931 /nfs/dbraw/zinc/24/99/31/574249931.db2.gz VFLMTYAUSGJZHW-XEZLXBQYSA-N 0 3 279.355 2.973 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC[C@H]1C)c1cc(F)ccc1[O-] ZINC000756617117 574252484 /nfs/dbraw/zinc/25/24/84/574252484.db2.gz MIRCJGKNNVDOPX-VXGBXAGGSA-N 0 3 266.360 2.666 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@]2(O)CCSC2)c([O-])c1C ZINC000756637599 574253916 /nfs/dbraw/zinc/25/39/16/574253916.db2.gz NZQVPZAZOHIBDF-SWLSCSKDSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C2CCC(C(N)=O)CC2)c([O-])c1C ZINC000756703531 574258075 /nfs/dbraw/zinc/25/80/75/574258075.db2.gz DJBFLFOHQNRSAU-IYXRBSQSSA-N 0 3 290.407 2.704 20 10 CFCDHN COCCOC[C@@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756732004 574259495 /nfs/dbraw/zinc/25/94/95/574259495.db2.gz FIVBLNXVSJJLOY-TZMCWYRMSA-N 0 3 281.396 2.711 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[S@@](C)=O)c([O-])c1C ZINC000756762118 574260501 /nfs/dbraw/zinc/26/05/01/574260501.db2.gz OPTSNDDABHUVAV-MJLGCCKJSA-N 0 3 283.437 2.817 20 10 CFCDHN COC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])CCOCC1 ZINC000756759272 574261187 /nfs/dbraw/zinc/26/11/87/574261187.db2.gz JFBORYDHPXVEIR-AWEZNQCLSA-N 0 3 293.407 2.855 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCNC(=O)C(C)C)c([O-])c1C ZINC000756775419 574261815 /nfs/dbraw/zinc/26/18/15/574261815.db2.gz HFJWOFAEVLTINR-AWEZNQCLSA-N 0 3 292.423 2.822 20 10 CFCDHN Cc1cc(CN[C@H]2C[C@@H](C)c3c2c(O)ccc3F)ncn1 ZINC000756775430 574261884 /nfs/dbraw/zinc/26/18/84/574261884.db2.gz HKSATHZMGAAFAA-RNCFNFMXSA-N 0 3 287.338 2.968 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H](CO)CC2CC2)c2c1c(F)ccc2[O-] ZINC000756770480 574261902 /nfs/dbraw/zinc/26/19/02/574261902.db2.gz XTBLTPTZUFGPKW-SUZMYJTESA-N 0 3 279.355 2.830 20 10 CFCDHN CNC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756773861 574261936 /nfs/dbraw/zinc/26/19/36/574261936.db2.gz CUPCCMBRBXXXOR-YUELXQCFSA-N 0 3 290.407 2.574 20 10 CFCDHN COC[C@@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756778830 574262309 /nfs/dbraw/zinc/26/23/09/574262309.db2.gz FYMPKTKJFPFAGR-KKZNHRDASA-N 0 3 253.317 2.704 20 10 CFCDHN COCC1([NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)CC1 ZINC000756852146 574268970 /nfs/dbraw/zinc/26/89/70/574268970.db2.gz YMRAHCCZVSLHRL-ONGXEEELSA-N 0 3 265.328 2.848 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@](C)(O)CCC(C)C ZINC000740899826 574273777 /nfs/dbraw/zinc/27/37/77/574273777.db2.gz FJFCJJSAPGBBOE-MRXNPFEDSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCCSC2)c([O-])c1 ZINC000749111008 574280277 /nfs/dbraw/zinc/28/02/77/574280277.db2.gz XGSUWQVTIAAWFZ-LBPRGKRZSA-N 0 3 267.394 2.776 20 10 CFCDHN C[NH+](C)CC[C@H](NC(=O)c1cc([O-])cs1)C(C)(C)C ZINC000734879929 574305881 /nfs/dbraw/zinc/30/58/81/574305881.db2.gz CMXSPJKLNHOYEN-LBPRGKRZSA-N 0 3 284.425 2.550 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCN1CCCc2ccccc21 ZINC000725849822 574330952 /nfs/dbraw/zinc/33/09/52/574330952.db2.gz YFJVTWHCDMIMDM-UHFFFAOYSA-N 0 3 282.387 2.935 20 10 CFCDHN CCSCCC[NH2+]Cc1c([O-])cccc1OC ZINC000800283310 630366741 /nfs/dbraw/zinc/36/67/41/630366741.db2.gz QVUZUSYDSUZOMB-UHFFFAOYSA-N 0 3 255.383 2.634 20 10 CFCDHN CC[N@@H+](Cc1ccc(OC)c(OC)c1[O-])CC(C)C ZINC000891619257 617687945 /nfs/dbraw/zinc/68/79/45/617687945.db2.gz AWSPPZCZIHXQCM-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN CC[N@H+](Cc1ccc(OC)c(OC)c1[O-])CC(C)C ZINC000891619257 617687947 /nfs/dbraw/zinc/68/79/47/617687947.db2.gz AWSPPZCZIHXQCM-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN CCCN(CCC)c1ccc(CNCC(=O)NCC)cc1 ZINC000119917504 618106330 /nfs/dbraw/zinc/10/63/30/618106330.db2.gz PABPOYSUSRNYOB-UHFFFAOYSA-N 0 3 291.439 2.539 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2ccccn2)c(O)c1OC ZINC000892430232 618262644 /nfs/dbraw/zinc/26/26/44/618262644.db2.gz BKBBAFYGNTVFNR-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN Cc1cc(Br)cc(C[NH2+]C2CSC2)c1[O-] ZINC000877634453 618452080 /nfs/dbraw/zinc/45/20/80/618452080.db2.gz KGQJXZCPMZCFCY-UHFFFAOYSA-N 0 3 288.210 2.668 20 10 CFCDHN COc1ccc(O)c(CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000052926148 618621102 /nfs/dbraw/zinc/62/11/02/618621102.db2.gz FMTHSEHRTJEVRY-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCOCC1CC1)CC2 ZINC000312042191 618865221 /nfs/dbraw/zinc/86/52/21/618865221.db2.gz SBCSRNWHONUMBM-CQSZACIVSA-N 0 3 261.365 2.786 20 10 CFCDHN CC(C)[C@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185434727 625726240 /nfs/dbraw/zinc/72/62/40/625726240.db2.gz HQBVTSFQHDDIEH-QMTHXVAHSA-N 0 3 255.333 2.589 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+][C@@H]2CCc3cccc([O-])c32)n1 ZINC000314593053 619085430 /nfs/dbraw/zinc/08/54/30/619085430.db2.gz SUTVZANUAGJNDA-OAHLLOKOSA-N 0 3 285.391 2.873 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000840958568 619149702 /nfs/dbraw/zinc/14/97/02/619149702.db2.gz QMUIQPOILWRDMA-HZPDHXFCSA-N 0 3 287.334 2.839 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000840958568 619149703 /nfs/dbraw/zinc/14/97/03/619149703.db2.gz QMUIQPOILWRDMA-HZPDHXFCSA-N 0 3 287.334 2.839 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2c(C)ccnc2N)c1 ZINC000894783223 619466657 /nfs/dbraw/zinc/46/66/57/619466657.db2.gz RDFPMOBJKAGQEI-LLVKDONJSA-N 0 3 287.363 2.537 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC000895546158 619552869 /nfs/dbraw/zinc/55/28/69/619552869.db2.gz KTIYWWUKMANVMG-GFCCVEGCSA-N 0 3 267.344 2.972 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC000895546158 619552871 /nfs/dbraw/zinc/55/28/71/619552871.db2.gz KTIYWWUKMANVMG-GFCCVEGCSA-N 0 3 267.344 2.972 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC000895546159 619553157 /nfs/dbraw/zinc/55/31/57/619553157.db2.gz KTIYWWUKMANVMG-LBPRGKRZSA-N 0 3 267.344 2.972 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC000895546159 619553158 /nfs/dbraw/zinc/55/31/58/619553158.db2.gz KTIYWWUKMANVMG-LBPRGKRZSA-N 0 3 267.344 2.972 20 10 CFCDHN [O-]c1cccc(F)c1CNc1cc[nH+]cc1C1CC1 ZINC000895833428 619619724 /nfs/dbraw/zinc/61/97/24/619619724.db2.gz XBHCWJRCHUHQJF-UHFFFAOYSA-N 0 3 258.296 2.838 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895847802 619622077 /nfs/dbraw/zinc/62/20/77/619622077.db2.gz VUBPYPNSZPTXRS-PBHICJAKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895847802 619622078 /nfs/dbraw/zinc/62/20/78/619622078.db2.gz VUBPYPNSZPTXRS-PBHICJAKSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCC2(C[C@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852386 619623395 /nfs/dbraw/zinc/62/33/95/619623395.db2.gz UNBQSIFPHWOVEO-YUTCNCBUSA-N 0 3 295.354 2.677 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@H](OC)CC[C@@H]2C)c([O-])c1 ZINC000895947004 619639368 /nfs/dbraw/zinc/63/93/68/619639368.db2.gz ZWDDRORHNMOYRF-SWLSCSKDSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@H](OC)CC[C@@H]2C)c([O-])c1 ZINC000895947004 619639369 /nfs/dbraw/zinc/63/93/69/619639369.db2.gz ZWDDRORHNMOYRF-SWLSCSKDSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1cc(CO)cc(C)c1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000896560737 619762601 /nfs/dbraw/zinc/76/26/01/619762601.db2.gz FOPRBVAMXWXSTN-UHFFFAOYSA-N 0 3 289.350 2.930 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(O)(C3CCC3)CC2)c([O-])c1 ZINC000897033653 619916681 /nfs/dbraw/zinc/91/66/81/619916681.db2.gz CUAZLHOWPXXWIS-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897037298 619917439 /nfs/dbraw/zinc/91/74/39/619917439.db2.gz WVWSWSYVVSXUTL-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC000897505634 620195729 /nfs/dbraw/zinc/19/57/29/620195729.db2.gz MWBCJJLOEGLBSP-CJNGLKHVSA-N 0 3 261.365 2.748 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CC[C@H](C3CC3)O2)c([O-])c1 ZINC000897512350 620199856 /nfs/dbraw/zinc/19/98/56/620199856.db2.gz XZQMZYCNSCCYNC-NVXWUHKLSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc(C[NH2+]C2CC3(C2)CO[C@@H](C)C3)c([O-])c1 ZINC000897772645 620279280 /nfs/dbraw/zinc/27/92/80/620279280.db2.gz AIJWZCATHJXVGJ-YGONEPDPSA-N 0 3 261.365 2.748 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2ccc3nonc3c2)c([O-])c1 ZINC000897994087 620315032 /nfs/dbraw/zinc/31/50/32/620315032.db2.gz LTHYPDOSXZMWJT-UHFFFAOYSA-N 0 3 299.330 2.617 20 10 CFCDHN COC(=O)C[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000898300048 620367761 /nfs/dbraw/zinc/36/77/61/620367761.db2.gz GKYNHVGMONLUFO-MRXNPFEDSA-N 0 3 299.370 2.656 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2COC[C@@H]2C2CC2)cc1F ZINC000898375748 620377169 /nfs/dbraw/zinc/37/71/69/620377169.db2.gz HDVKJLVKAUKRDG-IUODEOHRSA-N 0 3 296.361 2.545 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOC1CCSCC1 ZINC000898440260 620463288 /nfs/dbraw/zinc/46/32/88/620463288.db2.gz JDMREZRJKXDPFB-UHFFFAOYSA-N 0 3 281.421 2.702 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c([O-])c1 ZINC000903266542 621306302 /nfs/dbraw/zinc/30/63/02/621306302.db2.gz ZCLZJXOJGRWCIO-XFJVYGCCSA-N 0 3 261.365 2.919 20 10 CFCDHN COc1nn(C)cc1CN[C@@H](C)c1ccc(C)c(C)c1O ZINC000903339612 621334504 /nfs/dbraw/zinc/33/45/04/621334504.db2.gz ZQTBNIPFBDVWJA-LBPRGKRZSA-N 0 3 289.379 2.602 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C2CC(CCO)C2)c2c1c(F)ccc2[O-] ZINC000903328733 621340147 /nfs/dbraw/zinc/34/01/47/621340147.db2.gz FCVXEVOMXFVOLH-ZUYNKMSQSA-N 0 3 279.355 2.830 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCOC1 ZINC000903358377 621347563 /nfs/dbraw/zinc/34/75/63/621347563.db2.gz VJHCMZNKLSUZKQ-PBHICJAKSA-N 0 3 291.391 2.553 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC[C@H](O)C2CC2)c2c1c(F)ccc2[O-] ZINC000903404834 621360793 /nfs/dbraw/zinc/36/07/93/621360793.db2.gz ADWGLUNUXDMJRD-WQAKAFBOSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](O)C1CC1)c1ccc(C)cc1[O-] ZINC000903408530 621364157 /nfs/dbraw/zinc/36/41/57/621364157.db2.gz SBLFYSUKJOEKDR-LSDHHAIUSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2COC[C@H]2C2CC2)c([O-])c1 ZINC000903436550 621374437 /nfs/dbraw/zinc/37/44/37/621374437.db2.gz JVESIZGRAGKEQF-TUKIKUTGSA-N 0 3 261.365 2.776 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1O)c1cc(F)ccc1[O-] ZINC000903440623 621377122 /nfs/dbraw/zinc/37/71/22/621377122.db2.gz RKLAXSJHUQSVMA-IGGJQXEISA-N 0 3 287.334 2.840 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1ccccc1[O-] ZINC000183494290 625508868 /nfs/dbraw/zinc/50/88/68/625508868.db2.gz QFFVISWMPMFSLB-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1ccccc1[O-] ZINC000183615226 625520703 /nfs/dbraw/zinc/52/07/03/625520703.db2.gz UJVGNIAUWGMMDR-YUNKPMOVSA-N 0 3 289.400 2.980 20 10 CFCDHN CN(Cc1ccccc1O)C(=O)C(C)(C)N1CCCCC1 ZINC000906990872 622073772 /nfs/dbraw/zinc/07/37/72/622073772.db2.gz HIVZEEKMSUXNIT-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](C)CC(F)F ZINC000842727625 622874099 /nfs/dbraw/zinc/87/40/99/622874099.db2.gz NQRUAOBYGWRUPO-VIFPVBQESA-N 0 3 259.296 2.782 20 10 CFCDHN C[NH+](C)[C@@H](CNC(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000821948129 623011598 /nfs/dbraw/zinc/01/15/98/623011598.db2.gz KOPXEMLSBVDGOT-ZDUSSCGKSA-N 0 3 296.436 2.694 20 10 CFCDHN CS[C@@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000226612666 623085111 /nfs/dbraw/zinc/08/51/11/623085111.db2.gz JIRMMMCNLQXZCQ-NWDGAFQWSA-N 0 3 255.358 2.905 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCCCS1 ZINC000230391694 623273050 /nfs/dbraw/zinc/27/30/50/623273050.db2.gz MWVOCEFVSNKMOL-GFCCVEGCSA-N 0 3 255.358 2.907 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](C)c2cn[nH]c2)c1 ZINC000230669560 623289663 /nfs/dbraw/zinc/28/96/63/623289663.db2.gz OWDYXHLZPYESFQ-VHSXEESVSA-N 0 3 261.325 2.536 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000230672563 623290714 /nfs/dbraw/zinc/29/07/14/623290714.db2.gz CCJXEFSPNBDFJL-GHMZBOCLSA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000230672567 623290811 /nfs/dbraw/zinc/29/08/11/623290811.db2.gz CCJXEFSPNBDFJL-MNOVXSKESA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCC1)c1ccc(F)cc1[O-] ZINC000062745046 623293439 /nfs/dbraw/zinc/29/34/39/623293439.db2.gz AQYDCJRDHSSKQV-LBPRGKRZSA-N 0 3 266.360 2.668 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@]2(C)CCCOC2)c1[O-] ZINC000230935609 623310226 /nfs/dbraw/zinc/31/02/26/623310226.db2.gz QQZBRWXGFHXCLB-AWEZNQCLSA-N 0 3 285.771 2.713 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](O)CC(C)C)c1[O-] ZINC000230934269 623310470 /nfs/dbraw/zinc/31/04/70/623310470.db2.gz NDZIBFLKSUOFGG-LBPRGKRZSA-N 0 3 287.787 2.551 20 10 CFCDHN C[C@H]([NH3+])[C@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000063191322 623330614 /nfs/dbraw/zinc/33/06/14/623330614.db2.gz VIGBSIBIUVWHCP-GXFFZTMASA-N 0 3 268.788 2.747 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC(C)(C)c1ccccn1 ZINC000824582529 623528875 /nfs/dbraw/zinc/52/88/75/623528875.db2.gz AAWDJSFEEWZPEB-UHFFFAOYSA-N 0 3 286.375 2.863 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1c([O-])cccc1OC)OC ZINC000824597701 623530067 /nfs/dbraw/zinc/53/00/67/623530067.db2.gz WVMZFLARQDFPMU-ABAIWWIYSA-N 0 3 267.369 2.552 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1[O-] ZINC000824715563 623550392 /nfs/dbraw/zinc/55/03/92/623550392.db2.gz MVSQNVCPGQCMLF-ZNMIVQPWSA-N 0 3 291.391 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1[O-] ZINC000824715563 623550395 /nfs/dbraw/zinc/55/03/95/623550395.db2.gz MVSQNVCPGQCMLF-ZNMIVQPWSA-N 0 3 291.391 2.526 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824716384 623551471 /nfs/dbraw/zinc/55/14/71/623551471.db2.gz UBUYCEAVIHFUJE-IIAWOOMASA-N 0 3 279.355 2.657 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824716384 623551473 /nfs/dbraw/zinc/55/14/73/623551473.db2.gz UBUYCEAVIHFUJE-IIAWOOMASA-N 0 3 279.355 2.657 20 10 CFCDHN CC(C)[C@@H](CO)[C@H]([NH2+]Cc1ccccc1[O-])C(C)C ZINC000824847258 623577090 /nfs/dbraw/zinc/57/70/90/623577090.db2.gz XMTCBVJSEJXYPW-GDBMZVCRSA-N 0 3 265.397 2.771 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]([C@@H](CO)C2CC2)C2CC2)c1 ZINC000824847395 623577369 /nfs/dbraw/zinc/57/73/69/623577369.db2.gz YQMSUMLUIMHJPP-RDJZCZTQSA-N 0 3 275.392 2.587 20 10 CFCDHN CN1CC[C@@H]2C[N@H+](Cc3ccc4ccccc4c3[O-])C[C@@H]21 ZINC000824893310 623583744 /nfs/dbraw/zinc/58/37/44/623583744.db2.gz OWXGSKBKWNPNSY-PBHICJAKSA-N 0 3 282.387 2.681 20 10 CFCDHN CN1CC[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3[O-])C[C@@H]21 ZINC000824893310 623583748 /nfs/dbraw/zinc/58/37/48/623583748.db2.gz OWXGSKBKWNPNSY-PBHICJAKSA-N 0 3 282.387 2.681 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@H]1C[C@H](OC)C12CCC2 ZINC000825104380 623631419 /nfs/dbraw/zinc/63/14/19/623631419.db2.gz VTDMUJJAYGFZGT-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@H]1C[C@H](OC)C12CCC2 ZINC000825104380 623631423 /nfs/dbraw/zinc/63/14/23/623631423.db2.gz VTDMUJJAYGFZGT-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN CC(C)(C[NH2+]Cc1ccccc1[O-])C1(O)CCCC1 ZINC000825231648 623655031 /nfs/dbraw/zinc/65/50/31/623655031.db2.gz BGIYEJUMBXJGMX-UHFFFAOYSA-N 0 3 263.381 2.813 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H](C)C[S@](C)=O)cc1Cl ZINC000825505368 623703758 /nfs/dbraw/zinc/70/37/58/623703758.db2.gz XDTNPOCEKSDXFC-YPMLDQLKSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H](C)C[S@](C)=O)cc1Cl ZINC000825505368 623703764 /nfs/dbraw/zinc/70/37/64/623703764.db2.gz XDTNPOCEKSDXFC-YPMLDQLKSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc(Cl)cc(CN(C)Cc2cnc[nH]2)c1O ZINC000826769638 623870092 /nfs/dbraw/zinc/87/00/92/623870092.db2.gz PNIHRORCHDMJAM-UHFFFAOYSA-N 0 3 265.744 2.709 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)C2CCC2)c1[O-] ZINC000826868737 623899134 /nfs/dbraw/zinc/89/91/34/623899134.db2.gz WMJZZHJKZCWERJ-CYBMUJFWSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2C[C@H](C)C(O)[C@@H](C)C2)c1[O-] ZINC000827151658 623954872 /nfs/dbraw/zinc/95/48/72/623954872.db2.gz HRLHDFHFKZNEOZ-QWRGUYRKSA-N 0 3 283.799 2.803 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](CCF)C1 ZINC000827270789 623978006 /nfs/dbraw/zinc/97/80/06/623978006.db2.gz FZIFXYBXWMYASB-GFCCVEGCSA-N 0 3 267.344 2.972 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](CCF)C1 ZINC000827270789 623978008 /nfs/dbraw/zinc/97/80/08/623978008.db2.gz FZIFXYBXWMYASB-GFCCVEGCSA-N 0 3 267.344 2.972 20 10 CFCDHN Cn1ncc(C2CCC2)c1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000827401475 623998729 /nfs/dbraw/zinc/99/87/29/623998729.db2.gz XLBZMAXRKSNCKH-UHFFFAOYSA-N 0 3 289.354 2.822 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)c1ccccc1F)CC2 ZINC000834526743 625701926 /nfs/dbraw/zinc/70/19/26/625701926.db2.gz OLEWNFIDTRCDLX-GOEBONIOSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@@H](NC(=O)c1cccc(CN(C)C)c1)c1ccccc1O ZINC000827937213 624131376 /nfs/dbraw/zinc/13/13/76/624131376.db2.gz OWWCCPKOPIOUNE-CYBMUJFWSA-N 0 3 298.386 2.945 20 10 CFCDHN Cc1ncc2c(n1)CC[C@H]([NH2+][C@@H]1CCc3cccc([O-])c31)C2 ZINC000834508475 625698432 /nfs/dbraw/zinc/69/84/32/625698432.db2.gz MUTLNENHEAZSIZ-GOEBONIOSA-N 0 3 295.386 2.625 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1cn3c(n1)CCCC3)CC2 ZINC000834509108 625699625 /nfs/dbraw/zinc/69/96/25/625699625.db2.gz WRAIRVKAEKFPIR-OAHLLOKOSA-N 0 3 297.402 2.745 20 10 CFCDHN CC(C)CC[C@](C)(O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000180773531 625039360 /nfs/dbraw/zinc/03/93/60/625039360.db2.gz HNUANQIYQGYHIT-HNNXBMFYSA-N 0 3 269.360 2.808 20 10 CFCDHN Cc1nn(C)c(C)c1CCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834701733 625792471 /nfs/dbraw/zinc/79/24/71/625792471.db2.gz FNPUJBNTPSGWRO-INIZCTEOSA-N 0 3 299.418 2.952 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOc1ccccc1 ZINC000083445930 625850508 /nfs/dbraw/zinc/85/05/08/625850508.db2.gz CGFZEDZHBBAXKR-UHFFFAOYSA-N 0 3 261.296 2.700 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CCO)Cc1ccccc1)CC2 ZINC000834794012 625864327 /nfs/dbraw/zinc/86/43/27/625864327.db2.gz MAOSCUODHXDISA-IRXDYDNUSA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCOC[C@H]1OC)c1ccc(C)cc1[O-] ZINC000834880810 625907849 /nfs/dbraw/zinc/90/78/49/625907849.db2.gz RVRHARHRNCSQOY-JLJPHGGASA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCC2(CO)CC2)c2c1c(F)ccc2[O-] ZINC000834895968 625912763 /nfs/dbraw/zinc/91/27/63/625912763.db2.gz GFICKAMVWCYVMZ-CMPLNLGQSA-N 0 3 279.355 2.832 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)CC2 ZINC000834896276 625912863 /nfs/dbraw/zinc/91/28/63/625912863.db2.gz JIQFVWWKOOVWBM-RDBSUJKOSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834906308 625917918 /nfs/dbraw/zinc/91/79/18/625917918.db2.gz OQDCOCAOLAEHRE-RSLMWUCJSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)C2CCC2)c2c1c(F)ccc2[O-] ZINC000834905466 625918283 /nfs/dbraw/zinc/91/82/83/625918283.db2.gz ITBRUIDCQCURPH-GAJTVXKRSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@@H]2CCCCN2C1=O)c1ccccc1[O-] ZINC000834914271 625921688 /nfs/dbraw/zinc/92/16/88/625921688.db2.gz LSUNMRUGQPGSOA-QEJZJMRPSA-N 0 3 288.391 2.586 20 10 CFCDHN COC(=O)CCCCC[NH2+]Cc1ccc(C)cc1[O-] ZINC000083482109 625946015 /nfs/dbraw/zinc/94/60/15/625946015.db2.gz FEFKQIDXDSFEDR-UHFFFAOYSA-N 0 3 265.353 2.524 20 10 CFCDHN CC(C)(C)[S@@](=O)CCNCc1ccc2c(c1)CCCO2 ZINC000921752490 626106511 /nfs/dbraw/zinc/10/65/11/626106511.db2.gz SOCVMEWWIZPJLS-FQEVSTJZSA-N 0 3 295.448 2.648 20 10 CFCDHN COC1(C[NH2+][C@H](C)c2cc(F)ccc2[O-])CCC1 ZINC000186509651 626202144 /nfs/dbraw/zinc/20/21/44/626202144.db2.gz SVKXXPCFXXHBJJ-SNVBAGLBSA-N 0 3 253.317 2.751 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)c1ccccc1[O-] ZINC000922329218 626271315 /nfs/dbraw/zinc/27/13/15/626271315.db2.gz LVRABURMECSPIT-WEAAYUCLSA-N 0 3 273.376 2.856 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@]1(c2ccccc2)C[C@@H](O)C1 ZINC000922531759 626304156 /nfs/dbraw/zinc/30/41/56/626304156.db2.gz ZSWIZTSUHCNFGY-SAABIXHNSA-N 0 3 283.371 2.575 20 10 CFCDHN Oc1cc2c(cc1CN[C@@H](c1ccccn1)C1CC1)OCO2 ZINC000922586848 626318800 /nfs/dbraw/zinc/31/88/00/626318800.db2.gz RNSFOZFWUDYQNZ-QGZVFWFLSA-N 0 3 298.342 2.757 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922677912 626340217 /nfs/dbraw/zinc/34/02/17/626340217.db2.gz IEBBTPKFROOMDV-YPMHNXCESA-N 0 3 289.297 2.982 20 10 CFCDHN CCc1onc(C)c1CNCc1cccc(OC)c1O ZINC000922988867 626440215 /nfs/dbraw/zinc/44/02/15/626440215.db2.gz WDOQSKJXHNRZDQ-UHFFFAOYSA-N 0 3 276.336 2.549 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CCC(OC)CC2)c([O-])c1 ZINC000839172797 626529545 /nfs/dbraw/zinc/52/95/45/626529545.db2.gz QPRCVUBTVGNEBG-UHFFFAOYSA-N 0 3 279.380 2.838 20 10 CFCDHN C[C@H](C[N@H+](C)Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000839193258 626530938 /nfs/dbraw/zinc/53/09/38/626530938.db2.gz QYKPTTVMGKMUFN-LLVKDONJSA-N 0 3 297.370 2.941 20 10 CFCDHN C[C@H](C[N@@H+](C)Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000839193258 626530939 /nfs/dbraw/zinc/53/09/39/626530939.db2.gz QYKPTTVMGKMUFN-LLVKDONJSA-N 0 3 297.370 2.941 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc2c(c1)C(=O)NCC2)c1ccccc1[O-] ZINC000757660520 626557482 /nfs/dbraw/zinc/55/74/82/626557482.db2.gz FNJVIAMFAWXLSX-GFCCVEGCSA-N 0 3 296.370 2.529 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000760885934 626782014 /nfs/dbraw/zinc/78/20/14/626782014.db2.gz MUIWHHUFAAMZPG-XNRPHZJLSA-N 0 3 279.380 2.545 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000767926120 627295277 /nfs/dbraw/zinc/29/52/77/627295277.db2.gz AQGUVVGSNSNKIR-CQSZACIVSA-N 0 3 291.391 2.982 20 10 CFCDHN CC[N@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768437824 627342456 /nfs/dbraw/zinc/34/24/56/627342456.db2.gz JUARAJOCCMVORE-KRWDZBQOSA-N 0 3 299.370 2.840 20 10 CFCDHN CC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768437824 627342461 /nfs/dbraw/zinc/34/24/61/627342461.db2.gz JUARAJOCCMVORE-KRWDZBQOSA-N 0 3 299.370 2.840 20 10 CFCDHN CCCC[N@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC1 ZINC000768440103 627343083 /nfs/dbraw/zinc/34/30/83/627343083.db2.gz DCGVKUMZBYNNRN-HNNXBMFYSA-N 0 3 277.364 2.583 20 10 CFCDHN CCCC[N@@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC1 ZINC000768440103 627343085 /nfs/dbraw/zinc/34/30/85/627343085.db2.gz DCGVKUMZBYNNRN-HNNXBMFYSA-N 0 3 277.364 2.583 20 10 CFCDHN Cc1cccc(C[N@@H+](C)Cc2cc3c(cc2[O-])OC[C@@H]3O)c1 ZINC000768441678 627343205 /nfs/dbraw/zinc/34/32/05/627343205.db2.gz FNWSCCDLWRFVMG-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1cccc(C[N@H+](C)Cc2cc3c(cc2[O-])OC[C@@H]3O)c1 ZINC000768441678 627343212 /nfs/dbraw/zinc/34/32/12/627343212.db2.gz FNWSCCDLWRFVMG-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN COCC[N@@H+](Cc1c([O-])cccc1OC)CC(C)C ZINC000768587581 627354108 /nfs/dbraw/zinc/35/41/08/627354108.db2.gz HAKZDNJJPCULHH-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN COCC[N@H+](Cc1c([O-])cccc1OC)CC(C)C ZINC000768587581 627354111 /nfs/dbraw/zinc/35/41/11/627354111.db2.gz HAKZDNJJPCULHH-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](OC)C2)cc1F ZINC000769447845 627439828 /nfs/dbraw/zinc/43/98/28/627439828.db2.gz YINDZHKGDQUESC-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(OCC2CC2)CC1 ZINC000769502200 627448251 /nfs/dbraw/zinc/44/82/51/627448251.db2.gz WMEWDKYSSOWNOQ-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H](C)c1ccnn1C ZINC000774194326 627901399 /nfs/dbraw/zinc/90/13/99/627901399.db2.gz XCLQOERQDSVGFD-CYBMUJFWSA-N 0 3 272.396 2.645 20 10 CFCDHN COC(=O)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000775131913 627995439 /nfs/dbraw/zinc/99/54/39/627995439.db2.gz ZAMRYVVKKVXNFL-CYBMUJFWSA-N 0 3 299.370 2.959 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000776222280 628118636 /nfs/dbraw/zinc/11/86/36/628118636.db2.gz AZGDVNDMGPWITA-RISCZKNCSA-N 0 3 282.815 2.926 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[NH2+][C@H]1CCc2cn[nH]c2C1 ZINC000776247492 628121217 /nfs/dbraw/zinc/12/12/17/628121217.db2.gz DRTDPOZRUUEFRT-NSHDSACASA-N 0 3 295.745 2.555 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777440130 628226098 /nfs/dbraw/zinc/22/60/98/628226098.db2.gz UYEQMHOTCGBDDH-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777440130 628226099 /nfs/dbraw/zinc/22/60/99/628226099.db2.gz UYEQMHOTCGBDDH-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)c1[O-] ZINC000777440536 628226123 /nfs/dbraw/zinc/22/61/23/628226123.db2.gz ZDGISSIXEVOWCX-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1[O-] ZINC000777440536 628226125 /nfs/dbraw/zinc/22/61/25/628226125.db2.gz ZDGISSIXEVOWCX-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](O)C2(C)C)c2c1c(F)ccc2[O-] ZINC000779066468 628349642 /nfs/dbraw/zinc/34/96/42/628349642.db2.gz XSKMYYAPJQSFDV-MWKLQFHZSA-N 0 3 279.355 2.829 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000779084390 628350958 /nfs/dbraw/zinc/35/09/58/628350958.db2.gz VFLMTYAUSGJZHW-BQUFFADESA-N 0 3 279.355 2.973 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783515761 628715138 /nfs/dbraw/zinc/71/51/38/628715138.db2.gz AWHUELLAMLBMII-RWMBFGLXSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCOC2(CCOCC2)C1)c1ccccc1[O-] ZINC000783516499 628715704 /nfs/dbraw/zinc/71/57/04/628715704.db2.gz COUGWCQMDHRLNL-KGLIPLIRSA-N 0 3 291.391 2.771 20 10 CFCDHN CO[C@H](C[NH2+][C@H](C)c1ccccc1[O-])C(F)(F)F ZINC000783523329 628716484 /nfs/dbraw/zinc/71/64/84/628716484.db2.gz IEEUQVQLFNXQFQ-LDYMZIIASA-N 0 3 263.259 2.620 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)C[C@H](C)O)c1[O-] ZINC000783602558 628725919 /nfs/dbraw/zinc/72/59/19/628725919.db2.gz PDHMQBOHYZDVPP-ZJUUUORDSA-N 0 3 257.761 2.603 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC(C)(C)C1 ZINC000784008275 628761706 /nfs/dbraw/zinc/76/17/06/628761706.db2.gz NLGPYLPWKOCUGF-XHDPSFHLSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC(C)(C)C1 ZINC000784008275 628761708 /nfs/dbraw/zinc/76/17/08/628761708.db2.gz NLGPYLPWKOCUGF-XHDPSFHLSA-N 0 3 291.391 2.686 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2[C@@H](C)O)c([O-])c1 ZINC000785989100 628928641 /nfs/dbraw/zinc/92/86/41/628928641.db2.gz QVTQLYYPYNJKIU-ZENOOKHLSA-N 0 3 293.407 2.772 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2[C@@H](C)O)c([O-])c1 ZINC000785989100 628928643 /nfs/dbraw/zinc/92/86/43/628928643.db2.gz QVTQLYYPYNJKIU-ZENOOKHLSA-N 0 3 293.407 2.772 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCC2(CCCO2)CC1 ZINC000788251659 629053212 /nfs/dbraw/zinc/05/32/12/629053212.db2.gz WTBXUXVXBDMTGN-UHFFFAOYSA-N 0 3 261.365 2.974 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCSC2)c([O-])c1 ZINC000790486631 629242634 /nfs/dbraw/zinc/24/26/34/629242634.db2.gz XIXQUFFTKUWRBS-NSHDSACASA-N 0 3 267.394 2.634 20 10 CFCDHN C[C@@H]1COCCCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000835024716 629320364 /nfs/dbraw/zinc/32/03/64/629320364.db2.gz AARYYMFMMUHBHD-ZDTYVGOBSA-N 0 3 274.408 2.877 20 10 CFCDHN CCc1nc([C@@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835043192 629338112 /nfs/dbraw/zinc/33/81/12/629338112.db2.gz QSRAEMOFBKGGDT-FMFIFOJESA-N 0 3 299.422 2.797 20 10 CFCDHN CC(C)(C)OC(=O)[C@@]1(C)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000835068664 629368354 /nfs/dbraw/zinc/36/83/54/629368354.db2.gz AAOHFVKCZJHEJC-KRWDZBQOSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000835068664 629368356 /nfs/dbraw/zinc/36/83/56/629368356.db2.gz AAOHFVKCZJHEJC-KRWDZBQOSA-N 0 3 291.391 2.946 20 10 CFCDHN COc1ccc(CNCc2ccc(-c3cc[nH]n3)o2)c(O)c1 ZINC000793387229 629535957 /nfs/dbraw/zinc/53/59/57/629535957.db2.gz AXHHDLXYUAUCOB-UHFFFAOYSA-N 0 3 299.330 2.674 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc(-c3cc[nH]n3)o2)c([O-])c1 ZINC000793387229 629535960 /nfs/dbraw/zinc/53/59/60/629535960.db2.gz AXHHDLXYUAUCOB-UHFFFAOYSA-N 0 3 299.330 2.674 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609092 629577808 /nfs/dbraw/zinc/57/78/08/629577808.db2.gz NSDKEMCNBOKZMC-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609092 629577811 /nfs/dbraw/zinc/57/78/11/629577811.db2.gz NSDKEMCNBOKZMC-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609588 629578302 /nfs/dbraw/zinc/57/83/02/629578302.db2.gz PTRFSPKHZONZDR-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609588 629578308 /nfs/dbraw/zinc/57/83/08/629578308.db2.gz PTRFSPKHZONZDR-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000793609064 629578401 /nfs/dbraw/zinc/57/84/01/629578401.db2.gz MZFWQTVLKBPKMY-CJNGLKHVSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000793609064 629578403 /nfs/dbraw/zinc/57/84/03/629578403.db2.gz MZFWQTVLKBPKMY-CJNGLKHVSA-N 0 3 277.364 2.544 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(C(C)=O)CC1)c1ccc(C)cc1[O-] ZINC000794793378 629687140 /nfs/dbraw/zinc/68/71/40/629687140.db2.gz NZBYAAPLDCJMDJ-INIZCTEOSA-N 0 3 290.407 2.752 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794805152 629687908 /nfs/dbraw/zinc/68/79/08/629687908.db2.gz FYCZBKWWPGECBQ-BBRMVZONSA-N 0 3 274.408 2.978 20 10 CFCDHN CC[C@@H]([NH2+]CC[S@](=O)CC)c1ccc(C)cc1[O-] ZINC000794809172 629688874 /nfs/dbraw/zinc/68/88/74/629688874.db2.gz RBPVBSBYOWZYHA-FZKQIMNGSA-N 0 3 269.410 2.510 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC(=O)N(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794817794 629690254 /nfs/dbraw/zinc/69/02/54/629690254.db2.gz QWNNLIVAMFEVCX-DOMZBBRYSA-N 0 3 288.391 2.505 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000798504137 630197392 /nfs/dbraw/zinc/19/73/92/630197392.db2.gz WIZGZRZPJXHAJI-AWEZNQCLSA-N 0 3 263.381 2.671 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000798961060 630264782 /nfs/dbraw/zinc/26/47/82/630264782.db2.gz SKACAAJJLGPYLG-ZDUSSCGKSA-N 0 3 281.371 2.810 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCCN(C)C1=O ZINC000801597573 630461843 /nfs/dbraw/zinc/46/18/43/630461843.db2.gz JMPHPUPAMCUAHR-OAHLLOKOSA-N 0 3 290.407 2.615 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCCN(C)C1=O ZINC000801597573 630461844 /nfs/dbraw/zinc/46/18/44/630461844.db2.gz JMPHPUPAMCUAHR-OAHLLOKOSA-N 0 3 290.407 2.615 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCSC1 ZINC000808430291 630991090 /nfs/dbraw/zinc/99/10/90/630991090.db2.gz NQCRRWUGDDLFET-LLVKDONJSA-N 0 3 267.394 2.634 20 10 CFCDHN CC[C@H](CO)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672232 631025425 /nfs/dbraw/zinc/02/54/25/631025425.db2.gz HBSCNYMIZCAGKR-MWLCHTKSSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](O)C(F)(F)F)c1[O-] ZINC000808679927 631027333 /nfs/dbraw/zinc/02/73/33/631027333.db2.gz FGAQSBXQFXWYGV-XVKPBYJWSA-N 0 3 297.704 2.928 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCCNC2=O)c1[O-] ZINC000840825875 631232198 /nfs/dbraw/zinc/23/21/98/631232198.db2.gz CCAFWGUMGFVEDU-WDEREUQCSA-N 0 3 296.798 2.531 20 10 CFCDHN CC[C@@H]([NH2+]CCC(C)(C)S(C)(=O)=O)c1ccccc1[O-] ZINC000840877618 631248852 /nfs/dbraw/zinc/24/88/52/631248852.db2.gz ZGEQHQNDCRUIFM-CYBMUJFWSA-N 0 3 299.436 2.646 20 10 CFCDHN Cc1cc(O)c(CNc2nccn2C)c(Cl)c1 ZINC000840887571 631252608 /nfs/dbraw/zinc/25/26/08/631252608.db2.gz LNODZVXURWUOSS-UHFFFAOYSA-N 0 3 251.717 2.700 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)C(=O)NC(C)C)c1[O-] ZINC000840890890 631253435 /nfs/dbraw/zinc/25/34/35/631253435.db2.gz PHQHDAKYSJTBEH-GHMZBOCLSA-N 0 3 298.814 2.918 20 10 CFCDHN COc1ccc(C[NH2+]CCCc2cnccc2C)c([O-])c1 ZINC000809658272 631258441 /nfs/dbraw/zinc/25/84/41/631258441.db2.gz JYDYYPQVZCWTSZ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1cc(O)c(CN2CCN(C3CC3)CC2)c(Cl)c1 ZINC000840909682 631260426 /nfs/dbraw/zinc/26/04/26/631260426.db2.gz GNGNYKHGMNPMCD-UHFFFAOYSA-N 0 3 280.799 2.634 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cc(F)ccc2[O-])c1O ZINC000809740229 631275476 /nfs/dbraw/zinc/27/54/76/631275476.db2.gz QJWISRPZJPLMGE-UHFFFAOYSA-N 0 3 277.295 2.535 20 10 CFCDHN Cc1cc([O-])c(CN(C)CC[NH+]2CCCC2)c(Cl)c1 ZINC000840949463 631277249 /nfs/dbraw/zinc/27/72/49/631277249.db2.gz YCVZAFLPVGJGEY-UHFFFAOYSA-N 0 3 282.815 2.882 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1(CO)C2CC3CC(C2)CC1C3 ZINC000840962501 631285723 /nfs/dbraw/zinc/28/57/23/631285723.db2.gz HUCCRJCSBXDCRE-UHFFFAOYSA-N 0 3 287.403 2.669 20 10 CFCDHN CO[C@](C)([C@H](C)[NH2+]Cc1cc(F)ccc1[O-])C1CC1 ZINC000840961208 631285876 /nfs/dbraw/zinc/28/58/76/631285876.db2.gz SGXXKLYYIOKGDY-ZUZCIYMTSA-N 0 3 267.344 2.825 20 10 CFCDHN CC(C)(C[NH2+]Cc1ccccc1[O-])c1cccnc1 ZINC000840974656 631290990 /nfs/dbraw/zinc/29/09/90/631290990.db2.gz DNDICWHMRBBHOE-UHFFFAOYSA-N 0 3 256.349 2.855 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1cc[nH]n1 ZINC000840975715 631291741 /nfs/dbraw/zinc/29/17/41/631291741.db2.gz KXSMRQDCTYNGSR-CYBMUJFWSA-N 0 3 272.396 2.505 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1COc2c(C)cccc2C1 ZINC000810177968 631340723 /nfs/dbraw/zinc/34/07/23/631340723.db2.gz FRUJSDFDEPRUMO-AWEZNQCLSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@]3(CCC[NH2+]3)C2)c(Cl)c1 ZINC000841105712 631341117 /nfs/dbraw/zinc/34/11/17/631341117.db2.gz STMQRAZRRJXFJZ-OAHLLOKOSA-N 0 3 280.799 2.682 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)C1(O)CCOCC1)c1ccccc1[O-] ZINC000841763028 631469038 /nfs/dbraw/zinc/46/90/38/631469038.db2.gz TWLJFOWKAOFSLY-CYBMUJFWSA-N 0 3 293.407 2.611 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])CC(C)C ZINC000841888947 631488013 /nfs/dbraw/zinc/48/80/13/631488013.db2.gz VVPOISVRVIFAAK-CYBMUJFWSA-N 0 3 255.333 2.682 20 10 CFCDHN CO[C@H](CC(C)C)C[N@H+](C)Cc1ccccc1[O-] ZINC000842153714 631554386 /nfs/dbraw/zinc/55/43/86/631554386.db2.gz QJSMECUSGCMUQZ-CQSZACIVSA-N 0 3 251.370 2.885 20 10 CFCDHN CO[C@H](CC(C)C)C[N@@H+](C)Cc1ccccc1[O-] ZINC000842153714 631554387 /nfs/dbraw/zinc/55/43/87/631554387.db2.gz QJSMECUSGCMUQZ-CQSZACIVSA-N 0 3 251.370 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@@H]3CCCC[C@@H]31)[C@@H](O)CO2 ZINC000842618793 631682137 /nfs/dbraw/zinc/68/21/37/631682137.db2.gz QQAPIRJGFOOXDC-PJODQICGSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@@H]3CCCC[C@@H]31)[C@@H](O)CO2 ZINC000842618793 631682144 /nfs/dbraw/zinc/68/21/44/631682144.db2.gz QQAPIRJGFOOXDC-PJODQICGSA-N 0 3 289.375 2.583 20 10 CFCDHN CC(C)Cn1nccc1C[NH2+]Cc1ccccc1[O-] ZINC000842673240 631702028 /nfs/dbraw/zinc/70/20/28/631702028.db2.gz HTGBIRUBGHGJQP-UHFFFAOYSA-N 0 3 259.353 2.535 20 10 CFCDHN CCOc1ccc(C[N@H+](C(C)C)[C@H]2CCOC2)c([O-])c1 ZINC000812775613 631771006 /nfs/dbraw/zinc/77/10/06/631771006.db2.gz FDSZQKZCZJNASI-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@@H+](C(C)C)[C@H]2CCOC2)c([O-])c1 ZINC000812775613 631771010 /nfs/dbraw/zinc/77/10/10/631771010.db2.gz FDSZQKZCZJNASI-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@]3(CC[NH2+]C3)C2)c(Cl)c1 ZINC000843123943 631843677 /nfs/dbraw/zinc/84/36/77/631843677.db2.gz SLRCNHPOQMAYSL-MRXNPFEDSA-N 0 3 294.826 2.930 20 10 CFCDHN CCC[N@H+](Cc1ccc(OCC)cc1[O-])[C@@H]1CCN(C)C1 ZINC000843422806 631951976 /nfs/dbraw/zinc/95/19/76/631951976.db2.gz SBQIFZJPVSQWSG-OAHLLOKOSA-N 0 3 292.423 2.707 20 10 CFCDHN CCC[N@@H+](Cc1ccc(OCC)cc1[O-])[C@@H]1CCN(C)C1 ZINC000843422806 631951979 /nfs/dbraw/zinc/95/19/79/631951979.db2.gz SBQIFZJPVSQWSG-OAHLLOKOSA-N 0 3 292.423 2.707 20 10 CFCDHN CC(=O)NCC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000843427728 631955346 /nfs/dbraw/zinc/95/53/46/631955346.db2.gz KXCVCZWZLPVBPQ-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CC(=O)NCC[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000843427728 631955349 /nfs/dbraw/zinc/95/53/49/631955349.db2.gz KXCVCZWZLPVBPQ-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CCOc1ccc(C[NH2+]CC(C)(C)COC)c([O-])c1 ZINC000813790151 631960227 /nfs/dbraw/zinc/96/02/27/631960227.db2.gz JPYFPOUEUZEJDT-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2cccnc2C)cc1 ZINC000844402992 632195727 /nfs/dbraw/zinc/19/57/27/632195727.db2.gz YSZCVYKKYRJWQX-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)c2cc[nH]c(=O)c2)c([O-])c1 ZINC000815147757 632217508 /nfs/dbraw/zinc/21/75/08/632217508.db2.gz FSWKEOJJLWAKQO-NSHDSACASA-N 0 3 288.347 2.742 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)c2cc[nH]c(=O)c2)c([O-])c1 ZINC000815147756 632217684 /nfs/dbraw/zinc/21/76/84/632217684.db2.gz FSWKEOJJLWAKQO-LLVKDONJSA-N 0 3 288.347 2.742 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@]2(O)CCC[C@@H]2C)c1[O-] ZINC000816661410 632507531 /nfs/dbraw/zinc/50/75/31/632507531.db2.gz MTAFAXYDJNGXIV-XHDPSFHLSA-N 0 3 283.799 2.995 20 10 CFCDHN COc1cc(F)c(CNCc2ccccc2O)cc1OC ZINC000845929235 632599361 /nfs/dbraw/zinc/59/93/61/632599361.db2.gz KBQPXWDKQIYKIU-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(C3(O)CC3)CC2)c([O-])c1 ZINC000846008454 632611908 /nfs/dbraw/zinc/61/19/08/632611908.db2.gz NZMBPKKNIXZUSH-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN CCC[C@@H](C)[C@@H](CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000846015211 632614500 /nfs/dbraw/zinc/61/45/00/632614500.db2.gz CEYHCLMUDXYWMN-IUODEOHRSA-N 0 3 281.396 2.678 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846117761 632638971 /nfs/dbraw/zinc/63/89/71/632638971.db2.gz RDCNGVLREIWVEE-CYBMUJFWSA-N 0 3 269.291 2.632 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846117761 632638981 /nfs/dbraw/zinc/63/89/81/632638981.db2.gz RDCNGVLREIWVEE-CYBMUJFWSA-N 0 3 269.291 2.632 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846117900 632639060 /nfs/dbraw/zinc/63/90/60/632639060.db2.gz SGMNDKVTZPEZAB-LBPRGKRZSA-N 0 3 257.255 2.762 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846117900 632639065 /nfs/dbraw/zinc/63/90/65/632639065.db2.gz SGMNDKVTZPEZAB-LBPRGKRZSA-N 0 3 257.255 2.762 20 10 CFCDHN COc1cccc([C@@H](C)N[C@H](CO)c2ccsc2)c1O ZINC000846164335 632650775 /nfs/dbraw/zinc/65/07/75/632650775.db2.gz NZTGEKDFVZFXJW-ZWNOBZJWSA-N 0 3 293.388 2.847 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1ccccc1[O-] ZINC000846180117 632655099 /nfs/dbraw/zinc/65/50/99/632655099.db2.gz SAEBMUYMDOSIIQ-KUHUBIRLSA-N 0 3 297.398 2.919 20 10 CFCDHN C[C@H]([NH2+]CCC1(CO)CCC1)c1cc(F)ccc1[O-] ZINC000846210495 632661977 /nfs/dbraw/zinc/66/19/77/632661977.db2.gz NKIDUJIMUGQLIM-NSHDSACASA-N 0 3 267.344 2.735 20 10 CFCDHN C[C@@H]([NH2+]C1CCNCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817935611 632741645 /nfs/dbraw/zinc/74/16/45/632741645.db2.gz KCGUOKYLKZULNL-SECBINFHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H](NC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1[O-] ZINC000817951679 632751374 /nfs/dbraw/zinc/75/13/74/632751374.db2.gz JIZYKXKGEIQXJG-MWLCHTKSSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@@H](NC[C@H]1CCC[NH2+]1)c1cc(Cl)ccc1[O-] ZINC000817951674 632751527 /nfs/dbraw/zinc/75/15/27/632751527.db2.gz JHQZJKKBIPXLST-DGCLKSJQSA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@H](NC[C@@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1[O-] ZINC000817953011 632752548 /nfs/dbraw/zinc/75/25/48/632752548.db2.gz KFYAJJHRULYJFM-UWVGGRQHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](N)c1ccccc1)c1ccccc1[O-] ZINC000817955019 632754508 /nfs/dbraw/zinc/75/45/08/632754508.db2.gz OSXWZPQYDRRXGX-SWLSCSKDSA-N 0 3 256.349 2.743 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CN)C1CC1)c1ccc(Br)cc1[O-] ZINC000817959758 632758164 /nfs/dbraw/zinc/75/81/64/632758164.db2.gz IJTCZIRCFZGXCQ-PELKAZGASA-N 0 3 299.212 2.543 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1[O-] ZINC000817960533 632759738 /nfs/dbraw/zinc/75/97/38/632759738.db2.gz MTGVBXOQJMXLEW-MRVPVSSYSA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CCC1)c1ccc(Br)cc1[O-] ZINC000817964568 632762985 /nfs/dbraw/zinc/76/29/85/632762985.db2.gz FKCOCHLEKSYQOQ-SECBINFHSA-N 0 3 299.212 2.687 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CN)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966588 632765293 /nfs/dbraw/zinc/76/52/93/632765293.db2.gz QNRSHKKDCCOUPS-LDYMZIIASA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@H](NCC(F)(F)CN)c1cccc(C(F)(F)F)c1O ZINC000817967545 632766338 /nfs/dbraw/zinc/76/63/38/632766338.db2.gz KDJKIAUQRKQQGA-ZETCQYMHSA-N 0 3 298.255 2.656 20 10 CFCDHN CC(=O)C1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000846943685 632854831 /nfs/dbraw/zinc/85/48/31/632854831.db2.gz KYYISGHXPHGLMV-UHFFFAOYSA-N 0 3 274.408 2.862 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+](C)[C@@H]3CCOC3)c2c1 ZINC000106858161 632986691 /nfs/dbraw/zinc/98/66/91/632986691.db2.gz SOPIHYBBXAIOSU-CYBMUJFWSA-N 0 3 287.359 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+](C)[C@@H]3CCOC3)c2c1 ZINC000106858161 632986695 /nfs/dbraw/zinc/98/66/95/632986695.db2.gz SOPIHYBBXAIOSU-CYBMUJFWSA-N 0 3 287.359 2.775 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2O)c([O-])c1 ZINC000848567884 633291272 /nfs/dbraw/zinc/29/12/72/633291272.db2.gz RYVUFRXDGHLUHL-ROUUACIJSA-N 0 3 299.370 2.539 20 10 CFCDHN CCc1cccc(CN2CCOC[C@H]2C2CC2)c1O ZINC000848888376 633362769 /nfs/dbraw/zinc/36/27/69/633362769.db2.gz SGXYLZDCEFEWNG-HNNXBMFYSA-N 0 3 261.365 2.565 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H]1CCCCO1 ZINC000848927744 633411285 /nfs/dbraw/zinc/41/12/85/633411285.db2.gz MLSXVQHSFPKTCQ-HIFRSBDPSA-N 0 3 267.344 2.969 20 10 CFCDHN COc1ccc(CNC(=[NH2+])Nc2ccccc2)c([O-])c1 ZINC000849093126 633484339 /nfs/dbraw/zinc/48/43/39/633484339.db2.gz JMUPMNAWTZYJKU-UHFFFAOYSA-N 0 3 271.320 2.537 20 10 CFCDHN CCCn1nccc1CNCc1ccc2c(c1)CCCN2C ZINC000850099678 633840597 /nfs/dbraw/zinc/84/05/97/633840597.db2.gz SVOBZBOBBLPUKM-UHFFFAOYSA-N 0 3 298.434 2.965 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccco3)C2)cc1 ZINC000850346271 633948463 /nfs/dbraw/zinc/94/84/63/633948463.db2.gz RJWZSKAVTWMSFC-CYBMUJFWSA-N 0 3 272.348 2.657 20 10 CFCDHN C[C@@H](CN1CCC(C)CC1)[NH2+]Cc1ccccc1[O-] ZINC000850387583 633970514 /nfs/dbraw/zinc/97/05/14/633970514.db2.gz VGMKREXSISLMTK-AWEZNQCLSA-N 0 3 262.397 2.602 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](COC)OC)c1ccc(C)cc1[O-] ZINC000850487326 634014289 /nfs/dbraw/zinc/01/42/89/634014289.db2.gz ZCRIKYQOGSDJQH-HIFRSBDPSA-N 0 3 281.396 2.793 20 10 CFCDHN CO[C@@H]1CCC[C@H]([C@@H](CO)[NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000850503827 634021577 /nfs/dbraw/zinc/02/15/77/634021577.db2.gz ZHJZNHSXCKTTEV-HLPPOEQASA-N 0 3 293.407 2.609 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C1(CO)CC1)c1ccc(C)cc1[O-] ZINC000850513818 634026423 /nfs/dbraw/zinc/02/64/23/634026423.db2.gz HAIMCQPVYDEOST-JSGCOSHPSA-N 0 3 263.381 2.902 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000850520716 634028994 /nfs/dbraw/zinc/02/89/94/634028994.db2.gz GSCGOLGKEAYBQM-ATZCPNFKSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1ccccc1[O-] ZINC000850566887 634054867 /nfs/dbraw/zinc/05/48/67/634054867.db2.gz TULAKQIFBULOHC-NSHDSACASA-N 0 3 285.334 2.983 20 10 CFCDHN C[C@@H]1CSC[C@@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858163752 636144933 /nfs/dbraw/zinc/14/49/33/636144933.db2.gz KVQNTMMLIDKSDF-RNCFNFMXSA-N 0 3 286.391 2.872 20 10 CFCDHN C[C@]1(C2CC2)CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000853528857 635028293 /nfs/dbraw/zinc/02/82/93/635028293.db2.gz XDPKLEBOFHNQOE-GOSISDBHSA-N 0 3 287.403 2.882 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2ccnc(C)c2)cc1 ZINC000856754511 635847882 /nfs/dbraw/zinc/84/78/82/635847882.db2.gz JNDHRPXWXGNJGO-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@H]2CC2(F)F)c([O-])c1 ZINC000856802153 635864148 /nfs/dbraw/zinc/86/41/48/635864148.db2.gz JQWXWJAXQJRHEX-NSHDSACASA-N 0 3 271.307 2.926 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CC=C(C(=O)OC)C1)c1ccccc1[O-] ZINC000858473412 636260626 /nfs/dbraw/zinc/26/06/26/636260626.db2.gz NQVGSYGNOGYIES-TZMCWYRMSA-N 0 3 275.348 2.695 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCCN1CC(F)F)CC2 ZINC000858479235 636264732 /nfs/dbraw/zinc/26/47/32/636264732.db2.gz MGGBDZAROSKWNY-CHWSQXEVSA-N 0 3 296.361 2.699 20 10 CFCDHN CC[C@@H](C)[N@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000862386997 637349891 /nfs/dbraw/zinc/34/98/91/637349891.db2.gz GHRKWIRCBNIAPW-LLVKDONJSA-N 0 3 271.788 2.947 20 10 CFCDHN CC[C@@H](C)[N@@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000862386997 637349896 /nfs/dbraw/zinc/34/98/96/637349896.db2.gz GHRKWIRCBNIAPW-LLVKDONJSA-N 0 3 271.788 2.947 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000862540680 637413985 /nfs/dbraw/zinc/41/39/85/637413985.db2.gz JNOXINIARVCXCY-HAQNSBGRSA-N 0 3 255.745 2.621 20 10 CFCDHN CO[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000862547970 637420944 /nfs/dbraw/zinc/42/09/44/637420944.db2.gz UUHISIDUJKJGDP-GSJFWJNXSA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@@H]3CCC[C@@H]32)c1 ZINC000863305832 637622601 /nfs/dbraw/zinc/62/26/01/637622601.db2.gz BZPXJMXKKNDQOI-LSDHHAIUSA-N 0 3 261.365 2.762 20 10 CFCDHN C[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc(Br)cc1[O-] ZINC000863546932 637693297 /nfs/dbraw/zinc/69/32/97/637693297.db2.gz PAKASVJMOGCBMC-VDDIYKPWSA-N 0 3 299.212 2.556 20 10 CFCDHN COc1cnccc1[C@@H](C)NCc1ccccc1O ZINC000189570948 650390327 /nfs/dbraw/zinc/39/03/27/650390327.db2.gz LJNZLTQSZLNUCO-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN CC1(C)CC[C@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000190254573 650422184 /nfs/dbraw/zinc/42/21/84/650422184.db2.gz PQJOEGRSXZVSEE-GFCCVEGCSA-N 0 3 253.317 2.579 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCCn3nccc32)c([O-])c1 ZINC000865871183 638629318 /nfs/dbraw/zinc/62/93/18/638629318.db2.gz GNIYIKHVGWLVCW-CQSZACIVSA-N 0 3 287.363 2.612 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866489460 638829818 /nfs/dbraw/zinc/82/98/18/638829818.db2.gz OBUFMYOSWUTKKO-KLHWPWHYSA-N 0 3 265.328 2.583 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CC2(CO1)CCOCC2)c1ccccc1[O-] ZINC000866530865 638836460 /nfs/dbraw/zinc/83/64/60/638836460.db2.gz BRMNMLVSOYSIHL-KGLIPLIRSA-N 0 3 291.391 2.629 20 10 CFCDHN C[C@H]([NH2+]CC[C@H](O)C1CCCC1)c1ccccc1[O-] ZINC000866636887 638859299 /nfs/dbraw/zinc/85/92/99/638859299.db2.gz CANQWQCDLCZMRC-WFASDCNBSA-N 0 3 263.381 2.984 20 10 CFCDHN Nc1cc(F)cc(C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000873290087 642122745 /nfs/dbraw/zinc/12/27/45/642122745.db2.gz NSJRLIFQGGXCIM-AWEZNQCLSA-N 0 3 272.323 2.891 20 10 CFCDHN CC[C@H](C)[C@@H](C[N@H+](C)Cc1ccccc1[O-])OC ZINC000876615411 642945973 /nfs/dbraw/zinc/94/59/73/642945973.db2.gz DTODTETUHWTWBM-SWLSCSKDSA-N 0 3 251.370 2.885 20 10 CFCDHN CC[C@H](C)[C@@H](C[N@@H+](C)Cc1ccccc1[O-])OC ZINC000876615411 642945977 /nfs/dbraw/zinc/94/59/77/642945977.db2.gz DTODTETUHWTWBM-SWLSCSKDSA-N 0 3 251.370 2.885 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000876770733 643003116 /nfs/dbraw/zinc/00/31/16/643003116.db2.gz JGALMFHRPFXFHS-CYBMUJFWSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000876770733 643003122 /nfs/dbraw/zinc/00/31/22/643003122.db2.gz JGALMFHRPFXFHS-CYBMUJFWSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCc2nccs2)c([O-])c1 ZINC000876790835 643010464 /nfs/dbraw/zinc/01/04/64/643010464.db2.gz ZORNTBJTPXIKQY-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCc2nccs2)c([O-])c1 ZINC000876790835 643010468 /nfs/dbraw/zinc/01/04/68/643010468.db2.gz ZORNTBJTPXIKQY-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000876804905 643016708 /nfs/dbraw/zinc/01/67/08/643016708.db2.gz VURINJSVIFUBAM-ZFWWWQNUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000876804905 643016714 /nfs/dbraw/zinc/01/67/14/643016714.db2.gz VURINJSVIFUBAM-ZFWWWQNUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000876807890 643017877 /nfs/dbraw/zinc/01/78/77/643017877.db2.gz AVZYXDVKSPGADJ-AWEZNQCLSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](OCC(C)C)C1 ZINC000876807890 643017882 /nfs/dbraw/zinc/01/78/82/643017882.db2.gz AVZYXDVKSPGADJ-AWEZNQCLSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)c1ccc(F)cc1 ZINC000876879549 643047529 /nfs/dbraw/zinc/04/75/29/643047529.db2.gz BVUUBAPXMAMGLH-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](Cc1ccccc1)N(C)C ZINC000876893603 643055750 /nfs/dbraw/zinc/05/57/50/643055750.db2.gz GNVNUMLNOAUJLI-QGZVFWFLSA-N 0 3 298.430 2.963 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2COc3ccccc3C2)c([O-])c1 ZINC000876975754 643089744 /nfs/dbraw/zinc/08/97/44/643089744.db2.gz JOHYPQWJAXGKCU-OAHLLOKOSA-N 0 3 269.344 2.794 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877037260 643115417 /nfs/dbraw/zinc/11/54/17/643115417.db2.gz YXSVQFMEVFQQTG-KRWDZBQOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2ccsc2)c([O-])c1 ZINC000877049097 643120901 /nfs/dbraw/zinc/12/09/01/643120901.db2.gz QGTJKTZKJUDQOV-AWEZNQCLSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C2(C)C)c([O-])c1 ZINC000877059019 643126626 /nfs/dbraw/zinc/12/66/26/643126626.db2.gz IZESNWZEOYCMFX-BPLDGKMQSA-N 0 3 261.365 2.604 20 10 CFCDHN CCC[C@H](CCO)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877064944 643130487 /nfs/dbraw/zinc/13/04/87/643130487.db2.gz GKXRKIMXFMHGJS-CYBMUJFWSA-N 0 3 251.370 2.589 20 10 CFCDHN CC[C@@H](C[C@H](C)CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877065811 643131203 /nfs/dbraw/zinc/13/12/03/643131203.db2.gz WQKBTHCOBZWTAG-JSGCOSHPSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](CO)c2ccccc2)c([O-])c1 ZINC000877073168 643135586 /nfs/dbraw/zinc/13/55/86/643135586.db2.gz DNFSCFLSVNWNPR-INIZCTEOSA-N 0 3 271.360 2.566 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000877115418 643158839 /nfs/dbraw/zinc/15/88/39/643158839.db2.gz FIQSYOKRHWGABO-PBHICJAKSA-N 0 3 285.387 2.782 20 10 CFCDHN Cc1nn(C)c(C)c1CCC[NH2+]Cc1c(C)cccc1[O-] ZINC000877130245 643168004 /nfs/dbraw/zinc/16/80/04/643168004.db2.gz KQVFSMHADJHHJJ-UHFFFAOYSA-N 0 3 287.407 2.773 20 10 CFCDHN CCOc1ncccc1CNCc1ccc(C)cc1O ZINC000877145394 643176471 /nfs/dbraw/zinc/17/64/71/643176471.db2.gz IBPIBTJCKRBOIM-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN Cc1ccc(C[NH+]2CCC([C@@H]3CCOC3)CC2)c([O-])c1 ZINC000877306782 643228530 /nfs/dbraw/zinc/22/85/30/643228530.db2.gz DHRSQACWSXCEMN-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN CC(=O)NC1CCC([N@H+](C)Cc2c(C)cccc2[O-])CC1 ZINC000877314859 643234449 /nfs/dbraw/zinc/23/44/49/643234449.db2.gz FUDCFZBFIJEFRF-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN CC(=O)NC1CCC([N@@H+](C)Cc2c(C)cccc2[O-])CC1 ZINC000877314859 643234453 /nfs/dbraw/zinc/23/44/53/643234453.db2.gz FUDCFZBFIJEFRF-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@H](C3CC3)C2)c([O-])c1 ZINC000877374552 643249956 /nfs/dbraw/zinc/24/99/56/643249956.db2.gz CXOKXTNURXAIHW-ZBFHGGJFSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](C)CNC(=O)OC(C)(C)C ZINC000877400093 643259522 /nfs/dbraw/zinc/25/95/22/643259522.db2.gz SDDVDLRMLAJWQJ-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877438693 643272881 /nfs/dbraw/zinc/27/28/81/643272881.db2.gz NXBPTDBTLHYXNV-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877438693 643272886 /nfs/dbraw/zinc/27/28/86/643272886.db2.gz NXBPTDBTLHYXNV-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCOC(CC[NH2+]Cc1c(C)cccc1[O-])OCC ZINC000877467126 643287020 /nfs/dbraw/zinc/28/70/20/643287020.db2.gz BINZAHWRNWFMJI-UHFFFAOYSA-N 0 3 267.369 2.579 20 10 CFCDHN Cc1ccc(CN2CCN(c3cnccc3C)CC2)c(O)c1 ZINC000877497127 643309865 /nfs/dbraw/zinc/30/98/65/643309865.db2.gz GHMUGFZMZPOBFT-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4ccc(C)cc4[O-])[C@H]1[C@H]3C2 ZINC000877518428 643322740 /nfs/dbraw/zinc/32/27/40/643322740.db2.gz UMKWAQJBLGWQJT-CUINURIISA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4ccc(C)cc4[O-])[C@H]1[C@H]3C2 ZINC000877518428 643322745 /nfs/dbraw/zinc/32/27/45/643322745.db2.gz UMKWAQJBLGWQJT-CUINURIISA-N 0 3 273.376 2.556 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530727 643334795 /nfs/dbraw/zinc/33/47/95/643334795.db2.gz GSURZGRJJGQLTI-BXUZGUMPSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530727 643334804 /nfs/dbraw/zinc/33/48/04/643334804.db2.gz GSURZGRJJGQLTI-BXUZGUMPSA-N 0 3 296.361 2.587 20 10 CFCDHN Cc1ccc(CN2CC[C@@H](n3cc(Cl)cn3)C2)c(O)c1 ZINC000877541254 643343883 /nfs/dbraw/zinc/34/38/83/643343883.db2.gz FFQFBAIQGFCJBS-CQSZACIVSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(O)CCCC2(C)C)c([O-])c1 ZINC000877551528 643352935 /nfs/dbraw/zinc/35/29/35/643352935.db2.gz DNOAOIPSDBAYBX-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877570870 643368894 /nfs/dbraw/zinc/36/88/94/643368894.db2.gz OSKXQQDHKWUDDU-AWEZNQCLSA-N 0 3 265.397 2.930 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877570870 643368897 /nfs/dbraw/zinc/36/88/97/643368897.db2.gz OSKXQQDHKWUDDU-AWEZNQCLSA-N 0 3 265.397 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000877604502 643391391 /nfs/dbraw/zinc/39/13/91/643391391.db2.gz MGLHAYCJUSEYOF-LJQANCHMSA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000877604502 643391397 /nfs/dbraw/zinc/39/13/97/643391397.db2.gz MGLHAYCJUSEYOF-LJQANCHMSA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(CO)CCc2ccccc21 ZINC000877610320 643397301 /nfs/dbraw/zinc/39/73/01/643397301.db2.gz SGPSHVZWJWGYGG-LJQANCHMSA-N 0 3 297.398 2.667 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)CC2(C)OCCO2)c([O-])c1 ZINC000877670152 643444027 /nfs/dbraw/zinc/44/40/27/643444027.db2.gz HOWSJDKRYYGVTD-CYBMUJFWSA-N 0 3 279.380 2.579 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2c3ccccc3CN2C)c([O-])c1 ZINC000877732978 643492794 /nfs/dbraw/zinc/49/27/94/643492794.db2.gz MENNFFSFAPYPOG-KRWDZBQOSA-N 0 3 282.387 2.977 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877736351 643495720 /nfs/dbraw/zinc/49/57/20/643495720.db2.gz WASIYRFIGNWHEX-ZIAGYGMSSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877736351 643495727 /nfs/dbraw/zinc/49/57/27/643495727.db2.gz WASIYRFIGNWHEX-ZIAGYGMSSA-N 0 3 263.406 2.886 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc2c(c1)nnn2C)c1ccccc1[O-] ZINC000877756470 643537372 /nfs/dbraw/zinc/53/73/72/643537372.db2.gz KPRNXWCYENOUGQ-LLVKDONJSA-N 0 3 282.347 2.525 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H](O)C1CCCC1 ZINC000877777440 643552628 /nfs/dbraw/zinc/55/26/28/643552628.db2.gz ANGHTBDNDPZUQO-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(C)(C)O)C2)c1[O-] ZINC000877836527 643603958 /nfs/dbraw/zinc/60/39/58/643603958.db2.gz ZOAZDCLBYZUZRK-LLVKDONJSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c1[O-] ZINC000877836527 643603962 /nfs/dbraw/zinc/60/39/62/643603962.db2.gz ZOAZDCLBYZUZRK-LLVKDONJSA-N 0 3 299.798 2.647 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000878242459 643804511 /nfs/dbraw/zinc/80/45/11/643804511.db2.gz RTOKKGXGVUIRRV-DUVNUKRYSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000878242459 643804514 /nfs/dbraw/zinc/80/45/14/643804514.db2.gz RTOKKGXGVUIRRV-DUVNUKRYSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000878242461 643804539 /nfs/dbraw/zinc/80/45/39/643804539.db2.gz RTOKKGXGVUIRRV-INWMFGNUSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000878242461 643804543 /nfs/dbraw/zinc/80/45/43/643804543.db2.gz RTOKKGXGVUIRRV-INWMFGNUSA-N 0 3 261.365 2.782 20 10 CFCDHN C[C@@H]([NH2+]CCOC(=O)Cc1ccccc1)c1ccccc1[O-] ZINC000879648903 644362661 /nfs/dbraw/zinc/36/26/61/644362661.db2.gz FLURCVLCLLSVAT-CQSZACIVSA-N 0 3 299.370 2.829 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)NC1CCCCC1 ZINC000879648961 644363284 /nfs/dbraw/zinc/36/32/84/644363284.db2.gz HQHMKMDMMNYSHZ-CHWSQXEVSA-N 0 3 290.407 2.880 20 10 CFCDHN Cc1cc(C)n(CC[NH2+][C@@H](C)c2ccccc2[O-])n1 ZINC000879650260 644364483 /nfs/dbraw/zinc/36/44/83/644364483.db2.gz SHCDJTGESQXAFU-ZDUSSCGKSA-N 0 3 259.353 2.556 20 10 CFCDHN Cc1cc(CN[C@H](C)c2ccccc2O)nc(C)n1 ZINC000879650234 644364844 /nfs/dbraw/zinc/36/48/44/644364844.db2.gz QUBQKEGBWKPLID-LLVKDONJSA-N 0 3 257.337 2.650 20 10 CFCDHN CCC(CC)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651552 644365107 /nfs/dbraw/zinc/36/51/07/644365107.db2.gz ASEGSISQJMQECV-NWDGAFQWSA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1ccccc1CNC(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879653731 644365869 /nfs/dbraw/zinc/36/58/69/644365869.db2.gz VAKPSWGPDLKFDB-AWEZNQCLSA-N 0 3 298.386 2.668 20 10 CFCDHN CC[C@H]1CN(Cc2cc(C)ccc2O)CCN1CC(F)F ZINC000093767236 650945812 /nfs/dbraw/zinc/94/58/12/650945812.db2.gz JIIZQIIWCSPTAQ-AWEZNQCLSA-N 0 3 298.377 2.862 20 10 CFCDHN Cc1cc(CN2CC=C[C@@H]2CO)ccc1N1CCCCC1 ZINC000880493022 644735113 /nfs/dbraw/zinc/73/51/13/644735113.db2.gz XUJIIWSUJJZEJG-QGZVFWFLSA-N 0 3 286.419 2.718 20 10 CFCDHN CC[C@@H](CCO)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000094949534 650965995 /nfs/dbraw/zinc/96/59/95/650965995.db2.gz AMFMUGYUUZFWHO-JSGCOSHPSA-N 0 3 251.370 2.842 20 10 CFCDHN CO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000251801139 650994368 /nfs/dbraw/zinc/99/43/68/650994368.db2.gz YKPUDASUWAVHST-GAJTVXKRSA-N 0 3 253.317 2.749 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc2c(cc1[O-])OCO2)C(C)(C)C ZINC000096610274 650995831 /nfs/dbraw/zinc/99/58/31/650995831.db2.gz MVZTVJOJJMOGJC-SNVBAGLBSA-N 0 3 265.353 2.893 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCC3(COC3)CC1)CC2 ZINC000883382903 645782779 /nfs/dbraw/zinc/78/27/79/645782779.db2.gz PMRSOLUFQPCDJA-AWEZNQCLSA-N 0 3 273.376 2.928 20 10 CFCDHN C[NH+](C)C1CCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000132200683 645890616 /nfs/dbraw/zinc/89/06/16/645890616.db2.gz QJXPXBIZRCZWTE-UHFFFAOYSA-N 0 3 268.788 2.572 20 10 CFCDHN CCOc1cccc(C[N@H+](CCN(C)C)CC(C)C)c1[O-] ZINC000132553383 645931552 /nfs/dbraw/zinc/93/15/52/645931552.db2.gz VEVDBEGMOBGZTJ-UHFFFAOYSA-N 0 3 294.439 2.811 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCN(C)C)CC(C)C)c1[O-] ZINC000132553383 645931555 /nfs/dbraw/zinc/93/15/55/645931555.db2.gz VEVDBEGMOBGZTJ-UHFFFAOYSA-N 0 3 294.439 2.811 20 10 CFCDHN CC[NH+](CC)[C@@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000134052323 646272100 /nfs/dbraw/zinc/27/21/00/646272100.db2.gz MBWSJOSNIDLPBU-CQSZACIVSA-N 0 3 282.815 2.962 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1c([O-])cccc1F ZINC000886505306 647021985 /nfs/dbraw/zinc/02/19/85/647021985.db2.gz UXRONUAFHXSIHZ-YNEHKIRRSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1c([O-])cccc1F ZINC000886505306 647021986 /nfs/dbraw/zinc/02/19/86/647021986.db2.gz UXRONUAFHXSIHZ-YNEHKIRRSA-N 0 3 278.371 2.809 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886520523 647027098 /nfs/dbraw/zinc/02/70/98/647027098.db2.gz GSSLYWNCMLKIHO-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@@H](C)[N@H+](C)CCN[C@@H](C)c1c([O-])cccc1F ZINC000886520523 647027103 /nfs/dbraw/zinc/02/71/03/647027103.db2.gz GSSLYWNCMLKIHO-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@@H](C)[N@@H+](C)CCN[C@@H](C)c1c([O-])cccc1F ZINC000886520523 647027106 /nfs/dbraw/zinc/02/71/06/647027106.db2.gz GSSLYWNCMLKIHO-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000886670678 647101770 /nfs/dbraw/zinc/10/17/70/647101770.db2.gz UFVRFMMKHMCGGL-YCPHGPKFSA-N 0 3 293.407 2.671 20 10 CFCDHN C[C@H](N[C@@H]1C[NH2+]C[C@H]1C)c1ccc2ccccc2c1[O-] ZINC000925783399 648321738 /nfs/dbraw/zinc/32/17/38/648321738.db2.gz KGSBZFSABQFDKO-BFQNTYOBSA-N 0 3 270.376 2.804 20 10 CFCDHN CCOCCOCC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000927086648 648705009 /nfs/dbraw/zinc/70/50/09/648705009.db2.gz HUMRJXZQRIWDDI-DGCLKSJQSA-N 0 3 297.370 2.722 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(C2CC2)nn1C)c1cc(F)ccc1[O-] ZINC000927102083 648712137 /nfs/dbraw/zinc/71/21/37/648712137.db2.gz PYHDQXXCFMZRDH-SNVBAGLBSA-N 0 3 289.354 2.993 20 10 CFCDHN CCC[N@H+](CCCCCNC(C)=O)Cc1ccccc1[O-] ZINC000929753401 649112394 /nfs/dbraw/zinc/11/23/94/649112394.db2.gz PKJOYJDLYJZWBA-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN CCC[N@@H+](CCCCCNC(C)=O)Cc1ccccc1[O-] ZINC000929753401 649112396 /nfs/dbraw/zinc/11/23/96/649112396.db2.gz PKJOYJDLYJZWBA-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCO[C@@H]2CC2(F)F)c([O-])c1 ZINC000690730719 770807140 /nfs/dbraw/zinc/80/71/40/770807140.db2.gz KJYRQQMKBVHTOH-GXFFZTMASA-N 0 3 271.307 2.775 20 10 CFCDHN COCc1csc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000695448142 775842727 /nfs/dbraw/zinc/84/27/27/775842727.db2.gz ZOQMAWCQBAECMS-UHFFFAOYSA-N 0 3 263.362 2.890 20 10 CFCDHN CN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c([O-])ccc2ccccc21 ZINC001231590309 777270898 /nfs/dbraw/zinc/27/08/98/777270898.db2.gz SBYLPZIPRFKKHN-GASCZTMLSA-N 0 3 282.387 2.824 20 10 CFCDHN CN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c([O-])ccc2ccccc21 ZINC001231590309 777270909 /nfs/dbraw/zinc/27/09/09/777270909.db2.gz SBYLPZIPRFKKHN-GASCZTMLSA-N 0 3 282.387 2.824 20 10 CFCDHN COc1cc(CN(C)Cc2ccsc2)c(O)cc1O ZINC001231636072 777286604 /nfs/dbraw/zinc/28/66/04/777286604.db2.gz QAZBKXHEOWKOEZ-UHFFFAOYSA-N 0 3 279.361 2.800 20 10 CFCDHN COc1cc(CN2CCc3c(C)cccc3C2)c(O)cc1O ZINC001231634529 777286900 /nfs/dbraw/zinc/28/69/00/777286900.db2.gz OMVQCTOEYAFFTJ-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN Cc1cc(C)c(CN2CCCCC23COC3)c(O)c1 ZINC001231847004 777348451 /nfs/dbraw/zinc/34/84/51/777348451.db2.gz UJRDXFZABGORKK-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1C[C@H]2[C@H](CC2(F)F)C1 ZINC001231852470 777351526 /nfs/dbraw/zinc/35/15/26/777351526.db2.gz WGWBPYCFLYQKBG-OCCSQVGLSA-N 0 3 296.361 2.848 20 10 CFCDHN CN(C1CC1)[C@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])C1 ZINC001231914410 777383165 /nfs/dbraw/zinc/38/31/65/777383165.db2.gz LFHGWKREAVSVRK-ZDUSSCGKSA-N 0 3 280.799 2.714 20 10 CFCDHN CN(C1CC1)[C@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])C1 ZINC001231914410 777383169 /nfs/dbraw/zinc/38/31/69/777383169.db2.gz LFHGWKREAVSVRK-ZDUSSCGKSA-N 0 3 280.799 2.714 20 10 CFCDHN CCC[N@H+](Cc1ccc(N(C)C)cc1[O-])C1CCOCC1 ZINC001232840645 777690677 /nfs/dbraw/zinc/69/06/77/777690677.db2.gz FDGVIMKWWTUALI-UHFFFAOYSA-N 0 3 292.423 2.849 20 10 CFCDHN CCC[N@@H+](Cc1ccc(N(C)C)cc1[O-])C1CCOCC1 ZINC001232840645 777690680 /nfs/dbraw/zinc/69/06/80/777690680.db2.gz FDGVIMKWWTUALI-UHFFFAOYSA-N 0 3 292.423 2.849 20 10 CFCDHN CC(C)(C)c1ccc(O)c(CN2CC(N3CCCC3)C2)c1 ZINC001233286526 777867446 /nfs/dbraw/zinc/86/74/46/777867446.db2.gz XOBRDIPURNZMJJ-UHFFFAOYSA-N 0 3 288.435 2.970 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@]3(CCCO3)C2)c1O ZINC001233287776 777869488 /nfs/dbraw/zinc/86/94/88/777869488.db2.gz HBZMHGCXEKMVRF-OAHLLOKOSA-N 0 3 297.782 2.809 20 10 CFCDHN Cn1cc(C[N@H+](C)Cc2c([O-])ccc3ccccc32)cn1 ZINC000029539857 777982961 /nfs/dbraw/zinc/98/29/61/777982961.db2.gz NAMPUGHXQHWQON-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN Cn1cc(C[N@@H+](C)Cc2c([O-])ccc3ccccc32)cn1 ZINC000029539857 777982971 /nfs/dbraw/zinc/98/29/71/777982971.db2.gz NAMPUGHXQHWQON-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CC[C@@H](C)SC2)c([O-])c1 ZINC000689522295 778225627 /nfs/dbraw/zinc/22/56/27/778225627.db2.gz SEDGKCXHJVXHQR-PWSUYJOCSA-N 0 3 267.394 2.775 20 10 CFCDHN CC[N@H+](CCC(N)=O)Cc1cccc(-c2ccccc2)c1[O-] ZINC001234996273 778348690 /nfs/dbraw/zinc/34/86/90/778348690.db2.gz YVGUDBTZFXWFCE-UHFFFAOYSA-N 0 3 298.386 2.757 20 10 CFCDHN CC[N@@H+](CCC(N)=O)Cc1cccc(-c2ccccc2)c1[O-] ZINC001234996273 778348696 /nfs/dbraw/zinc/34/86/96/778348696.db2.gz YVGUDBTZFXWFCE-UHFFFAOYSA-N 0 3 298.386 2.757 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2[O-])C[C@H]1O ZINC001235002326 778350875 /nfs/dbraw/zinc/35/08/75/778350875.db2.gz PGJXJALAPJHFEH-SUMWQHHRSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2[O-])C[C@H]1O ZINC001235002326 778350880 /nfs/dbraw/zinc/35/08/80/778350880.db2.gz PGJXJALAPJHFEH-SUMWQHHRSA-N 0 3 283.371 2.872 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CC[C@H]([NH3+])C2)cc1Cl ZINC001235360761 778468417 /nfs/dbraw/zinc/46/84/17/778468417.db2.gz BNWXUGZVOWZWFW-NSHDSACASA-N 0 3 282.815 2.876 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235674891 778532922 /nfs/dbraw/zinc/53/29/22/778532922.db2.gz IGKXUZJXYMZIFC-ZDUSSCGKSA-N 0 3 291.391 2.685 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235674891 778532926 /nfs/dbraw/zinc/53/29/26/778532926.db2.gz IGKXUZJXYMZIFC-ZDUSSCGKSA-N 0 3 291.391 2.685 20 10 CFCDHN CC(C)(C)c1ccc(C[NH+]2CC3(C2)CCOC3)c([O-])c1 ZINC001235675950 778533150 /nfs/dbraw/zinc/53/31/50/778533150.db2.gz MTNXRXQIJWHALM-UHFFFAOYSA-N 0 3 275.392 2.912 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](F)CC2)c([O-])c1 ZINC001235676454 778533260 /nfs/dbraw/zinc/53/32/60/778533260.db2.gz SPABQQRAOMIUKI-HUUCEWRRSA-N 0 3 295.398 2.985 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](F)CC2)c([O-])c1 ZINC001235676454 778533264 /nfs/dbraw/zinc/53/32/64/778533264.db2.gz SPABQQRAOMIUKI-HUUCEWRRSA-N 0 3 295.398 2.985 20 10 CFCDHN CN(C)C(=O)CC[N@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680500 778535196 /nfs/dbraw/zinc/53/51/96/778535196.db2.gz VPPGYDXOFJCTLI-UHFFFAOYSA-N 0 3 292.423 2.600 20 10 CFCDHN CN(C)C(=O)CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680500 778535200 /nfs/dbraw/zinc/53/52/00/778535200.db2.gz VPPGYDXOFJCTLI-UHFFFAOYSA-N 0 3 292.423 2.600 20 10 CFCDHN CC(C)(C)c1ccc(CN2CCCC[C@@H]2C(N)=O)c(O)c1 ZINC001235686112 778537565 /nfs/dbraw/zinc/53/75/65/778537565.db2.gz YCISPQGCZURRPX-CQSZACIVSA-N 0 3 290.407 2.530 20 10 CFCDHN CCC[C@@H]1C[NH2+]CCN1Cc1ccc(Cl)cc1[O-] ZINC001236130455 778706029 /nfs/dbraw/zinc/70/60/29/778706029.db2.gz GXCXBEUSZUKFRN-CYBMUJFWSA-N 0 3 268.788 2.620 20 10 CFCDHN CCC[C@H]1CN(Cc2ccc(Cl)cc2[O-])CC[NH2+]1 ZINC001236178378 778725907 /nfs/dbraw/zinc/72/59/07/778725907.db2.gz LVIPDAYNKIULRI-ZDUSSCGKSA-N 0 3 268.788 2.620 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(CO)cc1)c1ccccc1[O-] ZINC000226560294 778839747 /nfs/dbraw/zinc/83/97/47/778839747.db2.gz ZSZJBXYKEJMRNE-LBPRGKRZSA-N 0 3 257.333 2.735 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c([O-])c1 ZINC001236784411 778935811 /nfs/dbraw/zinc/93/58/11/778935811.db2.gz WRWXUDGZRSWSHQ-MLGOLLRUSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@](C)(O)C2)c([O-])c1 ZINC001236784411 778935817 /nfs/dbraw/zinc/93/58/17/778935817.db2.gz WRWXUDGZRSWSHQ-MLGOLLRUSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784235 778936098 /nfs/dbraw/zinc/93/60/98/778936098.db2.gz SCBCEAZAHDRGPO-MLGOLLRUSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784235 778936103 /nfs/dbraw/zinc/93/61/03/778936103.db2.gz SCBCEAZAHDRGPO-MLGOLLRUSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC3(COC3)C2)c([O-])c1 ZINC001236786967 778937600 /nfs/dbraw/zinc/93/76/00/778937600.db2.gz TWPGLQHRAWTRTR-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC3(COC3)C2)c([O-])c1 ZINC001236786967 778937605 /nfs/dbraw/zinc/93/76/05/778937605.db2.gz TWPGLQHRAWTRTR-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(CN2CCCC[C@@H]2C(C)=O)c(O)c1 ZINC001236792341 778938432 /nfs/dbraw/zinc/93/84/32/778938432.db2.gz PRDFFGNJRNXRMF-OAHLLOKOSA-N 0 3 261.365 2.898 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(CCO3)CC2)c([O-])c1 ZINC001236795237 778941237 /nfs/dbraw/zinc/94/12/37/778941237.db2.gz SIARQCZGGWTNCH-UHFFFAOYSA-N 0 3 261.365 2.710 20 10 CFCDHN COCC[N@H+](Cc1c(C)cc(OC)cc1[O-])C(C)C ZINC001236812299 778950706 /nfs/dbraw/zinc/95/07/06/778950706.db2.gz BTMWUFDLTFIEFP-UHFFFAOYSA-N 0 3 267.369 2.566 20 10 CFCDHN COCC[N@@H+](Cc1c(C)cc(OC)cc1[O-])C(C)C ZINC001236812299 778950712 /nfs/dbraw/zinc/95/07/12/778950712.db2.gz BTMWUFDLTFIEFP-UHFFFAOYSA-N 0 3 267.369 2.566 20 10 CFCDHN C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827438 778956524 /nfs/dbraw/zinc/95/65/24/778956524.db2.gz RXWQHSOTBUNSMS-MLGOLLRUSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827438 778956528 /nfs/dbraw/zinc/95/65/28/778956528.db2.gz RXWQHSOTBUNSMS-MLGOLLRUSA-N 0 3 271.360 2.891 20 10 CFCDHN COC(=O)CC1C[NH+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841622 778962423 /nfs/dbraw/zinc/96/24/23/778962423.db2.gz MLUXUKDKHFBHRN-UHFFFAOYSA-N 0 3 285.343 2.540 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@](C)(CO)C2)c([O-])c1 ZINC001237046151 778998484 /nfs/dbraw/zinc/99/84/84/778998484.db2.gz QQSCZQGNHQHFLA-MRXNPFEDSA-N 0 3 263.381 2.720 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@](C)(CO)C2)c([O-])c1 ZINC001237046151 778998488 /nfs/dbraw/zinc/99/84/88/778998488.db2.gz QQSCZQGNHQHFLA-MRXNPFEDSA-N 0 3 263.381 2.720 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237049403 779000878 /nfs/dbraw/zinc/00/08/78/779000878.db2.gz OCLFOUTZHBUNOZ-HNNXBMFYSA-N 0 3 291.391 2.901 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237049403 779000884 /nfs/dbraw/zinc/00/08/84/779000884.db2.gz OCLFOUTZHBUNOZ-HNNXBMFYSA-N 0 3 291.391 2.901 20 10 CFCDHN CO[C@H](C)C1C[NH+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237054768 779001666 /nfs/dbraw/zinc/00/16/66/779001666.db2.gz GODYPPYJZRRLNI-GFCCVEGCSA-N 0 3 263.381 2.982 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3c([O-])ccc(F)c3Cl)C[C@@H]2C1 ZINC001237125274 779020039 /nfs/dbraw/zinc/02/00/39/779020039.db2.gz XHWORQCDTRYMBW-MNOVXSKESA-N 0 3 298.789 2.568 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3c([O-])ccc(F)c3Cl)C[C@@H]2C1 ZINC001237125274 779020041 /nfs/dbraw/zinc/02/00/41/779020041.db2.gz XHWORQCDTRYMBW-MNOVXSKESA-N 0 3 298.789 2.568 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@](C)(O)[C@@H](C)C1 ZINC001237485902 779117673 /nfs/dbraw/zinc/11/76/73/779117673.db2.gz VKAFQSBUZFKJRJ-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@](C)(O)[C@@H](C)C1 ZINC001237485902 779117678 /nfs/dbraw/zinc/11/76/78/779117678.db2.gz VKAFQSBUZFKJRJ-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CCCO[C@@H]2C1 ZINC001237484364 779117830 /nfs/dbraw/zinc/11/78/30/779117830.db2.gz CWTLAHFADOWTMK-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2CCCO[C@@H]2C1 ZINC001237484364 779117831 /nfs/dbraw/zinc/11/78/31/779117831.db2.gz CWTLAHFADOWTMK-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](Oc2cccnc2)C1 ZINC001237490533 779118818 /nfs/dbraw/zinc/11/88/18/779118818.db2.gz WAVPFLPVXBVSMM-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](Oc2cccnc2)C1 ZINC001237490533 779118821 /nfs/dbraw/zinc/11/88/21/779118821.db2.gz WAVPFLPVXBVSMM-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN CCN(C(C)=O)C1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC001237494715 779120571 /nfs/dbraw/zinc/12/05/71/779120571.db2.gz KWRGZTYTBICINW-UHFFFAOYSA-N 0 3 290.407 2.533 20 10 CFCDHN CN1CC2(C1)CC[NH+](Cc1cc(Cl)cc(F)c1[O-])CC2 ZINC001237623421 779147209 /nfs/dbraw/zinc/14/72/09/779147209.db2.gz MWYLRZMLXSLRQU-UHFFFAOYSA-N 0 3 298.789 2.712 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc1Br ZINC001237680732 779160142 /nfs/dbraw/zinc/16/01/42/779160142.db2.gz KTOUAEFQJGHMQX-AOOOYVTPSA-N 0 3 282.181 2.915 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1Br ZINC001237680732 779160145 /nfs/dbraw/zinc/16/01/45/779160145.db2.gz KTOUAEFQJGHMQX-AOOOYVTPSA-N 0 3 282.181 2.915 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935814 779211312 /nfs/dbraw/zinc/21/13/12/779211312.db2.gz ZJRNHSOIIRVNNK-SECBINFHSA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935814 779211316 /nfs/dbraw/zinc/21/13/16/779211316.db2.gz ZJRNHSOIIRVNNK-SECBINFHSA-N 0 3 273.735 2.796 20 10 CFCDHN CCCCN1CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238061470 779242837 /nfs/dbraw/zinc/24/28/37/779242837.db2.gz HZPOQTJIMJRTPU-UHFFFAOYSA-N 0 3 280.387 2.757 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c1[O-] ZINC001238063259 779242847 /nfs/dbraw/zinc/24/28/47/779242847.db2.gz LPDREXRLXVOJTJ-MRXNPFEDSA-N 0 3 279.355 2.985 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@]3(C2)CCCCO3)c1[O-] ZINC001238063259 779242851 /nfs/dbraw/zinc/24/28/51/779242851.db2.gz LPDREXRLXVOJTJ-MRXNPFEDSA-N 0 3 279.355 2.985 20 10 CFCDHN Cc1cc(F)cc(CN2CCC[C@@]3(CCC(=O)O3)C2)c1O ZINC001238067298 779244633 /nfs/dbraw/zinc/24/46/33/779244633.db2.gz NPNGSYGBCOEHML-MRXNPFEDSA-N 0 3 293.338 2.511 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(C[C@H](F)CO3)CC2)c1[O-] ZINC001238070071 779245191 /nfs/dbraw/zinc/24/51/91/779245191.db2.gz MMZJHONLCMHCIL-AWEZNQCLSA-N 0 3 297.345 2.933 20 10 CFCDHN Cc1ccc(O)cc1C[N@@H+]1CCc2cccc([O-])c2C1 ZINC001238104002 779253107 /nfs/dbraw/zinc/25/31/07/779253107.db2.gz SFFGVDGAJWZUAM-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1ccc(O)cc1C[N@H+]1CCc2cccc([O-])c2C1 ZINC001238104002 779253110 /nfs/dbraw/zinc/25/31/10/779253110.db2.gz SFFGVDGAJWZUAM-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1cnc(CN2CCc3cccc(O)c3C2)c(C)c1 ZINC001238440918 779315682 /nfs/dbraw/zinc/31/56/82/779315682.db2.gz MDRUHMRYPVEFIK-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])CC[NH2+]1 ZINC001235730204 779370582 /nfs/dbraw/zinc/37/05/82/779370582.db2.gz LDJDSAWOPGHUTR-LBPRGKRZSA-N 0 3 288.313 2.595 20 10 CFCDHN CC[C@@H]1C[NH2+]CCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001235772876 779375271 /nfs/dbraw/zinc/37/52/71/779375271.db2.gz MFAHTQCKKMVMDG-GFCCVEGCSA-N 0 3 288.313 2.595 20 10 CFCDHN Cc1cccc(N2CCC[N@H+](Cc3ccccc3[O-])CC2)n1 ZINC001203558638 780074679 /nfs/dbraw/zinc/07/46/79/780074679.db2.gz RRECLJROGZBEHR-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cccc(N2CCC[N@@H+](Cc3ccccc3[O-])CC2)n1 ZINC001203558638 780074687 /nfs/dbraw/zinc/07/46/87/780074687.db2.gz RRECLJROGZBEHR-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN CCc1noc([C@H]2CC[C@H]([NH2+]Cc3ccccc3[O-])C2)n1 ZINC000922865636 780573942 /nfs/dbraw/zinc/57/39/42/780573942.db2.gz JYRQWTMRUQQYJL-AAEUAGOBSA-N 0 3 287.363 2.764 20 10 CFCDHN CN1CCCC[C@@H](C[NH2+]Cc2cccc(Cl)c2[O-])C1 ZINC000700799511 780720908 /nfs/dbraw/zinc/72/09/08/780720908.db2.gz IOUUGYKFXCFSSU-LBPRGKRZSA-N 0 3 282.815 2.867 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@@H](C)F)c1[O-] ZINC000705762536 781146815 /nfs/dbraw/zinc/14/68/15/781146815.db2.gz SMLUMTUKJSJFNL-MRVPVSSYSA-N 0 3 261.724 2.892 20 10 CFCDHN CCc1cccc(CN2CCO[C@@H](C(C)C)C2)c1O ZINC000708999073 781287092 /nfs/dbraw/zinc/28/70/92/781287092.db2.gz DRFAGHUDNHEFJU-OAHLLOKOSA-N 0 3 263.381 2.811 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(Cl)c1[O-])CC(C)(C)N ZINC000709331645 781309776 /nfs/dbraw/zinc/30/97/76/781309776.db2.gz NBGPLUFDDZFNIS-UHFFFAOYSA-N 0 3 277.195 2.868 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(Cl)c1[O-])CC(C)(C)N ZINC000709331645 781309783 /nfs/dbraw/zinc/30/97/83/781309783.db2.gz NBGPLUFDDZFNIS-UHFFFAOYSA-N 0 3 277.195 2.868 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccns1)CC2 ZINC000709996566 781325727 /nfs/dbraw/zinc/32/57/27/781325727.db2.gz KGCRXRYBJHQKFO-LBPRGKRZSA-N 0 3 260.362 2.668 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccns1)c1cc(F)ccc1[O-] ZINC000710028446 781326944 /nfs/dbraw/zinc/32/69/44/781326944.db2.gz UWVVMJGXVQOUFO-SECBINFHSA-N 0 3 266.341 2.881 20 10 CFCDHN CC1(C)CC[C@H](C[NH2+]Cc2cc(F)ccc2[O-])OC1 ZINC000711279951 781406350 /nfs/dbraw/zinc/40/63/50/781406350.db2.gz ZYCIXPVBYUGMSF-CYBMUJFWSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)CC(C)(C)O)cc1C ZINC000295064486 199326428 /nfs/dbraw/zinc/32/64/28/199326428.db2.gz OSMLLTKEPYVJEW-GFCCVEGCSA-N 0 3 251.370 2.648 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c1 ZINC000093483139 347677229 /nfs/dbraw/zinc/67/72/29/347677229.db2.gz MDLLLOUGMBYASM-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c1 ZINC000093483139 347677231 /nfs/dbraw/zinc/67/72/31/347677231.db2.gz MDLLLOUGMBYASM-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccc1 ZINC000206094913 348155978 /nfs/dbraw/zinc/15/59/78/348155978.db2.gz GVTCNXABFJWQNV-MRXNPFEDSA-N 0 3 257.333 2.558 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccc1 ZINC000206094913 348155981 /nfs/dbraw/zinc/15/59/81/348155981.db2.gz GVTCNXABFJWQNV-MRXNPFEDSA-N 0 3 257.333 2.558 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](OC)[C@@H](C)CC)c1[O-] ZINC000294330520 199000861 /nfs/dbraw/zinc/00/08/61/199000861.db2.gz XQNCKLHYUXPXGP-SWLSCSKDSA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000294861692 199218803 /nfs/dbraw/zinc/21/88/03/199218803.db2.gz CAWWPJOZRXKRQM-ZANVPECISA-N 0 3 255.333 2.731 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CCCCO)c1ccccc1[O-] ZINC000294933656 199257856 /nfs/dbraw/zinc/25/78/56/199257856.db2.gz BSVVLRGNKPOVBE-JSGCOSHPSA-N 0 3 251.370 2.984 20 10 CFCDHN CC(C)(CCCO)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297076564 200078844 /nfs/dbraw/zinc/07/88/44/200078844.db2.gz WOBVOJJTWAFJEF-ZDUSSCGKSA-N 0 3 263.381 2.768 20 10 CFCDHN COc1cccc(CN2CC(COc3ccccc3)C2)c1O ZINC000297300747 200140488 /nfs/dbraw/zinc/14/04/88/200140488.db2.gz BOECHRSHIMBAGK-UHFFFAOYSA-N 0 3 299.370 2.912 20 10 CFCDHN C[C@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000297583645 200233451 /nfs/dbraw/zinc/23/34/51/200233451.db2.gz HGCVTJJUYHEIJH-QAPCUYQASA-N 0 3 283.371 2.877 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CN1CCCCC1)c1ccccc1[O-] ZINC000037154261 296146625 /nfs/dbraw/zinc/14/66/25/296146625.db2.gz BMHHXGBJBXNVIP-UONOGXRCSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CN(C)C)c([O-])c1 ZINC000020087883 372226244 /nfs/dbraw/zinc/22/62/44/372226244.db2.gz YGROXHUSFCGIGN-CYBMUJFWSA-N 0 3 264.413 2.939 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2ccccc2F)c1 ZINC000020088807 372227340 /nfs/dbraw/zinc/22/73/40/372227340.db2.gz FXCXBSGCNSDDIO-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2C[C@@](C)(OC)C2(C)C)c1 ZINC000089726198 374943241 /nfs/dbraw/zinc/94/32/41/374943241.db2.gz AAZWRXRVWCBXMG-GOEBONIOSA-N 0 3 279.380 2.694 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2cccc(OC)c2[O-])C1 ZINC000093419326 375232835 /nfs/dbraw/zinc/23/28/35/375232835.db2.gz CANWXCUVEQXEMC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2cccc(OC)c2[O-])C1 ZINC000093419326 375232845 /nfs/dbraw/zinc/23/28/45/375232845.db2.gz CANWXCUVEQXEMC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000093839325 375319221 /nfs/dbraw/zinc/31/92/21/375319221.db2.gz FVVVMPBLZWXTEI-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000093839325 375319223 /nfs/dbraw/zinc/31/92/23/375319223.db2.gz FVVVMPBLZWXTEI-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1cc(O)c(CN2CC[C@@](O)(C(F)(F)F)C2)cc1C ZINC000093611763 375273628 /nfs/dbraw/zinc/27/36/28/375273628.db2.gz LHXLXALMPIVLSD-ZDUSSCGKSA-N 0 3 289.297 2.508 20 10 CFCDHN COC[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000124731007 377082004 /nfs/dbraw/zinc/08/20/04/377082004.db2.gz HETWYOXBIYPXCA-CQSZACIVSA-N 0 3 280.387 2.750 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2ccccc2[O-])[C@H]2CCCO[C@@H]21 ZINC000135201236 378098046 /nfs/dbraw/zinc/09/80/46/378098046.db2.gz XLTUCQRIDOESNW-YUELXQCFSA-N 0 3 261.365 2.685 20 10 CFCDHN CC[C@H](NCc1ccnn1C)c1ccc(N(C)C)cc1 ZINC000152194475 378402654 /nfs/dbraw/zinc/40/26/54/378402654.db2.gz NDQGRPGUSIVTOI-INIZCTEOSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[C@@H](C)[C@H](N)C(=O)NCc1ccc(N(CC)CC)cc1 ZINC000178712511 380478110 /nfs/dbraw/zinc/47/81/10/380478110.db2.gz GELMJSDSAXHVGD-CJNGLKHVSA-N 0 3 291.439 2.522 20 10 CFCDHN CC[C@@H](NCC1(C)OCCO1)c1ccc(N(C)C)cc1 ZINC000179571662 380558845 /nfs/dbraw/zinc/55/88/45/380558845.db2.gz TXZHKFPREQSCKS-OAHLLOKOSA-N 0 3 278.396 2.556 20 10 CFCDHN C[C@H](CNC(=O)OC(C)(C)C)[N@H+](C)Cc1ccccc1[O-] ZINC000179574309 380559138 /nfs/dbraw/zinc/55/91/38/380559138.db2.gz DRVODBQLUDFPOX-GFCCVEGCSA-N 0 3 294.395 2.737 20 10 CFCDHN C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1ccccc1[O-] ZINC000179574309 380559143 /nfs/dbraw/zinc/55/91/43/380559143.db2.gz DRVODBQLUDFPOX-GFCCVEGCSA-N 0 3 294.395 2.737 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC000180208042 380634207 /nfs/dbraw/zinc/63/42/07/380634207.db2.gz VZNUOCUZXJUAFJ-CYBMUJFWSA-N 0 3 277.364 2.556 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000180208042 380634215 /nfs/dbraw/zinc/63/42/15/380634215.db2.gz VZNUOCUZXJUAFJ-CYBMUJFWSA-N 0 3 277.364 2.556 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180207965 380634910 /nfs/dbraw/zinc/63/49/10/380634910.db2.gz GFQAMIHFRDOTDG-NSHDSACASA-N 0 3 295.354 2.695 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180207965 380634914 /nfs/dbraw/zinc/63/49/14/380634914.db2.gz GFQAMIHFRDOTDG-NSHDSACASA-N 0 3 295.354 2.695 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000180257668 380639466 /nfs/dbraw/zinc/63/94/66/380639466.db2.gz IEZFLRBUUOIRSC-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000180257668 380639474 /nfs/dbraw/zinc/63/94/74/380639474.db2.gz IEZFLRBUUOIRSC-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC(C)(O)CC2)c1[O-] ZINC000180286040 380643946 /nfs/dbraw/zinc/64/39/46/380643946.db2.gz NSGRAVYMGXTGEN-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN COc1ccc(O)c(CN2CCc3ccc(OC)cc3C2)c1 ZINC000179861488 380587824 /nfs/dbraw/zinc/58/78/24/380587824.db2.gz RKLQWSBTTGAJDR-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)NCc1ccccc1 ZINC000179878529 380592284 /nfs/dbraw/zinc/59/22/84/380592284.db2.gz TWKDNFKBYFXDCK-KBPBESRZSA-N 0 3 298.386 2.748 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000179902980 380596151 /nfs/dbraw/zinc/59/61/51/380596151.db2.gz KTEVSFPBNSKMRT-PXAZEXFGSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@@H](C)CCSC)cc1OC ZINC000180349828 380646256 /nfs/dbraw/zinc/64/62/56/380646256.db2.gz XEHDDCOPVXIRDR-NSHDSACASA-N 0 3 299.436 2.983 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@@H](C)CCSC)cc1OC ZINC000180349828 380646260 /nfs/dbraw/zinc/64/62/60/380646260.db2.gz XEHDDCOPVXIRDR-NSHDSACASA-N 0 3 299.436 2.983 20 10 CFCDHN C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000180172044 380628345 /nfs/dbraw/zinc/62/83/45/380628345.db2.gz JIDDVCDTGLJGEY-ZJUUUORDSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@@H]1[C@H](C)SCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000180172044 380628349 /nfs/dbraw/zinc/62/83/49/380628349.db2.gz JIDDVCDTGLJGEY-ZJUUUORDSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000180739139 380695353 /nfs/dbraw/zinc/69/53/53/380695353.db2.gz ALHKPGSMFUSHIM-MRXNPFEDSA-N 0 3 275.323 2.529 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C(C)(C)CCO)c1[O-] ZINC000182220900 381027467 /nfs/dbraw/zinc/02/74/67/381027467.db2.gz NIAHBFSOGPEPKP-UHFFFAOYSA-N 0 3 257.761 2.605 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](CO)C[C@@H]2C)c1[O-] ZINC000289223895 381027636 /nfs/dbraw/zinc/02/76/36/381027636.db2.gz AGSLSSHEOHBMSN-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](CO)C[C@@H]2C)c1[O-] ZINC000289223895 381027642 /nfs/dbraw/zinc/02/76/42/381027642.db2.gz AGSLSSHEOHBMSN-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN COc1cc([O-])c(C[NH2+][C@H](C)CC(C)(C)OC)cc1OC ZINC000182478174 381095469 /nfs/dbraw/zinc/09/54/69/381095469.db2.gz FYQWHKLKUPIXEL-LLVKDONJSA-N 0 3 297.395 2.703 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCOC[C@@H]1CCCO1)CC2 ZINC000295969631 381188329 /nfs/dbraw/zinc/18/83/29/381188329.db2.gz MQOPSPGBNYWSMI-LSDHHAIUSA-N 0 3 291.391 2.555 20 10 CFCDHN CCNC(=O)c1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000183419932 381269070 /nfs/dbraw/zinc/26/90/70/381269070.db2.gz KAZQPFDEJPOQOY-CYBMUJFWSA-N 0 3 298.386 2.993 20 10 CFCDHN COc1ncccc1CN[C@@H]1CCc2cccc(O)c21 ZINC000296179923 381289064 /nfs/dbraw/zinc/28/90/64/381289064.db2.gz YCBOGPQQZBUINS-CYBMUJFWSA-N 0 3 270.332 2.573 20 10 CFCDHN C[C@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1ccccc1[O-] ZINC000183625549 381297496 /nfs/dbraw/zinc/29/74/96/381297496.db2.gz GGVMWLOGJAEMCM-VIFPVBQESA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(O)CCc2ccccc21)c1ccccc1[O-] ZINC000183628083 381297681 /nfs/dbraw/zinc/29/76/81/381297681.db2.gz HGUMBAOKUXDWMZ-SCLBCKFNSA-N 0 3 283.371 2.877 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(c2ccccn2)C1)c1ccccc1[O-] ZINC000183628802 381297835 /nfs/dbraw/zinc/29/78/35/381297835.db2.gz HZLWTVWHFVZOPA-KBPBESRZSA-N 0 3 283.375 2.717 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccccc1[O-] ZINC000183518362 381282182 /nfs/dbraw/zinc/28/21/82/381282182.db2.gz AXUYWNWIHXRKTA-NEPJUHHUSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H]([NH2+]CC[S@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000183517680 381282291 /nfs/dbraw/zinc/28/22/91/381282291.db2.gz YEESKXJUEDLBCP-VOJFVSQTSA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccccc1[O-] ZINC000183544907 381285109 /nfs/dbraw/zinc/28/51/09/381285109.db2.gz NACKIHOXALDXRF-IHRRRGAJSA-N 0 3 262.397 2.916 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183538116 381286169 /nfs/dbraw/zinc/28/61/69/381286169.db2.gz ZJMDPJLTRWQHNI-OLZOCXBDSA-N 0 3 251.370 2.842 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1cccc(CO)c1)CC2 ZINC000296229641 381312048 /nfs/dbraw/zinc/31/20/48/381312048.db2.gz AKCZZKIYYCHDBD-OAHLLOKOSA-N 0 3 269.344 2.662 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296243378 381316455 /nfs/dbraw/zinc/31/64/55/381316455.db2.gz AXGCZDXNCWIQDR-GXTWGEPZSA-N 0 3 290.407 2.522 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000296393556 381375934 /nfs/dbraw/zinc/37/59/34/381375934.db2.gz JZDOWZXJSVEMFT-DLBZAZTESA-N 0 3 297.398 2.881 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1[O-] ZINC000184677691 381458057 /nfs/dbraw/zinc/45/80/57/381458057.db2.gz KMWHLKWMEIUFKO-FUNVUKJBSA-N 0 3 297.782 2.542 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1[O-] ZINC000184677691 381458061 /nfs/dbraw/zinc/45/80/61/381458061.db2.gz KMWHLKWMEIUFKO-FUNVUKJBSA-N 0 3 297.782 2.542 20 10 CFCDHN COCCC[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184840933 381486112 /nfs/dbraw/zinc/48/61/12/381486112.db2.gz QOHKECIQJLKEJL-GFCCVEGCSA-N 0 3 263.381 2.958 20 10 CFCDHN Cc1cccnc1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000296662267 381497708 /nfs/dbraw/zinc/49/77/08/381497708.db2.gz ZXVUNUXZSLHOGW-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN CCOCCCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185071723 381528039 /nfs/dbraw/zinc/52/80/39/381528039.db2.gz DQXOHAAXJWQFEF-LLVKDONJSA-N 0 3 255.333 2.999 20 10 CFCDHN COC1(CC[NH2+][C@H]2CCc3cccc([O-])c32)CCC1 ZINC000297263980 381555535 /nfs/dbraw/zinc/55/55/35/381555535.db2.gz KEHMUSUMNKQTMQ-ZDUSSCGKSA-N 0 3 261.365 2.928 20 10 CFCDHN COC1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCC1 ZINC000297300597 381556430 /nfs/dbraw/zinc/55/64/30/381556430.db2.gz MJBAZJOPZRUDJV-CYBMUJFWSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297498050 381562912 /nfs/dbraw/zinc/56/29/12/381562912.db2.gz BUEMRYRIVRXXSL-YGRLFVJLSA-N 0 3 271.364 2.772 20 10 CFCDHN CCOC(=O)C[C@@](C)([NH2+]Cc1ccccc1[O-])C(C)C ZINC000185234669 381572309 /nfs/dbraw/zinc/57/23/09/381572309.db2.gz JQEXDUPNEHQSGZ-MRXNPFEDSA-N 0 3 279.380 2.850 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185350303 381607878 /nfs/dbraw/zinc/60/78/78/381607878.db2.gz GEBUTTTUOMYOGH-UWVGGRQHSA-N 0 3 277.343 2.985 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000371316003 381588597 /nfs/dbraw/zinc/58/85/97/381588597.db2.gz ZADWHHWQINKTJL-ZIAGYGMSSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000371316003 381588608 /nfs/dbraw/zinc/58/86/08/381588608.db2.gz ZADWHHWQINKTJL-ZIAGYGMSSA-N 0 3 261.365 2.559 20 10 CFCDHN C[C@H](O)CC[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185456372 381638013 /nfs/dbraw/zinc/63/80/13/381638013.db2.gz VGOQZYYYBPZRGV-RYUDHWBXSA-N 0 3 263.381 2.693 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c([O-])c1 ZINC000185475553 381643813 /nfs/dbraw/zinc/64/38/13/381643813.db2.gz YFWSAZNZXRZESX-CWTRNNRKSA-N 0 3 283.437 2.898 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c1 ZINC000185474904 381643969 /nfs/dbraw/zinc/64/39/69/381643969.db2.gz CUMJPXJJXLONOX-BUXKBTBVSA-N 0 3 283.437 2.898 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCC(O)(c2cccnc2)CC1 ZINC000185695675 381708449 /nfs/dbraw/zinc/70/84/49/381708449.db2.gz SNFPAKOMOSXHCD-UHFFFAOYSA-N 0 3 298.386 2.707 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCO[C@@H]2CCOC2)c([O-])c1 ZINC000185705056 381709465 /nfs/dbraw/zinc/70/94/65/381709465.db2.gz CDWFXFYTDJPQNA-UONOGXRCSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCCSCC2)cc1C ZINC000298774265 381744102 /nfs/dbraw/zinc/74/41/02/381744102.db2.gz HSVDENMRYDCCAZ-UHFFFAOYSA-N 0 3 251.395 2.948 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCCSCC2)cc1C ZINC000298774265 381744107 /nfs/dbraw/zinc/74/41/07/381744107.db2.gz HSVDENMRYDCCAZ-UHFFFAOYSA-N 0 3 251.395 2.948 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC2CCOCC2)c([O-])c1 ZINC000186074482 381818554 /nfs/dbraw/zinc/81/85/54/381818554.db2.gz MVTFOIJEWQEPBZ-AWEZNQCLSA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1c(CN[C@H](C)c2cc(C)ccc2O)cnn1C ZINC000186188036 381847924 /nfs/dbraw/zinc/84/79/24/381847924.db2.gz KAXKFDUIWKFNED-LLVKDONJSA-N 0 3 259.353 2.593 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000292845589 381861814 /nfs/dbraw/zinc/86/18/14/381861814.db2.gz SPKRTQASUFYAIL-HNNXBMFYSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000292845589 381861817 /nfs/dbraw/zinc/86/18/17/381861817.db2.gz SPKRTQASUFYAIL-HNNXBMFYSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@H]3OCC[C@H]32)cc1C ZINC000373490489 382016345 /nfs/dbraw/zinc/01/63/45/382016345.db2.gz QKLBWGQCHPBFPI-GDBMZVCRSA-N 0 3 261.365 2.762 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@H]3OCC[C@H]32)cc1C ZINC000373490489 382016349 /nfs/dbraw/zinc/01/63/49/382016349.db2.gz QKLBWGQCHPBFPI-GDBMZVCRSA-N 0 3 261.365 2.762 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000373370701 381988743 /nfs/dbraw/zinc/98/87/43/381988743.db2.gz RGGQQJZIYIWASC-IAGOWNOFSA-N 0 3 291.391 2.696 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000362386552 382042488 /nfs/dbraw/zinc/04/24/88/382042488.db2.gz ULRREWDOIPWLCL-DAXOMENPSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000362386552 382042494 /nfs/dbraw/zinc/04/24/94/382042494.db2.gz ULRREWDOIPWLCL-DAXOMENPSA-N 0 3 291.391 2.646 20 10 CFCDHN C[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccccc1[O-] ZINC000374717093 382053209 /nfs/dbraw/zinc/05/32/09/382053209.db2.gz MJQUTVWTYPPSJA-ZDUSSCGKSA-N 0 3 285.391 2.818 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968641 382113313 /nfs/dbraw/zinc/11/33/13/382113313.db2.gz NGZVINRBWHRKHQ-SRVKXCTJSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968641 382113315 /nfs/dbraw/zinc/11/33/15/382113315.db2.gz NGZVINRBWHRKHQ-SRVKXCTJSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968641 382113318 /nfs/dbraw/zinc/11/33/18/382113318.db2.gz NGZVINRBWHRKHQ-SRVKXCTJSA-N 0 3 296.361 2.948 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@]3(CCOC3)C2)c1 ZINC000375252479 382072783 /nfs/dbraw/zinc/07/27/83/382072783.db2.gz IPMIPJOUEMTUAU-LRDDRELGSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@]3(CCOC3)C2)c1 ZINC000375252479 382072786 /nfs/dbraw/zinc/07/27/86/382072786.db2.gz IPMIPJOUEMTUAU-LRDDRELGSA-N 0 3 277.364 2.574 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000375301894 382079591 /nfs/dbraw/zinc/07/95/91/382079591.db2.gz ICOBHNXTECDFKQ-OAHLLOKOSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000375301894 382079595 /nfs/dbraw/zinc/07/95/95/382079595.db2.gz ICOBHNXTECDFKQ-OAHLLOKOSA-N 0 3 265.328 2.534 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000293725271 382251381 /nfs/dbraw/zinc/25/13/81/382251381.db2.gz QZIPVJAOBLUGDG-LBPRGKRZSA-N 0 3 287.787 2.959 20 10 CFCDHN CC(C)(CO)[C@@H]([NH2+]Cc1ccccc1[O-])c1cccnc1 ZINC000293758786 382266094 /nfs/dbraw/zinc/26/60/94/382266094.db2.gz XMKVFJYUABJYNH-INIZCTEOSA-N 0 3 286.375 2.637 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1[O-] ZINC000293859380 382309132 /nfs/dbraw/zinc/30/91/32/382309132.db2.gz BZIFMUNXBCCVGM-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1[O-] ZINC000293859380 382309137 /nfs/dbraw/zinc/30/91/37/382309137.db2.gz BZIFMUNXBCCVGM-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@]23CCOC3)c1 ZINC000377685329 382320224 /nfs/dbraw/zinc/32/02/24/382320224.db2.gz ZTMCOQXZCUIRMV-MLGOLLRUSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@]23CCOC3)c1 ZINC000377685329 382320229 /nfs/dbraw/zinc/32/02/29/382320229.db2.gz ZTMCOQXZCUIRMV-MLGOLLRUSA-N 0 3 277.364 2.717 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cc(OC)ccc1[O-])C(C)C ZINC000188003441 382321233 /nfs/dbraw/zinc/32/12/33/382321233.db2.gz NCLMJNVOXRMPIO-CQSZACIVSA-N 0 3 267.369 2.552 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1C[C@@H]3CCCCC[C@H]31)OCO2 ZINC000378345174 382442039 /nfs/dbraw/zinc/44/20/39/382442039.db2.gz HWMUSBRSGOYVHS-WCQYABFASA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1C[C@@H]3CCCCC[C@H]31)OCO2 ZINC000378345174 382442041 /nfs/dbraw/zinc/44/20/41/382442041.db2.gz HWMUSBRSGOYVHS-WCQYABFASA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@H]([NH+]2CCCC2)C1 ZINC000378490463 382471288 /nfs/dbraw/zinc/47/12/88/382471288.db2.gz CTKFAKQLHJCCFA-HNNXBMFYSA-N 0 3 278.371 2.592 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cc(OCC)ccc1[O-])C(C)C ZINC000188866185 382495077 /nfs/dbraw/zinc/49/50/77/382495077.db2.gz BSTKWBZFOAHCTO-OAHLLOKOSA-N 0 3 281.396 2.942 20 10 CFCDHN C[C@@H]1CCC[N@@H+]1C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000378495723 382472824 /nfs/dbraw/zinc/47/28/24/382472824.db2.gz MFYZPAYXXMAMPR-CYBMUJFWSA-N 0 3 292.398 2.980 20 10 CFCDHN C[C@@H]1CCC[N@H+]1C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000378495723 382472827 /nfs/dbraw/zinc/47/28/27/382472827.db2.gz MFYZPAYXXMAMPR-CYBMUJFWSA-N 0 3 292.398 2.980 20 10 CFCDHN CCOC(=O)C1(C)CC[NH+](Cc2cc(C)ccc2[O-])CC1 ZINC000378541533 382479572 /nfs/dbraw/zinc/47/95/72/382479572.db2.gz MNDPMJDLVOTEKD-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN COCCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000188829454 382487529 /nfs/dbraw/zinc/48/75/29/382487529.db2.gz MBLPLZPHQPOAGZ-CQSZACIVSA-N 0 3 299.798 2.591 20 10 CFCDHN COCCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000188829454 382487534 /nfs/dbraw/zinc/48/75/34/382487534.db2.gz MBLPLZPHQPOAGZ-CQSZACIVSA-N 0 3 299.798 2.591 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCOCC(F)F)c1[O-] ZINC000189001872 382521500 /nfs/dbraw/zinc/52/15/00/382521500.db2.gz WTZKNXAFDJALIF-UHFFFAOYSA-N 0 3 279.714 2.725 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H](OC)CC2)c1 ZINC000378640044 382498766 /nfs/dbraw/zinc/49/87/66/382498766.db2.gz WBIHZJKJSXSSTH-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H](OC)CC2)c1 ZINC000378640044 382498767 /nfs/dbraw/zinc/49/87/67/382498767.db2.gz WBIHZJKJSXSSTH-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])OC ZINC000294320338 382507706 /nfs/dbraw/zinc/50/77/06/382507706.db2.gz WQRLZZMCPKCKFD-YGRLFVJLSA-N 0 3 255.333 2.682 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])OC ZINC000294320324 382508126 /nfs/dbraw/zinc/50/81/26/382508126.db2.gz WQRLZZMCPKCKFD-HZMBPMFUSA-N 0 3 255.333 2.682 20 10 CFCDHN CC[C@H]([NH2+]CCc1nccnc1C)c1ccccc1[O-] ZINC000294908878 382542798 /nfs/dbraw/zinc/54/27/98/382542798.db2.gz GBGPHJBPDLFQOH-AWEZNQCLSA-N 0 3 271.364 2.774 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000367034059 382556053 /nfs/dbraw/zinc/55/60/53/382556053.db2.gz VDAHPKYVOLYBMW-UHFFFAOYSA-N 0 3 279.355 2.924 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000367356656 382565629 /nfs/dbraw/zinc/56/56/29/382565629.db2.gz OYAROLZODOVTOM-IMJJTQAJSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000367356656 382565633 /nfs/dbraw/zinc/56/56/33/382565633.db2.gz OYAROLZODOVTOM-IMJJTQAJSA-N 0 3 274.408 2.869 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@](C)(COC)C2)c1 ZINC000295186322 382579668 /nfs/dbraw/zinc/57/96/68/382579668.db2.gz WQSDAHYEFBVLKT-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@](C)(COC)C2)c1 ZINC000295186322 382579673 /nfs/dbraw/zinc/57/96/73/382579673.db2.gz WQSDAHYEFBVLKT-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c1 ZINC000251685373 383394102 /nfs/dbraw/zinc/39/41/02/383394102.db2.gz JENGNLPZQBTFGD-JPYFCXBMSA-N 0 3 277.364 2.619 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+]C12CCC2)c1ccc(F)cc1[O-] ZINC000530215902 383768382 /nfs/dbraw/zinc/76/83/82/383768382.db2.gz KDGVPNIYRWGAQJ-DZGCQCFKSA-N 0 3 278.371 2.857 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCNC12CCC2)c1ccc(F)cc1[O-] ZINC000530215902 383768387 /nfs/dbraw/zinc/76/83/87/383768387.db2.gz KDGVPNIYRWGAQJ-DZGCQCFKSA-N 0 3 278.371 2.857 20 10 CFCDHN C[C@@H]1C[C@@H](N[C@H]2CC[NH2+]C23CCC3)c2c1c(F)ccc2[O-] ZINC000530215986 383768686 /nfs/dbraw/zinc/76/86/86/383768686.db2.gz LKAQJOGNPKZXSG-QKCSRTOESA-N 0 3 290.382 2.954 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCSC2)c([O-])c1 ZINC000266124199 384085944 /nfs/dbraw/zinc/08/59/44/384085944.db2.gz AXQZIPDQFSGOBX-LBPRGKRZSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000268999967 384708660 /nfs/dbraw/zinc/70/86/60/384708660.db2.gz ZFSGKMVXCPTFNL-CQSZACIVSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)CC2CCC2)c1 ZINC000281186863 385187112 /nfs/dbraw/zinc/18/71/12/385187112.db2.gz QZONLSLGPXDLIP-JSGCOSHPSA-N 0 3 263.381 2.902 20 10 CFCDHN CCCOc1ccc(C[NH2+]C2(CN(C)C)CCC2)c([O-])c1 ZINC000282274794 385266261 /nfs/dbraw/zinc/26/62/61/385266261.db2.gz QASCLBPQKDLRAD-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCC2([S@](C)=O)CC2)cc1 ZINC000282277243 385268414 /nfs/dbraw/zinc/26/84/14/385268414.db2.gz KVZPXQAWRRRCGK-RBZFPXEDSA-N 0 3 294.464 2.704 20 10 CFCDHN CCOc1cccc(C[N@H+](CCO)C2CCCC2)c1[O-] ZINC000270983092 385291148 /nfs/dbraw/zinc/29/11/48/385291148.db2.gz DWIIJNICHMECHQ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCO)C2CCCC2)c1[O-] ZINC000270983092 385291154 /nfs/dbraw/zinc/29/11/54/385291154.db2.gz DWIIJNICHMECHQ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCCCN(CC(=O)NC(C)C)Cc1ccccc1O ZINC000282381794 385298120 /nfs/dbraw/zinc/29/81/20/385298120.db2.gz GCNNNCDQHZOTFK-UHFFFAOYSA-N 0 3 278.396 2.519 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCCCNC1=O ZINC000282564320 385343219 /nfs/dbraw/zinc/34/32/19/385343219.db2.gz YWVIQSBXECFVQE-OAHLLOKOSA-N 0 3 290.407 2.663 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCCCNC1=O ZINC000282564320 385343220 /nfs/dbraw/zinc/34/32/20/385343220.db2.gz YWVIQSBXECFVQE-OAHLLOKOSA-N 0 3 290.407 2.663 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC(C)(C)CCCO)c1 ZINC000271504899 385384136 /nfs/dbraw/zinc/38/41/36/385384136.db2.gz LDHFVJXHWDZMLY-UHFFFAOYSA-N 0 3 281.396 2.679 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H]2COC3(CCCC3)O2)cc1C ZINC000271472195 385384475 /nfs/dbraw/zinc/38/44/75/385384475.db2.gz WDZJKYBMTJMHJX-HNNXBMFYSA-N 0 3 291.391 2.784 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H]2CCO[C@H](C)C2)cc1C ZINC000271554448 385385027 /nfs/dbraw/zinc/38/50/27/385385027.db2.gz UZCRGCONNAAHST-KGLIPLIRSA-N 0 3 263.381 2.914 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000271524595 385385254 /nfs/dbraw/zinc/38/52/54/385385254.db2.gz NJNLZAWZXGMYCC-GOEBONIOSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CCC[C@H]2O)c1[O-] ZINC000271797301 385392132 /nfs/dbraw/zinc/39/21/32/385392132.db2.gz KGBHKOKGDLPXRP-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CCC[C@H]2O)c1[O-] ZINC000271797301 385392136 /nfs/dbraw/zinc/39/21/36/385392136.db2.gz KGBHKOKGDLPXRP-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C(C)(C)[C@@H](C)O)c1[O-] ZINC000271797192 385392770 /nfs/dbraw/zinc/39/27/70/385392770.db2.gz IFKVGUZKNPPTGZ-SECBINFHSA-N 0 3 257.761 2.603 20 10 CFCDHN CCC(CC)(CO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000271857162 385395087 /nfs/dbraw/zinc/39/50/87/385395087.db2.gz JPVSCVFPPKOIIZ-UHFFFAOYSA-N 0 3 271.788 2.995 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCCC(F)(F)F)cc1OC ZINC000271870490 385395821 /nfs/dbraw/zinc/39/58/21/385395821.db2.gz XOHMQUUGQSFJIG-UHFFFAOYSA-N 0 3 293.285 2.842 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)CCO)c([O-])c1 ZINC000283693775 385489850 /nfs/dbraw/zinc/48/98/50/385489850.db2.gz ANKANFZMCWUAME-GWCFXTLKSA-N 0 3 251.370 2.678 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c1ccccc1[O-] ZINC000284337549 385547776 /nfs/dbraw/zinc/54/77/76/385547776.db2.gz MPFQYADJLYAZPA-NOLJZWGESA-N 0 3 295.423 2.591 20 10 CFCDHN COC[C@@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284006659 385523929 /nfs/dbraw/zinc/52/39/29/385523929.db2.gz HYAOZXAYHBWWOX-WCQYABFASA-N 0 3 251.370 2.942 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000272393380 385526436 /nfs/dbraw/zinc/52/64/36/385526436.db2.gz HQSIIBYFWVWQHV-ZBFHGGJFSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000272393380 385526437 /nfs/dbraw/zinc/52/64/37/385526437.db2.gz HQSIIBYFWVWQHV-ZBFHGGJFSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284948099 385551751 /nfs/dbraw/zinc/55/17/51/385551751.db2.gz HMGKDKPSRYJBRW-HOCLYGCPSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284948099 385551756 /nfs/dbraw/zinc/55/17/56/385551756.db2.gz HMGKDKPSRYJBRW-HOCLYGCPSA-N 0 3 277.364 2.544 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000285236373 385552715 /nfs/dbraw/zinc/55/27/15/385552715.db2.gz SIKFZEGDUHUGKK-UKRRQHHQSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000285236373 385552721 /nfs/dbraw/zinc/55/27/21/385552721.db2.gz SIKFZEGDUHUGKK-UKRRQHHQSA-N 0 3 265.328 2.675 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000285320333 385553704 /nfs/dbraw/zinc/55/37/04/385553704.db2.gz WXGNAFFLJHMCFM-GJZGRUSLSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000285320333 385553709 /nfs/dbraw/zinc/55/37/09/385553709.db2.gz WXGNAFFLJHMCFM-GJZGRUSLSA-N 0 3 261.365 2.844 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H]2CCOC[C@@H]2C)c1 ZINC000285413098 385555458 /nfs/dbraw/zinc/55/54/58/385555458.db2.gz GCJNWDMIVTVYDK-STQMWFEESA-N 0 3 279.380 2.553 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(CCCO)CC2)c1[O-] ZINC000272831842 385627495 /nfs/dbraw/zinc/62/74/95/385627495.db2.gz FNRPACWYAYUDGG-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273303155 385676363 /nfs/dbraw/zinc/67/63/63/385676363.db2.gz CDBIYWIYEVWKAF-OCCSQVGLSA-N 0 3 292.423 2.964 20 10 CFCDHN Cc1ccc([C@@H](C)NC[C@@](C)(O)C(F)(F)F)c(O)c1C ZINC000273349504 385677245 /nfs/dbraw/zinc/67/72/45/385677245.db2.gz BLSWJFSGGVIYQP-ZWNOBZJWSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1C ZINC000273349504 385677251 /nfs/dbraw/zinc/67/72/51/385677251.db2.gz BLSWJFSGGVIYQP-ZWNOBZJWSA-N 0 3 291.313 2.973 20 10 CFCDHN COCCOCCC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273379285 385678859 /nfs/dbraw/zinc/67/88/59/385678859.db2.gz HVKWWAKYLNKENO-AWEZNQCLSA-N 0 3 281.396 2.713 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(=O)NC(C)C)c([O-])c1C ZINC000273372505 385679524 /nfs/dbraw/zinc/67/95/24/385679524.db2.gz GHESIOIBWGPZSY-CYBMUJFWSA-N 0 3 278.396 2.574 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCn2ccnc2)c([O-])c1C ZINC000273392052 385681365 /nfs/dbraw/zinc/68/13/65/385681365.db2.gz LBRLWVPFHAWTSX-ZDUSSCGKSA-N 0 3 259.353 2.556 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000273430125 385682879 /nfs/dbraw/zinc/68/28/79/385682879.db2.gz VHSUQRZHCZXJLJ-ZDUSSCGKSA-N 0 3 273.380 2.946 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cc(F)ccc1[O-] ZINC000273516878 385686124 /nfs/dbraw/zinc/68/61/24/385686124.db2.gz SSPRPEOJOUEVKK-DGCLKSJQSA-N 0 3 295.354 2.868 20 10 CFCDHN Cc1noc(CCC[NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])n1 ZINC000273517855 385686406 /nfs/dbraw/zinc/68/64/06/385686406.db2.gz SVHCQBVKRXRPNP-LBPRGKRZSA-N 0 3 289.379 2.984 20 10 CFCDHN CNC(=O)C1CCC([NH2+][C@H](C)c2ccc(C)cc2[O-])CC1 ZINC000273556376 385688397 /nfs/dbraw/zinc/68/83/97/385688397.db2.gz HACCXKJQPKJMOY-IYXRBSQSSA-N 0 3 290.407 2.656 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCSCCCO)c([O-])c1C ZINC000273585157 385689319 /nfs/dbraw/zinc/68/93/19/385689319.db2.gz NOSJZRNVBUHCGU-ZDUSSCGKSA-N 0 3 283.437 2.775 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c(O)c1C ZINC000273615750 385691601 /nfs/dbraw/zinc/69/16/01/385691601.db2.gz XHONCCVLFPJALF-OLZOCXBDSA-N 0 3 292.423 2.963 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cc(F)ccc2[O-])o1 ZINC000273619839 385692491 /nfs/dbraw/zinc/69/24/91/385692491.db2.gz YQXMNPZRKUDQNO-HZMBPMFUSA-N 0 3 279.311 2.817 20 10 CFCDHN CNC(=O)C1CCC([NH2+][C@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273621878 385692743 /nfs/dbraw/zinc/69/27/43/385692743.db2.gz ZJFRFCYDBYZYAQ-IYXRBSQSSA-N 0 3 290.407 2.656 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(C)c2[O-])[C@@]12CCCO2 ZINC000273712769 385694639 /nfs/dbraw/zinc/69/46/39/385694639.db2.gz GNHIVTWOQCVJOA-UXLLHSPISA-N 0 3 291.391 2.517 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCN3CCCC[C@H]13)CC2 ZINC000295967127 285397594 /nfs/dbraw/zinc/39/75/94/285397594.db2.gz MKGTZVNWKUWAAO-RBSFLKMASA-N 0 3 272.392 2.596 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1COc3ccccc3C1)CC2 ZINC000297502535 285397742 /nfs/dbraw/zinc/39/77/42/285397742.db2.gz CAXUPQCMQDIIDL-HUUCEWRRSA-N 0 3 281.355 2.973 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H]3OCCC[C@H]3C2)cc1F ZINC000372399637 393447451 /nfs/dbraw/zinc/44/74/51/393447451.db2.gz QSCPEVSLPSRILE-YOEHRIQHSA-N 0 3 292.398 2.893 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H]3OCCC[C@H]3C2)cc1F ZINC000372399636 393447770 /nfs/dbraw/zinc/44/77/70/393447770.db2.gz QSCPEVSLPSRILE-WMLDXEAASA-N 0 3 292.398 2.893 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000372434982 393449764 /nfs/dbraw/zinc/44/97/64/393449764.db2.gz HFACYQIQIVLHHE-CQSZACIVSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000372434982 393449770 /nfs/dbraw/zinc/44/97/70/393449770.db2.gz HFACYQIQIVLHHE-CQSZACIVSA-N 0 3 283.375 2.870 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1CO ZINC000372773179 393456846 /nfs/dbraw/zinc/45/68/46/393456846.db2.gz QMDBZNGGVTZNJV-MAUKXSAKSA-N 0 3 283.371 2.778 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1[O-] ZINC000374156483 393486539 /nfs/dbraw/zinc/48/65/39/393486539.db2.gz GLHCNNPVXFTHRB-MAZHCROVSA-N 0 3 291.391 2.694 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000374158015 393486710 /nfs/dbraw/zinc/48/67/10/393486710.db2.gz JPLNKTYVIMNFTI-BMFZPTHFSA-N 0 3 275.392 2.994 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](CC(C)(C)O)C2CC2)c1[O-] ZINC000189943557 393575952 /nfs/dbraw/zinc/57/59/52/393575952.db2.gz SNXSHOUCXLZNRJ-UHFFFAOYSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](CC(C)(C)O)C2CC2)c1[O-] ZINC000189943557 393575956 /nfs/dbraw/zinc/57/59/56/393575956.db2.gz SNXSHOUCXLZNRJ-UHFFFAOYSA-N 0 3 299.798 2.790 20 10 CFCDHN C[C@@H](c1ccccc1)[N@H+](CCO)Cc1ccccc1[O-] ZINC000119276223 393917157 /nfs/dbraw/zinc/91/71/57/393917157.db2.gz UZZWETDOCJSQOC-AWEZNQCLSA-N 0 3 271.360 2.948 20 10 CFCDHN C[C@@H](c1ccccc1)[N@@H+](CCO)Cc1ccccc1[O-] ZINC000119276223 393917160 /nfs/dbraw/zinc/91/71/60/393917160.db2.gz UZZWETDOCJSQOC-AWEZNQCLSA-N 0 3 271.360 2.948 20 10 CFCDHN CC[C@H]([NH2+]CC1CCN(C(C)=O)CC1)c1ccccc1[O-] ZINC000121091976 393948154 /nfs/dbraw/zinc/94/81/54/393948154.db2.gz CFZBSMCSVPFDMX-INIZCTEOSA-N 0 3 290.407 2.691 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCCC[C@H](CO)C2)c1 ZINC000366813035 394248083 /nfs/dbraw/zinc/24/80/83/394248083.db2.gz VVCGVJLANCMFFN-OLZOCXBDSA-N 0 3 279.380 2.556 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCCC[C@H](CO)C2)c1 ZINC000366813035 394248087 /nfs/dbraw/zinc/24/80/87/394248087.db2.gz VVCGVJLANCMFFN-OLZOCXBDSA-N 0 3 279.380 2.556 20 10 CFCDHN CC[C@@H](CO)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184841578 286846528 /nfs/dbraw/zinc/84/65/28/286846528.db2.gz ZEQRCKWNBMNDLP-FZMZJTMJSA-N 0 3 263.381 2.693 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1ccccc1[O-] ZINC000020122211 171002915 /nfs/dbraw/zinc/00/29/15/171002915.db2.gz JTMWZKOOIZQYFU-JSGCOSHPSA-N 0 3 274.364 2.939 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)N2CCCCC2)c1 ZINC000038028447 174017729 /nfs/dbraw/zinc/01/77/29/174017729.db2.gz MMTZDPRJZYZADQ-KGLIPLIRSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[C@H]2CCCO2)c1 ZINC000038095582 174109184 /nfs/dbraw/zinc/10/91/84/174109184.db2.gz JZOHKJGXGZVWBP-NWDGAFQWSA-N 0 3 265.353 2.621 20 10 CFCDHN CCOc1ccc(O)c(CN2CCOCC3(CCC3)C2)c1 ZINC000363915583 262028510 /nfs/dbraw/zinc/02/85/10/262028510.db2.gz AFRSSIACAQFARM-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN Cc1ccnc(C2CC[NH+](Cc3ccccc3[O-])CC2)n1 ZINC000368283141 267159066 /nfs/dbraw/zinc/15/90/66/267159066.db2.gz IMSYOPCJJPXQBZ-UHFFFAOYSA-N 0 3 283.375 2.870 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000368763029 267203003 /nfs/dbraw/zinc/20/30/03/267203003.db2.gz BGGQRHJEJNBTHF-IAGOWNOFSA-N 0 3 291.391 2.696 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000369888660 267274281 /nfs/dbraw/zinc/27/42/81/267274281.db2.gz OVOQEWUTMXDHAZ-PVAVHDDUSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000369888660 267274285 /nfs/dbraw/zinc/27/42/85/267274285.db2.gz OVOQEWUTMXDHAZ-PVAVHDDUSA-N 0 3 291.391 2.723 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCc3c[nH]nc3C2)c1[O-] ZINC000370364125 267312553 /nfs/dbraw/zinc/31/25/53/267312553.db2.gz CQDBHOMNFOVVNP-CYBMUJFWSA-N 0 3 291.782 2.724 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCCC23CCOCC3)c([O-])c1 ZINC000370593001 267330160 /nfs/dbraw/zinc/33/01/60/267330160.db2.gz KVGNMHUCUCRUBL-INIZCTEOSA-N 0 3 291.391 2.840 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCCC23CCOCC3)c([O-])c1 ZINC000370593002 267330250 /nfs/dbraw/zinc/33/02/50/267330250.db2.gz KVGNMHUCUCRUBL-MRXNPFEDSA-N 0 3 291.391 2.840 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000370721679 267342447 /nfs/dbraw/zinc/34/24/47/267342447.db2.gz AJRDPBBTJWKAOD-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000370721679 267342448 /nfs/dbraw/zinc/34/24/48/267342448.db2.gz AJRDPBBTJWKAOD-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2Cn2cccn2)c1 ZINC000371371107 267395723 /nfs/dbraw/zinc/39/57/23/267395723.db2.gz ADACLQBMWPMYKL-MRXNPFEDSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2Cn2cccn2)c1 ZINC000371371107 267395726 /nfs/dbraw/zinc/39/57/26/267395726.db2.gz ADACLQBMWPMYKL-MRXNPFEDSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccccc3[C@@H]2O)c([O-])c1 ZINC000290399808 274760085 /nfs/dbraw/zinc/76/00/85/274760085.db2.gz SUZGEZDCEDVIML-QITLCBANSA-N 0 3 299.370 2.846 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@]1(O)CCc3ccccc31)CC2 ZINC000297050660 275061615 /nfs/dbraw/zinc/06/16/15/275061615.db2.gz VOVZWRCIVKOXOV-VQIMIIECSA-N 0 3 295.382 2.803 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+]Cc1cccc(C)c1[O-] ZINC000279689103 276118078 /nfs/dbraw/zinc/11/80/78/276118078.db2.gz POUFGZCRRZOQAC-CYBMUJFWSA-N 0 3 250.386 2.521 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000248754963 276175201 /nfs/dbraw/zinc/17/52/01/276175201.db2.gz IJMACXIEDMCDRM-ZIAGYGMSSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185674994 279554899 /nfs/dbraw/zinc/55/48/99/279554899.db2.gz JQWMTTACNIOXSO-POJUEXTFSA-N 0 3 287.334 2.840 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CC[C@H]3C[C@H]3C1)OCO2 ZINC000403347021 327117561 /nfs/dbraw/zinc/11/75/61/327117561.db2.gz HKPIBKHWBIFAOA-GRYCIOLGSA-N 0 3 275.348 2.647 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000375260498 329002280 /nfs/dbraw/zinc/00/22/80/329002280.db2.gz OECTZHGBLJJMOV-AHIWAGSCSA-N 0 3 291.391 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000375260498 329002282 /nfs/dbraw/zinc/00/22/82/329002282.db2.gz OECTZHGBLJJMOV-AHIWAGSCSA-N 0 3 291.391 2.963 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC[C@@H]1CC=CCC1)OCO2 ZINC000527787068 330283406 /nfs/dbraw/zinc/28/34/06/330283406.db2.gz HGCJKUGEDXCUIA-GFCCVEGCSA-N 0 3 275.348 2.957 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1 ZINC000527999158 330299842 /nfs/dbraw/zinc/29/98/42/330299842.db2.gz CODZEDMNLXMIOD-VZAVHYRXSA-N 0 3 279.380 2.863 20 10 CFCDHN CC[C@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1ccccc1[O-] ZINC000528001953 330300199 /nfs/dbraw/zinc/30/01/99/330300199.db2.gz QIERBHSXNHEJDQ-HOCLYGCPSA-N 0 3 296.370 2.996 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1cc(F)ccc1[O-] ZINC000528004650 330300388 /nfs/dbraw/zinc/30/03/88/330300388.db2.gz RGKOULNDKLYDHC-YQEZVOHVSA-N 0 3 267.344 2.994 20 10 CFCDHN C[C@@H]([NH2+]CC1COC1)c1cc2c(cc1[O-])CCCC2 ZINC000528024165 330304945 /nfs/dbraw/zinc/30/49/45/330304945.db2.gz HNVQWBZJBJJJBZ-LLVKDONJSA-N 0 3 261.365 2.568 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2(C)CCOCC2)c1[O-] ZINC000169092592 522541270 /nfs/dbraw/zinc/54/12/70/522541270.db2.gz SLKZYFBGPRTNSM-UHFFFAOYSA-N 0 3 285.771 2.713 20 10 CFCDHN CC[C@H]([NH2+]CC1([S@](C)=O)CCC1)c1ccccc1[O-] ZINC000280959984 522571986 /nfs/dbraw/zinc/57/19/86/522571986.db2.gz HOCLGIWFYKJNAV-DJJJIMSYSA-N 0 3 281.421 2.734 20 10 CFCDHN CC(C)=CCNCc1ccc(N2CCOCC2)cc1 ZINC000191630373 519439539 /nfs/dbraw/zinc/43/95/39/519439539.db2.gz NYJIOJQLPRXFLO-UHFFFAOYSA-N 0 3 260.381 2.579 20 10 CFCDHN CC(C)SCCNCc1ccc2c(c1)CCO2 ZINC000290212192 519787733 /nfs/dbraw/zinc/78/77/33/519787733.db2.gz WBBVQLYSQYQIJP-UHFFFAOYSA-N 0 3 251.395 2.853 20 10 CFCDHN CC(C)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000276918179 519821469 /nfs/dbraw/zinc/82/14/69/519821469.db2.gz QIFPCNVTYWQEIE-HZMBPMFUSA-N 0 3 269.360 2.977 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@H]2CCN(C)C2)c([O-])c1 ZINC000156021243 520345698 /nfs/dbraw/zinc/34/56/98/520345698.db2.gz SGWFKTFYWSURRC-AWEZNQCLSA-N 0 3 292.423 2.565 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@H]2CCN(C)C2)c([O-])c1 ZINC000156021243 520345701 /nfs/dbraw/zinc/34/57/01/520345701.db2.gz SGWFKTFYWSURRC-AWEZNQCLSA-N 0 3 292.423 2.565 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](CO)C(C)(C)C)c([O-])c1 ZINC000278769550 520372086 /nfs/dbraw/zinc/37/20/86/520372086.db2.gz UOUXEWWBBNONKX-HNNXBMFYSA-N 0 3 281.396 2.678 20 10 CFCDHN CCCCN(C)C[C@H](C)[NH2+]Cc1cc(OC)ccc1[O-] ZINC000290226444 520419323 /nfs/dbraw/zinc/41/93/23/520419323.db2.gz SKUMQLMEHVGIQW-ZDUSSCGKSA-N 0 3 280.412 2.611 20 10 CFCDHN CC1(C)CN(Cc2cc3c(cc2O)OCO3)[C@H]1C1CC1 ZINC000291548992 520477425 /nfs/dbraw/zinc/47/74/25/520477425.db2.gz LZZDRZWTNYAZEG-HNNXBMFYSA-N 0 3 275.348 2.741 20 10 CFCDHN CC1(C)C[N@H+](Cc2cc3c(cc2[O-])OCO3)[C@H]1C1CC1 ZINC000291548992 520477430 /nfs/dbraw/zinc/47/74/30/520477430.db2.gz LZZDRZWTNYAZEG-HNNXBMFYSA-N 0 3 275.348 2.741 20 10 CFCDHN CC1(C)C[N@@H+](Cc2cc3c(cc2[O-])OCO3)[C@H]1C1CC1 ZINC000291548992 520477438 /nfs/dbraw/zinc/47/74/38/520477438.db2.gz LZZDRZWTNYAZEG-HNNXBMFYSA-N 0 3 275.348 2.741 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2ccccc2[O-])[C@@H]2CCCO[C@H]21 ZINC000229319453 520669983 /nfs/dbraw/zinc/66/99/83/520669983.db2.gz XLTUCQRIDOESNW-NWANDNLSSA-N 0 3 261.365 2.685 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000230661720 520939454 /nfs/dbraw/zinc/93/94/54/520939454.db2.gz YWKWTHJWNYTXFX-SWLSCSKDSA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[C@H](CCO)C[NH2+]Cc1cccc(OCC)c1[O-] ZINC000231391858 521095425 /nfs/dbraw/zinc/09/54/25/521095425.db2.gz LEBXYLPVSSFPHN-CYBMUJFWSA-N 0 3 281.396 2.679 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290652217 521142624 /nfs/dbraw/zinc/14/26/24/521142624.db2.gz ZCSVYCCNMFOPGF-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290652217 521142632 /nfs/dbraw/zinc/14/26/32/521142632.db2.gz ZCSVYCCNMFOPGF-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@H](O)C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000294952609 521180664 /nfs/dbraw/zinc/18/06/64/521180664.db2.gz MQDIOLLCHQPYII-HOTGVXAUSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@H](O)C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000294952609 521180672 /nfs/dbraw/zinc/18/06/72/521180672.db2.gz MQDIOLLCHQPYII-HOTGVXAUSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@H](O)C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000294952616 521181483 /nfs/dbraw/zinc/18/14/83/521181483.db2.gz MQDIOLLCHQPYII-JKSUJKDBSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@H](O)C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000294952616 521181493 /nfs/dbraw/zinc/18/14/93/521181493.db2.gz MQDIOLLCHQPYII-JKSUJKDBSA-N 0 3 293.407 2.534 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c1[O-] ZINC000276130798 521332356 /nfs/dbraw/zinc/33/23/56/521332356.db2.gz ZGMTXYDNKPZSFF-HDJSIYSDSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c1[O-] ZINC000276130798 521332359 /nfs/dbraw/zinc/33/23/59/521332359.db2.gz ZGMTXYDNKPZSFF-HDJSIYSDSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC000245792675 521345312 /nfs/dbraw/zinc/34/53/12/521345312.db2.gz WKEGWJYAZWUUEF-DZGCQCFKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC000245792675 521345321 /nfs/dbraw/zinc/34/53/21/521345321.db2.gz WKEGWJYAZWUUEF-DZGCQCFKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C)CN2CCCCC2)c1[O-] ZINC000037154027 521374635 /nfs/dbraw/zinc/37/46/35/521374635.db2.gz FWMBIHAEEQWETB-CQSZACIVSA-N 0 3 292.423 2.755 20 10 CFCDHN CCN(Cc1ccncc1)Cc1cc(OC)ccc1O ZINC000289894722 521421008 /nfs/dbraw/zinc/42/10/08/521421008.db2.gz TYRPMRHOGMOFDY-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN CCN(Cc1cn(C)nc1C)Cc1ccc(N(C)C)cc1 ZINC000156836853 521426571 /nfs/dbraw/zinc/42/65/71/521426571.db2.gz BANPEFAVCMIGRC-UHFFFAOYSA-N 0 3 286.423 2.817 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cc(C)ccc1[O-])OC ZINC000291684908 521442355 /nfs/dbraw/zinc/44/23/55/521442355.db2.gz IDNDAJFFKFOHEB-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN CCCN(Cc1nc(C)ccc1[O-])c1ccc(C[NH3+])cc1 ZINC000278443734 521694040 /nfs/dbraw/zinc/69/40/40/521694040.db2.gz WJSKVKWVFLUKHZ-UHFFFAOYSA-N 0 3 285.391 2.971 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@H](CC)c1ccccc1[O-] ZINC000157452642 521733177 /nfs/dbraw/zinc/73/31/77/521733177.db2.gz IHXCVEKMEQZTMV-CYBMUJFWSA-N 0 3 278.396 2.595 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@H](CC)c2ccccc2[O-])CCC1 ZINC000276835544 521733539 /nfs/dbraw/zinc/73/35/39/521733539.db2.gz BRKSENCHNPSMAT-CQSZACIVSA-N 0 3 290.407 2.739 20 10 CFCDHN COc1cc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])ccn1 ZINC000062057929 522475055 /nfs/dbraw/zinc/47/50/55/522475055.db2.gz QNASFAYCULLREZ-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](CO)C2CCCC2)c1[O-] ZINC000290849300 522539480 /nfs/dbraw/zinc/53/94/80/522539480.db2.gz IXZXFXTWABAZOS-ZDUSSCGKSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCO[C@H](C)C2)c1[O-] ZINC000273792558 522540997 /nfs/dbraw/zinc/54/09/97/522540997.db2.gz VLRPCWBHNDYOCR-MNOVXSKESA-N 0 3 299.798 2.959 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H](C)C2)c1[O-] ZINC000230935350 522542850 /nfs/dbraw/zinc/54/28/50/522542850.db2.gz IGSBXOJYNKETHB-CABZTGNLSA-N 0 3 285.771 2.711 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCOC[C@H]2C)c1[O-] ZINC000277523754 522544060 /nfs/dbraw/zinc/54/40/60/522544060.db2.gz PJPDGRYOJONONE-SKDRFNHKSA-N 0 3 285.771 2.569 20 10 CFCDHN CC[C@H]([NH2+]CCCN1CCOC1=O)c1ccc(C)cc1[O-] ZINC000279952360 522584887 /nfs/dbraw/zinc/58/48/87/522584887.db2.gz BWVNNCJKZTWGML-AWEZNQCLSA-N 0 3 292.379 2.584 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@H]2CCCSC2)cc1OC ZINC000290221261 522780448 /nfs/dbraw/zinc/78/04/48/522780448.db2.gz RPYXARXTOZFPHC-LLVKDONJSA-N 0 3 297.420 2.642 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCSCC1)c1ccc(C)cc1[O-] ZINC000280207943 522836869 /nfs/dbraw/zinc/83/68/69/522836869.db2.gz TXQZZJNJFVGILU-OAHLLOKOSA-N 0 3 294.464 2.790 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)N(C)C1CC1)c1ccccc1[O-] ZINC000155698969 522858374 /nfs/dbraw/zinc/85/83/74/522858374.db2.gz GYGVLCZFOZRRNL-SWLSCSKDSA-N 0 3 262.397 2.916 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@]1(O)CCSC1)c1ccc(C)cc1[O-] ZINC000279957418 522858744 /nfs/dbraw/zinc/85/87/44/522858744.db2.gz CDTANZMUWPHWSR-HIFRSBDPSA-N 0 3 281.421 2.609 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cnn(C)c1C)c1ccccc1[O-] ZINC000121102988 522891119 /nfs/dbraw/zinc/89/11/19/522891119.db2.gz CROZWHOLNFLETO-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(C)cc1[O-] ZINC000279970036 522922474 /nfs/dbraw/zinc/92/24/74/522922474.db2.gz CWPHGFOZBZTVNY-GZBFAFLISA-N 0 3 261.365 2.678 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000156297840 522932460 /nfs/dbraw/zinc/93/24/60/522932460.db2.gz YTCHIVNUXHGURS-UMVBOHGHSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@H]1CN(Cc2cccc(OC)c2O)CCS1 ZINC000093502296 523291897 /nfs/dbraw/zinc/29/18/97/523291897.db2.gz LEFHEHQSOZARGL-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@](C)(CCO)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000184709996 523638076 /nfs/dbraw/zinc/63/80/76/523638076.db2.gz NBUNQGPBJSIHLZ-AWEZNQCLSA-N 0 3 287.787 2.695 20 10 CFCDHN CO[C@@](C)(C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000291357449 523798082 /nfs/dbraw/zinc/79/80/82/523798082.db2.gz XVOKPWVPLDWTFB-BONVTDFDSA-N 0 3 267.344 2.997 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000156094140 523834348 /nfs/dbraw/zinc/83/43/48/523834348.db2.gz CHXVLGSODXCNKG-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000156094140 523834356 /nfs/dbraw/zinc/83/43/56/523834356.db2.gz CHXVLGSODXCNKG-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CO[C@](C)(C[NH2+][C@H]1CCc2cccc([O-])c21)C1CC1 ZINC000297467243 524028619 /nfs/dbraw/zinc/02/86/19/524028619.db2.gz YHNJJKXZWUGMPF-XJKSGUPXSA-N 0 3 261.365 2.784 20 10 CFCDHN Cc1cccc(CN[C@@H]2CCCc3c[nH]nc32)c1O ZINC000271864730 524437026 /nfs/dbraw/zinc/43/70/26/524437026.db2.gz VVYJGOMWLKMBGO-CYBMUJFWSA-N 0 3 257.337 2.591 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c1[O-] ZINC000292704227 524437588 /nfs/dbraw/zinc/43/75/88/524437588.db2.gz CPSWPFAMRVTKMI-MRXNPFEDSA-N 0 3 277.408 2.977 20 10 CFCDHN C[C@H](CO)N(C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000289428049 524541483 /nfs/dbraw/zinc/54/14/83/524541483.db2.gz KDLZCYWICQVHGN-SNVBAGLBSA-N 0 3 290.329 2.584 20 10 CFCDHN Cc1cc(CN2CCC([C@H](C)O)CC2)ccc1N(C)C ZINC000293141506 524675814 /nfs/dbraw/zinc/67/58/14/524675814.db2.gz QJPJTGXSTMUYAN-AWEZNQCLSA-N 0 3 276.424 2.654 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCCOC(C)C)c1 ZINC000271897773 524732583 /nfs/dbraw/zinc/73/25/83/524732583.db2.gz YNQVIYAJLYBFBY-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCCOC(C)C)c1 ZINC000271897773 524732592 /nfs/dbraw/zinc/73/25/92/524732592.db2.gz YNQVIYAJLYBFBY-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2cccnc2)c1 ZINC000020128046 524754694 /nfs/dbraw/zinc/75/46/94/524754694.db2.gz UUETWRXORKOBOL-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C2CCSCC2)c1 ZINC000168831376 524759592 /nfs/dbraw/zinc/75/95/92/524759592.db2.gz LHTIBGLUQDMDPJ-SNVBAGLBSA-N 0 3 267.394 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](n3cccn3)C2)c1[O-] ZINC000291170385 524865196 /nfs/dbraw/zinc/86/51/96/524865196.db2.gz DNLNIRZFDFPGNK-CQSZACIVSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c1[O-] ZINC000291170385 524865205 /nfs/dbraw/zinc/86/52/05/524865205.db2.gz DNLNIRZFDFPGNK-CQSZACIVSA-N 0 3 291.782 2.998 20 10 CFCDHN COc1ncccc1CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000290214341 525046322 /nfs/dbraw/zinc/04/63/22/525046322.db2.gz QEJOBEVMBSWENE-LLVKDONJSA-N 0 3 290.338 2.828 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)CN(C)C)c1cc(F)ccc1[O-] ZINC000094616605 525309712 /nfs/dbraw/zinc/30/97/12/525309712.db2.gz MIYATHRIBVTAGO-NSHDSACASA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1ccccc1[O-] ZINC000278684834 525317225 /nfs/dbraw/zinc/31/72/25/525317225.db2.gz GNPPHNIVPXFADA-ZDUSSCGKSA-N 0 3 275.392 2.986 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)CN(C)C(C)C)cc1C ZINC000289746780 525322937 /nfs/dbraw/zinc/32/29/37/525322937.db2.gz HXIDCBXGFLKGJT-CQSZACIVSA-N 0 3 264.413 2.827 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@]2(O)CCC[C@H]2C)cc1C ZINC000292903012 525323822 /nfs/dbraw/zinc/32/38/22/525323822.db2.gz DWYLGBKPDFLUNY-CJNGLKHVSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000245775513 525346555 /nfs/dbraw/zinc/34/65/55/525346555.db2.gz SOVOQRYYXJVOPY-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000245775513 525346563 /nfs/dbraw/zinc/34/65/63/525346563.db2.gz SOVOQRYYXJVOPY-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H]2CCCCN2C2CC2)c1 ZINC000277428555 525348406 /nfs/dbraw/zinc/34/84/06/525348406.db2.gz BVLPXXYJPNDYFD-MRXNPFEDSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@](C)(O)c2ccc(F)cc2)c1 ZINC000270246941 525349803 /nfs/dbraw/zinc/34/98/03/525349803.db2.gz FCXGSLDSOYYVSS-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@@H]2C2CC2)c1 ZINC000230669814 525365016 /nfs/dbraw/zinc/36/50/16/525365016.db2.gz RARCGTAWHDJNFE-HZUKXOBISA-N 0 3 261.365 2.919 20 10 CFCDHN C[C@@H]([NH2+]CC1=CCCOC1)c1cc(F)ccc1[O-] ZINC000287210026 525424002 /nfs/dbraw/zinc/42/40/02/525424002.db2.gz WWODEAJAINBEHM-SNVBAGLBSA-N 0 3 251.301 2.529 20 10 CFCDHN C[C@@H](NCC1=CCCOC1)c1ccc(N(C)C)cc1 ZINC000274745767 525424681 /nfs/dbraw/zinc/42/46/81/525424681.db2.gz DHYOFFSSUWCJRM-CYBMUJFWSA-N 0 3 260.381 2.750 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccccc1[O-] ZINC000278394988 525437184 /nfs/dbraw/zinc/43/71/84/525437184.db2.gz DCQQVDQAOSNUIB-HUUCEWRRSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@@H]([NH2+]CCOCC1CC1)c1cc(F)ccc1[O-] ZINC000230661339 525453185 /nfs/dbraw/zinc/45/31/85/525453185.db2.gz MFYIBCZXEFJPFV-SNVBAGLBSA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCCO1)c1cc(F)ccc1[O-] ZINC000094617934 525500844 /nfs/dbraw/zinc/50/08/44/525500844.db2.gz DKNLKIIHQDKCBT-ZYHUDNBSSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2ccccc2[O-])c(C)o1 ZINC000266157180 525501332 /nfs/dbraw/zinc/50/13/32/525501332.db2.gz MMUYHHNIENTBEX-INIZCTEOSA-N 0 3 275.348 2.599 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000062747651 525503795 /nfs/dbraw/zinc/50/37/95/525503795.db2.gz NJONNSWYGJGYBT-VXGBXAGGSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649182 525504179 /nfs/dbraw/zinc/50/41/79/525504179.db2.gz HLZGDGBDCXBCRA-CHWSQXEVSA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000245821136 525590637 /nfs/dbraw/zinc/59/06/37/525590637.db2.gz ADPJSIWWFTVTLL-UXEPBGEESA-N 0 3 269.344 2.701 20 10 CFCDHN C[C@H]([NH2+][C@H]1COc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000290207538 525634583 /nfs/dbraw/zinc/63/45/83/525634583.db2.gz HCJYMYQTDKMCAQ-YLVFBTJISA-N 0 3 285.343 2.537 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000280583996 525936122 /nfs/dbraw/zinc/93/61/22/525936122.db2.gz WVUZQEUYHBQUDZ-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000280583996 525936132 /nfs/dbraw/zinc/93/61/32/525936132.db2.gz WVUZQEUYHBQUDZ-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@](C)(OC)CC2)c1[O-] ZINC000280279696 525939785 /nfs/dbraw/zinc/93/97/85/525939785.db2.gz NFZVFHPHXIIABZ-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@](C)(OC)CC2)c1[O-] ZINC000280279696 525939795 /nfs/dbraw/zinc/93/97/95/525939795.db2.gz NFZVFHPHXIIABZ-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H]2C2CC2)c([O-])c1 ZINC000230669888 525945150 /nfs/dbraw/zinc/94/51/50/525945150.db2.gz ZCLZJXOJGRWCIO-HZUKXOBISA-N 0 3 261.365 2.919 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2C[C@](C)(OC)C2(C)C)c1[O-] ZINC000174132995 526039584 /nfs/dbraw/zinc/03/95/84/526039584.db2.gz FEDJDHOXQNJDJK-BBRMVZONSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1cc(Br)cc(C[NH2+]C2CC2)c1[O-] ZINC000157756132 526156593 /nfs/dbraw/zinc/15/65/93/526156593.db2.gz XKFNEAMWNZRVOD-UHFFFAOYSA-N 0 3 256.143 2.715 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]1C1CCC1)OCO2 ZINC000102886014 526333857 /nfs/dbraw/zinc/33/38/57/526333857.db2.gz QAJVIQQNRLAXFP-ZDUSSCGKSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCC1)OCO2 ZINC000102886014 526333863 /nfs/dbraw/zinc/33/38/63/526333863.db2.gz QAJVIQQNRLAXFP-ZDUSSCGKSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H]1[C@H]3Cc4ccccc4[C@@H]13)OCO2 ZINC000290542406 526336117 /nfs/dbraw/zinc/33/61/17/526336117.db2.gz RJLARLYAGRDHDN-MORSLUCNSA-N 0 3 295.338 2.549 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CSCCS1)CC2 ZINC000297151029 526368779 /nfs/dbraw/zinc/36/87/79/526368779.db2.gz AVLCQZCKUWZGBY-VXGBXAGGSA-N 0 3 281.446 2.818 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1[C@H]2Cc3ccccc3[C@@H]12 ZINC000290416290 526374293 /nfs/dbraw/zinc/37/42/93/526374293.db2.gz KJKHTLRSULGKFE-USXIJHARSA-N 0 3 251.329 2.820 20 10 CFCDHN Cc1nnsc1CN[C@@H](C)c1cc(C)ccc1O ZINC000293285383 526449162 /nfs/dbraw/zinc/44/91/62/526449162.db2.gz DAUKAQOYIAEIJB-VIFPVBQESA-N 0 3 263.366 2.711 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCCCO)C[C@H]1CCCO1 ZINC000173355008 527534869 /nfs/dbraw/zinc/53/48/69/527534869.db2.gz SULSESUPRFDGOV-MRXNPFEDSA-N 0 3 293.407 2.536 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCCCO)C[C@H]1CCCO1 ZINC000173355008 527534872 /nfs/dbraw/zinc/53/48/72/527534872.db2.gz SULSESUPRFDGOV-MRXNPFEDSA-N 0 3 293.407 2.536 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCO)Cc1ccccc1 ZINC000271347442 527540219 /nfs/dbraw/zinc/54/02/19/527540219.db2.gz KQSLSWRKXHBVMX-UHFFFAOYSA-N 0 3 271.360 2.777 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCO)Cc1ccccc1 ZINC000271347442 527540224 /nfs/dbraw/zinc/54/02/24/527540224.db2.gz KQSLSWRKXHBVMX-UHFFFAOYSA-N 0 3 271.360 2.777 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2(C)OCCCO2)c2c1c(F)ccc2[O-] ZINC000754123925 574075541 /nfs/dbraw/zinc/07/55/41/574075541.db2.gz RHXLAPSBQOJPNF-PWSUYJOCSA-N 0 3 295.354 2.822 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCN(C)C2)c2c1c(F)ccc2[O-] ZINC000756445246 574117117 /nfs/dbraw/zinc/11/71/17/574117117.db2.gz MKOMOYVEOOTECS-NQBHXWOUSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCCC[C@@H]2C2OCCO2)c1 ZINC000754731864 574117376 /nfs/dbraw/zinc/11/73/76/574117376.db2.gz KLKQGNGJFKONRC-OAHLLOKOSA-N 0 3 291.391 2.736 20 10 CFCDHN C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc([O-])cs2)C1 ZINC000731870608 574131284 /nfs/dbraw/zinc/13/12/84/574131284.db2.gz RTFXZJWXGGLFIE-LLVKDONJSA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([O-])cs2)C1 ZINC000731870608 574131285 /nfs/dbraw/zinc/13/12/85/574131285.db2.gz RTFXZJWXGGLFIE-LLVKDONJSA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)C2=CC(=O)CS2)C1 ZINC000731870608 574131286 /nfs/dbraw/zinc/13/12/86/574131286.db2.gz RTFXZJWXGGLFIE-LLVKDONJSA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@@H]1CCC[N@H+](CCCCNC(=O)c2cc([O-])cs2)C1 ZINC000731869161 574132606 /nfs/dbraw/zinc/13/26/06/574132606.db2.gz AIFADHOLWQQHBH-GFCCVEGCSA-N 0 3 296.436 2.696 20 10 CFCDHN C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([O-])cs2)C1 ZINC000731869161 574132607 /nfs/dbraw/zinc/13/26/07/574132607.db2.gz AIFADHOLWQQHBH-GFCCVEGCSA-N 0 3 296.436 2.696 20 10 CFCDHN C[C@H]1CCC[N@H+](CCCCNC(=O)c2cc([O-])cs2)C1 ZINC000731869162 574132981 /nfs/dbraw/zinc/13/29/81/574132981.db2.gz AIFADHOLWQQHBH-LBPRGKRZSA-N 0 3 296.436 2.696 20 10 CFCDHN C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([O-])cs2)C1 ZINC000731869162 574132984 /nfs/dbraw/zinc/13/29/84/574132984.db2.gz AIFADHOLWQQHBH-LBPRGKRZSA-N 0 3 296.436 2.696 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccncc21)[C@@H]1CCN(C2CC2)C1 ZINC000732188782 574145995 /nfs/dbraw/zinc/14/59/95/574145995.db2.gz MUWOUKJRRGSWGV-OAHLLOKOSA-N 0 3 297.402 2.609 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccncc21)[C@@H]1CCN(C2CC2)C1 ZINC000732188782 574146000 /nfs/dbraw/zinc/14/60/00/574146000.db2.gz MUWOUKJRRGSWGV-OAHLLOKOSA-N 0 3 297.402 2.609 20 10 CFCDHN C[NH+](C)Cc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732271711 574148792 /nfs/dbraw/zinc/14/87/92/574148792.db2.gz PJGRFNKQDAHAGD-UHFFFAOYSA-N 0 3 276.361 2.768 20 10 CFCDHN CC[N@@H+](Cc1cc(C)c(C)cc1[O-])C[C@@H]1CCOC1 ZINC000738076743 574156988 /nfs/dbraw/zinc/15/69/88/574156988.db2.gz OKDQURMWHCMNJT-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN CC[N@H+](Cc1cc(C)c(C)cc1[O-])C[C@@H]1CCOC1 ZINC000738076743 574156989 /nfs/dbraw/zinc/15/69/89/574156989.db2.gz OKDQURMWHCMNJT-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H](n3ccnc3)C1)CCC2 ZINC000738158994 574159124 /nfs/dbraw/zinc/15/91/24/574159124.db2.gz PRRIYOAMVCQEPY-QGZVFWFLSA-N 0 3 297.402 2.915 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H](n3ccnc3)C1)CCC2 ZINC000738158994 574159126 /nfs/dbraw/zinc/15/91/26/574159126.db2.gz PRRIYOAMVCQEPY-QGZVFWFLSA-N 0 3 297.402 2.915 20 10 CFCDHN Cc1ccccc1[C@@H](CO)NCc1ccc(N(C)C)cc1 ZINC000747100543 574179871 /nfs/dbraw/zinc/17/98/71/574179871.db2.gz KJOGAMXZUDGZEW-GOSISDBHSA-N 0 3 284.403 2.884 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)CC2CCOCC2)c([O-])c1 ZINC000747100922 574179955 /nfs/dbraw/zinc/17/99/55/574179955.db2.gz YFQOMTQLNHHZKV-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN COCCC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756342817 574227171 /nfs/dbraw/zinc/22/71/71/574227171.db2.gz LFYGXSRACOJJSQ-KOLCDFICSA-N 0 3 253.317 2.706 20 10 CFCDHN C[C@H](Cc1cccc(O)c1)[NH2+]Cc1ccccc1[O-] ZINC000729681198 574227942 /nfs/dbraw/zinc/22/79/42/574227942.db2.gz XEBDMOQTCPVMME-GFCCVEGCSA-N 0 3 257.333 2.819 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000748088409 574228696 /nfs/dbraw/zinc/22/86/96/574228696.db2.gz KERFPJKLTVBBOZ-CYBMUJFWSA-N 0 3 275.392 2.739 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000748088409 574228698 /nfs/dbraw/zinc/22/86/98/574228698.db2.gz KERFPJKLTVBBOZ-CYBMUJFWSA-N 0 3 275.392 2.739 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)c2ccco2)c1 ZINC000756382923 574231835 /nfs/dbraw/zinc/23/18/35/574231835.db2.gz HGCPZRAHHQIDHO-FZMZJTMJSA-N 0 3 261.321 2.678 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430440 574236577 /nfs/dbraw/zinc/23/65/77/574236577.db2.gz ICHUINDMLOJWCN-COLVAYQJSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430440 574236578 /nfs/dbraw/zinc/23/65/78/574236578.db2.gz ICHUINDMLOJWCN-COLVAYQJSA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c([O-])c1C ZINC000756433008 574236641 /nfs/dbraw/zinc/23/66/41/574236641.db2.gz MGDMNHPEGZSISU-CJNGLKHVSA-N 0 3 276.424 3.000 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCOC2)c2c1c(F)ccc2[O-] ZINC000756455648 574238979 /nfs/dbraw/zinc/23/89/79/574238979.db2.gz ASPGGOSLODWZBE-SCVCMEIPSA-N 0 3 265.328 2.706 20 10 CFCDHN CC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000748242784 574242568 /nfs/dbraw/zinc/24/25/68/574242568.db2.gz QLEJSDACYTXDKA-MRXNPFEDSA-N 0 3 279.380 2.830 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-])C(C)C ZINC000756525530 574243734 /nfs/dbraw/zinc/24/37/34/574243734.db2.gz PTWREZHORUEXDD-ZDUSSCGKSA-N 0 3 280.412 2.782 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCN(C3CC3)C2)c2c1c(F)ccc2[O-] ZINC000756532807 574244198 /nfs/dbraw/zinc/24/41/98/574244198.db2.gz GJMNDPWVOWNPIS-UHIISALHSA-N 0 3 290.382 2.906 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000756576621 574250084 /nfs/dbraw/zinc/25/00/84/574250084.db2.gz VFLMTYAUSGJZHW-FOUMNBMASA-N 0 3 279.355 2.973 20 10 CFCDHN CC(C)[C@@H](O)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756584817 574250714 /nfs/dbraw/zinc/25/07/14/574250714.db2.gz GWBBUNAUQYBHPC-CDMKHQONSA-N 0 3 267.344 2.686 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000756628614 574253590 /nfs/dbraw/zinc/25/35/90/574253590.db2.gz WKMPCCWPMSGFNH-JHJVBQTASA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000756647675 574255045 /nfs/dbraw/zinc/25/50/45/574255045.db2.gz QZPZVGLNHTZWCK-DVOMOZLQSA-N 0 3 274.408 2.834 20 10 CFCDHN C[C@H](CCCO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756647968 574255250 /nfs/dbraw/zinc/25/52/50/574255250.db2.gz URGQMKOIEPTCST-CKYFFXLPSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000756647681 574255363 /nfs/dbraw/zinc/25/53/63/574255363.db2.gz QZPZVGLNHTZWCK-WWGRRREGSA-N 0 3 274.408 2.834 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)Cc1ccco1)c1cc(F)ccc1[O-] ZINC000756661185 574256528 /nfs/dbraw/zinc/25/65/28/574256528.db2.gz PLJLVGNVHZBDBY-NWDGAFQWSA-N 0 3 293.338 2.626 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756659232 574256547 /nfs/dbraw/zinc/25/65/47/574256547.db2.gz PVPBKRZCJKXVQP-NHCYSSNCSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@H](CC[S@](C)=O)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756743232 574260536 /nfs/dbraw/zinc/26/05/36/574260536.db2.gz QVGPLXXHCHIZME-OVLUVOGVSA-N 0 3 299.411 2.826 20 10 CFCDHN COC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2[O-])CCOCC1 ZINC000756759275 574261266 /nfs/dbraw/zinc/26/12/66/574261266.db2.gz JFBORYDHPXVEIR-CQSZACIVSA-N 0 3 293.407 2.855 20 10 CFCDHN Cc1c(C[NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)cnn1C ZINC000756774506 574261648 /nfs/dbraw/zinc/26/16/48/574261648.db2.gz DKAJWTPEYBTHGO-NOZJJQNGSA-N 0 3 289.354 2.911 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2cnccn2)c2c1c(F)ccc2[O-] ZINC000756785980 574262724 /nfs/dbraw/zinc/26/27/24/574262724.db2.gz HKEQNTDVIOWRQO-ZWNOBZJWSA-N 0 3 287.338 2.702 20 10 CFCDHN CO[C@@H](CN[C@@H](C)c1cc(C)ccc1O)C(F)(F)F ZINC000756834600 574265935 /nfs/dbraw/zinc/26/59/35/574265935.db2.gz HNYYMCWAFIADTL-CABZTGNLSA-N 0 3 277.286 2.929 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NC[C@@H](OC)C(F)(F)F)c1 ZINC000756835991 574266881 /nfs/dbraw/zinc/26/68/81/574266881.db2.gz RMWSBZFLYYJNFJ-PRHODGIISA-N 0 3 293.285 2.629 20 10 CFCDHN COc1ccc(O)c(CNCc2n[nH]c3ccccc23)c1 ZINC000734003705 574268918 /nfs/dbraw/zinc/26/89/18/574268918.db2.gz WAMJWLZLCXPPML-UHFFFAOYSA-N 0 3 283.331 2.567 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@](C)(O)CCC(C)C ZINC000740899825 574273458 /nfs/dbraw/zinc/27/34/58/574273458.db2.gz FJFCJJSAPGBBOE-INIZCTEOSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCN(C)[C@@H](C)C2)cc1C ZINC000742375353 574325495 /nfs/dbraw/zinc/32/54/95/574325495.db2.gz PZMMLPFMTFWWOT-ZFWWWQNUSA-N 0 3 262.397 2.581 20 10 CFCDHN Oc1ccccc1CN1CCC[C@@H](OCC(F)(F)F)C1 ZINC000725847304 574328237 /nfs/dbraw/zinc/32/82/37/574328237.db2.gz ZJCQIWPZOAMTPY-GFCCVEGCSA-N 0 3 289.297 2.936 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CC)C[C@@H](C)CO)c([O-])c1 ZINC000743499652 574366972 /nfs/dbraw/zinc/36/69/72/574366972.db2.gz MNKOYAPSDDOTAR-OCCSQVGLSA-N 0 3 281.396 2.678 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@@H](C)C(C)C)c([O-])c1OC ZINC000891605024 617683877 /nfs/dbraw/zinc/68/38/77/617683877.db2.gz WPHCHXCQOVLGJA-NSHDSACASA-N 0 3 267.369 2.886 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@@H](C)C(C)C)c([O-])c1OC ZINC000891605024 617683878 /nfs/dbraw/zinc/68/38/78/617683878.db2.gz WPHCHXCQOVLGJA-NSHDSACASA-N 0 3 267.369 2.886 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](CO)c1cccnc1)c1ccccc1[O-] ZINC000806179020 617843093 /nfs/dbraw/zinc/84/30/93/617843093.db2.gz NFXLSQBLMXKCFF-ZBFHGGJFSA-N 0 3 286.375 2.604 20 10 CFCDHN CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000188037157 618291714 /nfs/dbraw/zinc/29/17/14/618291714.db2.gz YLSSXLACWYVIQQ-MRXNPFEDSA-N 0 3 281.371 2.904 20 10 CFCDHN CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000188037157 618291717 /nfs/dbraw/zinc/29/17/17/618291717.db2.gz YLSSXLACWYVIQQ-MRXNPFEDSA-N 0 3 281.371 2.904 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCCN2C)c1ccnnc1 ZINC000924871451 618347998 /nfs/dbraw/zinc/34/79/98/618347998.db2.gz NINPSUCKPPGQRT-CYBMUJFWSA-N 0 3 282.391 2.710 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000840879711 618359859 /nfs/dbraw/zinc/35/98/59/618359859.db2.gz HFASSFMIMYTRDU-OCCSQVGLSA-N 0 3 289.350 2.958 20 10 CFCDHN CCC[C@@H](CCO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000877667789 618454593 /nfs/dbraw/zinc/45/45/93/618454593.db2.gz QSNDBFUCNFRYLS-ZDUSSCGKSA-N 0 3 271.788 2.995 20 10 CFCDHN COC(=O)c1cc(CNCc2cc(C)ccc2O)cs1 ZINC000895392949 618565284 /nfs/dbraw/zinc/56/52/84/618565284.db2.gz WXISAQMCOGXVEV-UHFFFAOYSA-N 0 3 291.372 2.839 20 10 CFCDHN COc1cc(C)cc(C[N@@H+]2Cc3cccc([O-])c3C2)c1O ZINC000895449388 618592920 /nfs/dbraw/zinc/59/29/20/618592920.db2.gz HSEAADCCNUKUSX-UHFFFAOYSA-N 0 3 285.343 2.931 20 10 CFCDHN COc1cc(C)cc(C[N@H+]2Cc3cccc([O-])c3C2)c1O ZINC000895449388 618592925 /nfs/dbraw/zinc/59/29/25/618592925.db2.gz HSEAADCCNUKUSX-UHFFFAOYSA-N 0 3 285.343 2.931 20 10 CFCDHN Cc1ccc(CNCc2cc(F)ccc2O)nc1C ZINC000314245535 618781292 /nfs/dbraw/zinc/78/12/92/618781292.db2.gz XTNXQFIKTDPVBT-UHFFFAOYSA-N 0 3 260.312 2.833 20 10 CFCDHN CO[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C ZINC000784669067 618789893 /nfs/dbraw/zinc/78/98/93/618789893.db2.gz YEMQUAZXNXIODJ-WBMJQRKESA-N 0 3 280.387 2.749 20 10 CFCDHN CC(C)CC[C@@](C)(O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000180773550 618867882 /nfs/dbraw/zinc/86/78/82/618867882.db2.gz HNUANQIYQGYHIT-OAHLLOKOSA-N 0 3 269.360 2.808 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH+]3CCC2CC3)c(Cl)c1 ZINC000840948911 619117645 /nfs/dbraw/zinc/11/76/45/619117645.db2.gz MLWFMTCFGKPWNW-UHFFFAOYSA-N 0 3 280.799 2.634 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)C(C)C)c1ccccc1[O-] ZINC000054110804 619136371 /nfs/dbraw/zinc/13/63/71/619136371.db2.gz NLKBOYVDSLNHIA-AWEZNQCLSA-N 0 3 250.386 2.773 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000840958565 619149744 /nfs/dbraw/zinc/14/97/44/619149744.db2.gz QMUIQPOILWRDMA-HOTGVXAUSA-N 0 3 287.334 2.839 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000840958565 619149747 /nfs/dbraw/zinc/14/97/47/619149747.db2.gz QMUIQPOILWRDMA-HOTGVXAUSA-N 0 3 287.334 2.839 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H](CF)C2)cc1F ZINC000895573582 619557450 /nfs/dbraw/zinc/55/74/50/619557450.db2.gz PIXOJUBNBADHOF-GFCCVEGCSA-N 0 3 254.324 2.683 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H]2CC(C)(C)CO2)c([O-])c1 ZINC000895802013 619611067 /nfs/dbraw/zinc/61/10/67/619611067.db2.gz DHKBDHHREZUHFM-CQSZACIVSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)C2)O1 ZINC000895820524 619614549 /nfs/dbraw/zinc/61/45/49/619614549.db2.gz OIYWZYRFGGPUDX-KEYYUXOJSA-N 0 3 291.391 2.517 20 10 CFCDHN C[C@H]([NH2+]Cc1cn(C)nc1C1CC1)c1ccccc1[O-] ZINC000895852638 619623429 /nfs/dbraw/zinc/62/34/29/619623429.db2.gz YKOLWZSEQOQGEX-NSHDSACASA-N 0 3 271.364 2.854 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](CO)CCc1ccccc1 ZINC000896525589 619756310 /nfs/dbraw/zinc/75/63/10/619756310.db2.gz LVXODTYXALJZNK-MRXNPFEDSA-N 0 3 285.387 2.784 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1nc2c(s1)CCC2 ZINC000896840124 619838004 /nfs/dbraw/zinc/83/80/04/619838004.db2.gz AMBLOWYVHODPBI-UHFFFAOYSA-N 0 3 292.379 2.809 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000896864482 619850118 /nfs/dbraw/zinc/85/01/18/619850118.db2.gz JVRBAPLIIGBISG-OIBJUYFYSA-N 0 3 263.234 2.819 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H](N(C)C)C(F)(F)F)c([O-])c1 ZINC000896879631 619855564 /nfs/dbraw/zinc/85/55/64/619855564.db2.gz XRVKQHSQVXYRLV-CYBMUJFWSA-N 0 3 290.329 2.673 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897034860 619916867 /nfs/dbraw/zinc/91/68/67/619916867.db2.gz NWACBIOIPIDDLE-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1COc3ccccc3O1)CC2 ZINC000321015478 620080980 /nfs/dbraw/zinc/08/09/80/620080980.db2.gz SPXQKKGZSLCJHC-ZIAGYGMSSA-N 0 3 297.354 2.809 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000897538702 620224440 /nfs/dbraw/zinc/22/44/40/620224440.db2.gz ASBYUZNXNIFTKE-BBRMVZONSA-N 0 3 293.407 2.822 20 10 CFCDHN Cc1noc(C[C@@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n1 ZINC000897579453 620250780 /nfs/dbraw/zinc/25/07/80/620250780.db2.gz WSWRWQPOTNPMRC-ZDUSSCGKSA-N 0 3 287.363 2.538 20 10 CFCDHN Cc1noc(C[C@@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n1 ZINC000897579453 620250782 /nfs/dbraw/zinc/25/07/82/620250782.db2.gz WSWRWQPOTNPMRC-ZDUSSCGKSA-N 0 3 287.363 2.538 20 10 CFCDHN CN1C[C@@H]2C[N@H+](Cc3ccc4ccccc4c3[O-])C[C@]2(C)C1 ZINC000897620549 620262678 /nfs/dbraw/zinc/26/26/78/620262678.db2.gz TUKQULXDIXWIDC-APWZRJJASA-N 0 3 296.414 2.929 20 10 CFCDHN CN1C[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3[O-])C[C@]2(C)C1 ZINC000897620549 620262682 /nfs/dbraw/zinc/26/26/82/620262682.db2.gz TUKQULXDIXWIDC-APWZRJJASA-N 0 3 296.414 2.929 20 10 CFCDHN COc1ccc(CN[C@H](C)c2cncs2)c(O)c1OC ZINC000897929073 620305218 /nfs/dbraw/zinc/30/52/18/620305218.db2.gz MDDUZIOKSPFFFY-SECBINFHSA-N 0 3 294.376 2.717 20 10 CFCDHN COc1cc(C)cc(CN2CC(Cc3ccoc3)C2)c1O ZINC000898160039 620340501 /nfs/dbraw/zinc/34/05/01/620340501.db2.gz NTKSOHSGVLUWNE-UHFFFAOYSA-N 0 3 287.359 2.977 20 10 CFCDHN CC[C@H]([NH2+][C@H]1COC[C@@H]1C1CC1)c1ccccc1[O-] ZINC000898380753 620379063 /nfs/dbraw/zinc/37/90/63/620379063.db2.gz UUQFMIRHGWAUDK-ILXRZTDVSA-N 0 3 261.365 2.858 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CCN1 ZINC000841062326 620424681 /nfs/dbraw/zinc/42/46/81/620424681.db2.gz VJJYREBVHWKIAG-LDYMZIIASA-N 0 3 289.206 2.929 20 10 CFCDHN C[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[O-])CC[NH2+]1 ZINC000841062326 620424683 /nfs/dbraw/zinc/42/46/83/620424683.db2.gz VJJYREBVHWKIAG-LDYMZIIASA-N 0 3 289.206 2.929 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCO[C@@H]2COCC[C@@H]21 ZINC000902626392 621138428 /nfs/dbraw/zinc/13/84/28/621138428.db2.gz XWKMTVADGKWQPG-FUHWJXTLSA-N 0 3 299.370 2.535 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCO[C@@H]2COCC[C@@H]21 ZINC000902626392 621138431 /nfs/dbraw/zinc/13/84/31/621138431.db2.gz XWKMTVADGKWQPG-FUHWJXTLSA-N 0 3 299.370 2.535 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)CN1CCOCC1)c1ccccc1[O-] ZINC000903342497 621335235 /nfs/dbraw/zinc/33/52/35/621335235.db2.gz FRMQZNUFGNHSOA-GOEBONIOSA-N 0 3 292.423 2.544 20 10 CFCDHN CC1(C)CCN(CC[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000903343141 621336504 /nfs/dbraw/zinc/33/65/04/621336504.db2.gz DGKUIHVKXXVPCN-AWEZNQCLSA-N 0 3 274.408 2.701 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc(CCO)cc1)CC2 ZINC000903402968 621369339 /nfs/dbraw/zinc/36/93/39/621369339.db2.gz JOEBBWAGBGPGLP-MRXNPFEDSA-N 0 3 283.371 2.704 20 10 CFCDHN C[C@@H]([NH2+]CCCC(C)(C)CO)c1ccccc1[O-] ZINC000183528143 625514688 /nfs/dbraw/zinc/51/46/88/625514688.db2.gz YQUUOHVUOUOGCM-GFCCVEGCSA-N 0 3 251.370 2.842 20 10 CFCDHN C[C@H]([NH2+]C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1[O-] ZINC000183546749 625516616 /nfs/dbraw/zinc/51/66/16/625516616.db2.gz UGUSOGPNYVJKKG-NSHDSACASA-N 0 3 292.379 2.662 20 10 CFCDHN C[C@@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1cc([O-])cs1 ZINC000912651772 622754627 /nfs/dbraw/zinc/75/46/27/622754627.db2.gz ZDTFCDSGNMCWJO-VXGBXAGGSA-N 0 3 296.436 2.789 20 10 CFCDHN CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877030024 623017450 /nfs/dbraw/zinc/01/74/50/623017450.db2.gz WHBRFMMNFLCUSK-IUODEOHRSA-N 0 3 251.370 2.587 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877030026 623018307 /nfs/dbraw/zinc/01/83/07/623018307.db2.gz WHBRFMMNFLCUSK-WFASDCNBSA-N 0 3 251.370 2.587 20 10 CFCDHN CCOC[C@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228673432 623155867 /nfs/dbraw/zinc/15/58/67/623155867.db2.gz ISKPMSPGKBZXJM-VIFPVBQESA-N 0 3 273.760 2.569 20 10 CFCDHN Cc1cccc2c1CCN(Cc1cc3c(cc1O)OCO3)C2 ZINC000170904067 623190081 /nfs/dbraw/zinc/19/00/81/623190081.db2.gz SKKRMAXXFGMMDT-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN COc1ccc(CNCc2ccccc2O)c(F)c1 ZINC000229741945 623221878 /nfs/dbraw/zinc/22/18/78/623221878.db2.gz XPUQLRNCVNKQBF-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)CC(C)C)c([O-])c1 ZINC000230660062 623291996 /nfs/dbraw/zinc/29/19/96/623291996.db2.gz YQVRPUDKNGQIJC-OLZOCXBDSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H](OC)C2(C)C)c1[O-] ZINC000230935095 623310026 /nfs/dbraw/zinc/31/00/26/623310026.db2.gz RQIPPNRSHKCMCK-CHWSQXEVSA-N 0 3 299.798 2.957 20 10 CFCDHN COc1ccccc1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000083445925 623405453 /nfs/dbraw/zinc/40/54/53/623405453.db2.gz SEGGMMKTKSPLCA-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]([NH+](C)C)C2)cc1Cl ZINC000824688420 623545612 /nfs/dbraw/zinc/54/56/12/623545612.db2.gz GQJCMXSBFCTMHC-CYBMUJFWSA-N 0 3 282.815 2.880 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824714419 623550358 /nfs/dbraw/zinc/55/03/58/623550358.db2.gz DUNMJVKXWUJNKG-IIAWOOMASA-N 0 3 261.365 2.518 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000824714419 623550361 /nfs/dbraw/zinc/55/03/61/623550361.db2.gz DUNMJVKXWUJNKG-IIAWOOMASA-N 0 3 261.365 2.518 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2scnc2C)c([O-])c1 ZINC000824733439 623553726 /nfs/dbraw/zinc/55/37/26/623553726.db2.gz SMZVQJJWKCUBEF-UHFFFAOYSA-N 0 3 292.404 2.888 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000824751424 623557347 /nfs/dbraw/zinc/55/73/47/623557347.db2.gz WEFCIUQSJFQYIW-ZDUSSCGKSA-N 0 3 261.365 2.831 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCc1ncccc1C ZINC000824783143 623565092 /nfs/dbraw/zinc/56/50/92/623565092.db2.gz DVBLMONEFBQUMS-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCCn2ccnc2)cc1Cl ZINC000825044125 623614991 /nfs/dbraw/zinc/61/49/91/623614991.db2.gz QOCFTWPYYFFQMK-UHFFFAOYSA-N 0 3 279.771 2.730 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H](O)C2CCC2)c1[O-] ZINC000825240404 623656643 /nfs/dbraw/zinc/65/66/43/623656643.db2.gz KYSDDCZKWJFIDE-CYBMUJFWSA-N 0 3 269.772 2.605 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)CSCCF)c([O-])c1 ZINC000825753644 623751045 /nfs/dbraw/zinc/75/10/45/623751045.db2.gz SUEQZECDHYDXEA-SNVBAGLBSA-N 0 3 273.373 2.582 20 10 CFCDHN COCC1([NH2+]Cc2cc(F)ccc2[O-])CCCC1 ZINC000826834230 623886450 /nfs/dbraw/zinc/88/64/50/623886450.db2.gz NWEVLQUIDDVCOC-UHFFFAOYSA-N 0 3 253.317 2.580 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@@H](O)C2)c1[O-] ZINC000834905048 623903467 /nfs/dbraw/zinc/90/34/67/623903467.db2.gz FBUCWTNCUOHEHH-INTQDDNPSA-N 0 3 255.745 2.528 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@](O)(C3CC3)C2)c([O-])c1 ZINC000827151549 623955105 /nfs/dbraw/zinc/95/51/05/623955105.db2.gz FJBNEERJGGJHKY-QGZVFWFLSA-N 0 3 291.391 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@](O)(C3CC3)C2)c([O-])c1 ZINC000827151549 623955107 /nfs/dbraw/zinc/95/51/07/623955107.db2.gz FJBNEERJGGJHKY-QGZVFWFLSA-N 0 3 291.391 2.528 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2C[C@H](O)C23CCC3)c1[O-] ZINC000827365067 623994114 /nfs/dbraw/zinc/99/41/14/623994114.db2.gz JIZMUEJABXHQEF-STQMWFEESA-N 0 3 281.783 2.747 20 10 CFCDHN [O-]c1ccccc1C[N@H+](C[C@H]1COCCO1)C1CCCC1 ZINC000827813360 624099260 /nfs/dbraw/zinc/09/92/60/624099260.db2.gz PUGKPGRYLFREFA-INIZCTEOSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](C[C@H]1COCCO1)C1CCCC1 ZINC000827813360 624099263 /nfs/dbraw/zinc/09/92/63/624099263.db2.gz PUGKPGRYLFREFA-INIZCTEOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCOc1ncccc1CN[C@@H]1CCc2cccc(O)c21 ZINC000834508514 625699684 /nfs/dbraw/zinc/69/96/84/625699684.db2.gz MZYAAGDFKOZZHU-CQSZACIVSA-N 0 3 284.359 2.963 20 10 CFCDHN CCOC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000179938033 624985995 /nfs/dbraw/zinc/98/59/95/624985995.db2.gz XCLKXIMNBQERMN-UHFFFAOYSA-N 0 3 253.317 2.532 20 10 CFCDHN COCC[N@H+](C)Cc1c([O-])ccc2ccc(OC)cc21 ZINC000068960666 625041222 /nfs/dbraw/zinc/04/12/22/625041222.db2.gz QGJGUUOMNFJAGB-UHFFFAOYSA-N 0 3 275.348 2.632 20 10 CFCDHN COCC[N@@H+](C)Cc1c([O-])ccc2ccc(OC)cc21 ZINC000068960666 625041227 /nfs/dbraw/zinc/04/12/27/625041227.db2.gz QGJGUUOMNFJAGB-UHFFFAOYSA-N 0 3 275.348 2.632 20 10 CFCDHN N#Cc1ccc(OCC[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000180807082 625041720 /nfs/dbraw/zinc/04/17/20/625041720.db2.gz LCWFVVXZJJQUIQ-UHFFFAOYSA-N 0 3 286.306 2.572 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1cc(F)ccc1[O-] ZINC000185369524 625720795 /nfs/dbraw/zinc/72/07/95/625720795.db2.gz MMVAVKNNJIJYOH-GHMZBOCLSA-N 0 3 266.360 2.665 20 10 CFCDHN Cc1ccc(CC[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000834578274 625723395 /nfs/dbraw/zinc/72/33/95/625723395.db2.gz JMNAFWAGJOJXJT-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)C(C)C)c([O-])c1 ZINC000185434392 625725415 /nfs/dbraw/zinc/72/54/15/625725415.db2.gz TZPFRQIYVDUGLH-IUODEOHRSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1ccccc1[C@H](CO)N[C@@H]1CCc2cccc(O)c21 ZINC000834654531 625758632 /nfs/dbraw/zinc/75/86/32/625758632.db2.gz OTXRXTXTHCHQIG-CABCVRRESA-N 0 3 299.370 2.711 20 10 CFCDHN OC[C@@H](N[C@@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000834770854 625846571 /nfs/dbraw/zinc/84/65/71/625846571.db2.gz ZLBREGJTJFUMQF-CHWSQXEVSA-N 0 3 275.373 2.764 20 10 CFCDHN CO[C@H](CC[NH2+][C@@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834779571 625854470 /nfs/dbraw/zinc/85/44/70/625854470.db2.gz NKGDKBOKZKXGFS-ZYHUDNBSSA-N 0 3 289.297 2.937 20 10 CFCDHN Oc1cccc2c1[C@H](NCc1cccnc1F)CC2 ZINC000834790318 625860043 /nfs/dbraw/zinc/86/00/43/625860043.db2.gz NTAQGXKGVYPTIY-GFCCVEGCSA-N 0 3 258.296 2.703 20 10 CFCDHN CC[C@H]([NH2+]CC[C@](C)(O)COC)c1ccc(C)cc1[O-] ZINC000834844157 625900170 /nfs/dbraw/zinc/90/01/70/625900170.db2.gz NNEBYHMFTMAQQF-HOCLYGCPSA-N 0 3 281.396 2.529 20 10 CFCDHN CO[C@@H]1COCC[C@H]1C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000834880762 625907839 /nfs/dbraw/zinc/90/78/39/625907839.db2.gz QAICMBAZURGWQR-IJEWVQPXSA-N 0 3 293.407 2.711 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(CF)CCOCC1)CC2 ZINC000834882695 625908562 /nfs/dbraw/zinc/90/85/62/625908562.db2.gz CVIUZWWUQPWHHL-CYBMUJFWSA-N 0 3 279.355 2.735 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1[O-])[C@@H](C)O ZINC000834888476 625910260 /nfs/dbraw/zinc/91/02/60/625910260.db2.gz PPJLUSIWYWZFDN-BNOWGMLFSA-N 0 3 251.370 2.901 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834906310 625918411 /nfs/dbraw/zinc/91/84/11/625918411.db2.gz OQDCOCAOLAEHRE-YRRQLQLVSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834906309 625918475 /nfs/dbraw/zinc/91/84/75/625918475.db2.gz OQDCOCAOLAEHRE-XRRVDJEJSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-])C(=O)NC ZINC000834913880 625920457 /nfs/dbraw/zinc/92/04/57/625920457.db2.gz QKNFAEDBAPCEBN-BXKDBHETSA-N 0 3 284.787 2.529 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2cn(C)cn2)c2c1c(F)ccc2[O-] ZINC000840767523 625925964 /nfs/dbraw/zinc/92/59/64/625925964.db2.gz USTRSTSVDKHRQT-GXFFZTMASA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@H]([NH2+][C@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)c1ccccc1[O-] ZINC000922332325 626272518 /nfs/dbraw/zinc/27/25/18/626272518.db2.gz LVRABURMECSPIT-QHLLOBJKSA-N 0 3 273.376 2.856 20 10 CFCDHN CN1CC[C@H]1C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000922576134 626314636 /nfs/dbraw/zinc/31/46/36/626314636.db2.gz UURVSNBOIKBLQD-KRWDZBQOSA-N 0 3 282.387 2.853 20 10 CFCDHN CC1(C)CCC(O)(C[NH2+]Cc2ccccc2[O-])CC1 ZINC000087046607 626480253 /nfs/dbraw/zinc/48/02/53/626480253.db2.gz PVTPYSBDRSMGDI-UHFFFAOYSA-N 0 3 263.381 2.813 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](C[C@H](O)C1CC1)C1CCCC1 ZINC000838844902 626510041 /nfs/dbraw/zinc/51/00/41/626510041.db2.gz BGZONCGLPZNJHW-KRWDZBQOSA-N 0 3 275.392 2.908 20 10 CFCDHN [O-]c1ccccc1C[N@H+](C[C@H](O)C1CC1)C1CCCC1 ZINC000838844902 626510042 /nfs/dbraw/zinc/51/00/42/626510042.db2.gz BGZONCGLPZNJHW-KRWDZBQOSA-N 0 3 275.392 2.908 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@H](OC)C23CCC3)c([O-])c1 ZINC000839179853 626529817 /nfs/dbraw/zinc/52/98/17/626529817.db2.gz ALQUIULUAINGGI-CVEARBPZSA-N 0 3 291.391 2.838 20 10 CFCDHN CCCCCNC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000839564734 626546850 /nfs/dbraw/zinc/54/68/50/626546850.db2.gz XTVVXTHBFUQXIX-AWEZNQCLSA-N 0 3 291.439 2.710 20 10 CFCDHN C[C@H](O)CC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000758480358 626595456 /nfs/dbraw/zinc/59/54/56/626595456.db2.gz GCQCPMLJHZBRRT-ZDUSSCGKSA-N 0 3 271.360 2.920 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCC2(C)OCCO2)c2c1c(F)ccc2[O-] ZINC000760892572 626782347 /nfs/dbraw/zinc/78/23/47/626782347.db2.gz YXZNCHROIMHEDS-JQWIXIFHSA-N 0 3 295.354 2.822 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@]1(C)CCO[C@H]1C1CC1 ZINC000767195174 627238870 /nfs/dbraw/zinc/23/88/70/627238870.db2.gz IXYXEGZBZVKMBT-IRXDYDNUSA-N 0 3 291.391 2.696 20 10 CFCDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768446534 627344429 /nfs/dbraw/zinc/34/44/29/627344429.db2.gz YTGWINWBSGGQKY-XJKSGUPXSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768446534 627344431 /nfs/dbraw/zinc/34/44/31/627344431.db2.gz YTGWINWBSGGQKY-XJKSGUPXSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768465291 627344829 /nfs/dbraw/zinc/34/48/29/627344829.db2.gz FRDDXVLUXHDMTF-MLGOLLRUSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)C[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768465291 627344833 /nfs/dbraw/zinc/34/48/33/627344833.db2.gz FRDDXVLUXHDMTF-MLGOLLRUSA-N 0 3 291.391 2.686 20 10 CFCDHN CCOC1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000768527467 627350458 /nfs/dbraw/zinc/35/04/58/627350458.db2.gz JQURHCCHMYQOKS-UHFFFAOYSA-N 0 3 280.387 2.893 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c([O-])c1 ZINC000769488169 627446807 /nfs/dbraw/zinc/44/68/07/627446807.db2.gz NPTQXYYBOOLNQQ-OKILXGFUSA-N 0 3 261.365 2.879 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c([O-])c1 ZINC000769488169 627446810 /nfs/dbraw/zinc/44/68/10/627446810.db2.gz NPTQXYYBOOLNQQ-OKILXGFUSA-N 0 3 261.365 2.879 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCSCC(F)(F)F ZINC000769688141 627466068 /nfs/dbraw/zinc/46/60/68/627466068.db2.gz DVCNNKFBBXPWSR-UHFFFAOYSA-N 0 3 295.326 2.786 20 10 CFCDHN CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@@H+]1Cc1ccccc1[O-] ZINC000770504217 627525984 /nfs/dbraw/zinc/52/59/84/627525984.db2.gz BIPMTZBLVLLMLW-CVEARBPZSA-N 0 3 290.407 2.614 20 10 CFCDHN CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1Cc1ccccc1[O-] ZINC000770504217 627525985 /nfs/dbraw/zinc/52/59/85/627525985.db2.gz BIPMTZBLVLLMLW-CVEARBPZSA-N 0 3 290.407 2.614 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000770739825 627545325 /nfs/dbraw/zinc/54/53/25/627545325.db2.gz SKCJUIGGUWUSTD-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN CC(C)N(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000774480708 627931597 /nfs/dbraw/zinc/93/15/97/627931597.db2.gz CGFLOJJMYYCERE-UONOGXRCSA-N 0 3 291.439 2.659 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2OC)c([O-])c1 ZINC000774834041 627968928 /nfs/dbraw/zinc/96/89/28/627968928.db2.gz XUSAQKFUSMLGSP-BBRMVZONSA-N 0 3 279.380 2.696 20 10 CFCDHN COCC[C@]1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000775201151 627999835 /nfs/dbraw/zinc/99/98/35/627999835.db2.gz CDBPARPKNXXJAX-HNNXBMFYSA-N 0 3 299.798 2.639 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CC(N)=O)C2CCCC2)c1[O-] ZINC000775648720 628049552 /nfs/dbraw/zinc/04/95/52/628049552.db2.gz ITYXLLRBLPLBNG-UHFFFAOYSA-N 0 3 296.798 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CC(N)=O)C2CCCC2)c1[O-] ZINC000775648720 628049553 /nfs/dbraw/zinc/04/95/53/628049553.db2.gz ITYXLLRBLPLBNG-UHFFFAOYSA-N 0 3 296.798 2.584 20 10 CFCDHN Cc1cc(Cl)cc(CN(CC(N)=O)C2CCCC2)c1O ZINC000775648720 628049554 /nfs/dbraw/zinc/04/95/54/628049554.db2.gz ITYXLLRBLPLBNG-UHFFFAOYSA-N 0 3 296.798 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CCCO)C2CC2)c1[O-] ZINC000775700619 628057057 /nfs/dbraw/zinc/05/70/57/628057057.db2.gz GLPFZZSFHUKOJF-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CCCO)C2CC2)c1[O-] ZINC000775700619 628057061 /nfs/dbraw/zinc/05/70/61/628057061.db2.gz GLPFZZSFHUKOJF-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCO2)c1[O-] ZINC000775794600 628069467 /nfs/dbraw/zinc/06/94/67/628069467.db2.gz XJTDGNREAUTYJW-LBPRGKRZSA-N 0 3 255.745 2.623 20 10 CFCDHN CC(C)[C@@H]1CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000777968617 628269213 /nfs/dbraw/zinc/26/92/13/628269213.db2.gz NCNPIHPKSKSYHM-KRWDZBQOSA-N 0 3 275.392 2.738 20 10 CFCDHN C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[O-] ZINC000778999360 628343760 /nfs/dbraw/zinc/34/37/60/628343760.db2.gz FANQCPAXAQAGHA-CYBMUJFWSA-N 0 3 289.350 2.914 20 10 CFCDHN C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[O-] ZINC000778999360 628343762 /nfs/dbraw/zinc/34/37/62/628343762.db2.gz FANQCPAXAQAGHA-CYBMUJFWSA-N 0 3 289.350 2.914 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]2C(C)(C)O)c([O-])c1 ZINC000779165185 628357554 /nfs/dbraw/zinc/35/75/54/628357554.db2.gz AZLZBMFGSSXORK-HNNXBMFYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)O)c([O-])c1 ZINC000779165185 628357556 /nfs/dbraw/zinc/35/75/56/628357556.db2.gz AZLZBMFGSSXORK-HNNXBMFYSA-N 0 3 279.380 2.526 20 10 CFCDHN COCC1(C)CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000779606757 628389938 /nfs/dbraw/zinc/38/99/38/628389938.db2.gz YDORLECJEIZTML-UHFFFAOYSA-N 0 3 267.344 2.780 20 10 CFCDHN CC(C)[C@@H]1CN(C)CCN1Cc1ccc(N(C)C)c(F)c1 ZINC000780902657 628503615 /nfs/dbraw/zinc/50/36/15/628503615.db2.gz OKFVUWNOXKUCFC-KRWDZBQOSA-N 0 3 293.430 2.664 20 10 CFCDHN COc1ccc(O)c(CN2CCC[C@@H](OC(F)F)C2)c1 ZINC000781532124 628557397 /nfs/dbraw/zinc/55/73/97/628557397.db2.gz LZCVHUQLVKCBFH-GFCCVEGCSA-N 0 3 287.306 2.604 20 10 CFCDHN CC1(C)CCC[C@@](O)(C[NH2+]Cc2ccccc2[O-])C1 ZINC000782534732 628643862 /nfs/dbraw/zinc/64/38/62/628643862.db2.gz GTVGSPHQUZONTF-INIZCTEOSA-N 0 3 263.381 2.813 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(SC)CC2)c([O-])c1 ZINC000788524769 629079164 /nfs/dbraw/zinc/07/91/64/629079164.db2.gz UHFNFUQLXVGVDQ-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN CN1CCCC(C)(C)[C@H]1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000790928799 629272227 /nfs/dbraw/zinc/27/22/27/629272227.db2.gz XWKKUHRQHWXRFI-OAHLLOKOSA-N 0 3 280.387 2.741 20 10 CFCDHN CO[C@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835026184 629323386 /nfs/dbraw/zinc/32/33/86/629323386.db2.gz RQNFZXPDQZZIOD-YXMMZVCTSA-N 0 3 274.408 2.877 20 10 CFCDHN CN(C)c1ccc(/C=C\CNC2COC(C)(C)OC2)cc1 ZINC000835048407 629346651 /nfs/dbraw/zinc/34/66/51/629346651.db2.gz REXWPMNZISUBDR-WAYWQWQTSA-N 0 3 290.407 2.507 20 10 CFCDHN CN(C)c1ccc(/C=C\CNCC2(C)OCCCO2)cc1 ZINC000835048644 629348275 /nfs/dbraw/zinc/34/82/75/629348275.db2.gz KCZXBEUIQFTFIA-XQRVVYSFSA-N 0 3 290.407 2.509 20 10 CFCDHN Cc1ccc(CCC[NH2+]Cc2ccccc2[O-])cn1 ZINC000792953134 629470297 /nfs/dbraw/zinc/47/02/97/629470297.db2.gz ZMVLZIHBJLKVNZ-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cccc(C)c2O)c([O-])c1 ZINC000793387555 629535942 /nfs/dbraw/zinc/53/59/42/629535942.db2.gz GRMUBMSLOWYQIQ-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN Cc1cc([C@H](C)NCc2ccc(N(C)C)cc2)n(C)n1 ZINC000793519972 629560447 /nfs/dbraw/zinc/56/04/47/629560447.db2.gz SBPXAONILWWOQU-ZDUSSCGKSA-N 0 3 272.396 2.645 20 10 CFCDHN C[C@@H](CCNC(=O)OC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000793602616 629577285 /nfs/dbraw/zinc/57/72/85/629577285.db2.gz ZHPYAZAGOKFVOV-LBPRGKRZSA-N 0 3 294.395 2.785 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H](C2CC2)O1 ZINC000794660717 629672278 /nfs/dbraw/zinc/67/22/78/629672278.db2.gz UGJKRMKLQAZOHO-KZULUSFZSA-N 0 3 287.403 2.880 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](C)[S@](C)=O)c1ccc(C)cc1[O-] ZINC000794813903 629689620 /nfs/dbraw/zinc/68/96/20/629689620.db2.gz FZTRJVCSAVUZCY-PJFSTRORSA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@H]([NH2+]CCCNC(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000794817742 629690264 /nfs/dbraw/zinc/69/02/64/629690264.db2.gz PVLMPYGILOFUTK-HNNXBMFYSA-N 0 3 292.423 2.904 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C[C@H](C)O)c1ccc(C)cc1[O-] ZINC000794818762 629690340 /nfs/dbraw/zinc/69/03/40/629690340.db2.gz TVMLQUWDCUBQHZ-OBJOEFQTSA-N 0 3 251.370 2.901 20 10 CFCDHN CC[C@H]([NH2+]CCC1CC(O)C1)c1ccc(C)cc1[O-] ZINC000794827494 629690875 /nfs/dbraw/zinc/69/08/75/629690875.db2.gz JNCMCUSJTSNSGR-PIMMBPRGSA-N 0 3 263.381 2.902 20 10 CFCDHN CNC(=O)C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])c1ccccc1 ZINC000795849706 629841755 /nfs/dbraw/zinc/84/17/55/629841755.db2.gz QGXAKDXPFFVSOY-BBRMVZONSA-N 0 3 298.386 2.920 20 10 CFCDHN Cc1ccc([C@H](O)[C@H](C)[NH2+]Cc2ccccc2[O-])cc1 ZINC000796484016 629925446 /nfs/dbraw/zinc/92/54/46/629925446.db2.gz MUCRTTPAVNPNCB-SUMWQHHRSA-N 0 3 271.360 2.912 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000796497683 629926965 /nfs/dbraw/zinc/92/69/65/629926965.db2.gz NXAFGZWEJFMRTJ-QWHCGFSZSA-N 0 3 279.380 2.553 20 10 CFCDHN C[S@@](=O)Cc1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000796526112 629930436 /nfs/dbraw/zinc/93/04/36/629930436.db2.gz JEKTYTZGWLYXDR-HXUWFJFHSA-N 0 3 289.400 2.561 20 10 CFCDHN C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccccc1[O-] ZINC000797057248 630010238 /nfs/dbraw/zinc/01/02/38/630010238.db2.gz OCBBTBVVJXNMHL-LBPRGKRZSA-N 0 3 267.332 2.891 20 10 CFCDHN CC[C@H](O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000799302553 630294442 /nfs/dbraw/zinc/29/44/42/630294442.db2.gz PVUZHUFKVDSERK-HNNXBMFYSA-N 0 3 263.381 2.908 20 10 CFCDHN CC[C@H](O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000799302553 630294448 /nfs/dbraw/zinc/29/44/48/630294448.db2.gz PVUZHUFKVDSERK-HNNXBMFYSA-N 0 3 263.381 2.908 20 10 CFCDHN COc1ccc(CNCc2cccc(OC)c2F)c(O)c1 ZINC000800525131 630394189 /nfs/dbraw/zinc/39/41/89/630394189.db2.gz RFIWOUWGANVQNQ-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1cc([C@@H](C)NCc2ccc3c(c2)CCO3)ccn1 ZINC000808432664 630991502 /nfs/dbraw/zinc/99/15/02/630991502.db2.gz WCYIIUAFEHQHQC-GFCCVEGCSA-N 0 3 284.359 2.876 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1c([O-])cccc1OC ZINC000808449945 630993990 /nfs/dbraw/zinc/99/39/90/630993990.db2.gz IIVIBMCODFQXKQ-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](C)N(C)C)c1[O-] ZINC000808690947 631029249 /nfs/dbraw/zinc/02/92/49/631029249.db2.gz HGNDGWPDLFJRMV-MNOVXSKESA-N 0 3 270.804 2.955 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2cncn2C)c1[O-] ZINC000808714076 631033782 /nfs/dbraw/zinc/03/37/82/631033782.db2.gz MBCYWJGYSUUZSV-LLVKDONJSA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@]2(O)CCO[C@H]2C)c1[O-] ZINC000808716227 631035021 /nfs/dbraw/zinc/03/50/21/631035021.db2.gz KCEYDELHMMSDGW-PGUXBMHVSA-N 0 3 299.798 2.545 20 10 CFCDHN CC(C)[N@@H+]1CCCC[C@@H]1COC(=O)c1cc([O-])cs1 ZINC000837516164 631052076 /nfs/dbraw/zinc/05/20/76/631052076.db2.gz XXSAEFABFPJJDL-LLVKDONJSA-N 0 3 283.393 2.873 20 10 CFCDHN CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1cc([O-])cs1 ZINC000837516164 631052079 /nfs/dbraw/zinc/05/20/79/631052079.db2.gz XXSAEFABFPJJDL-LLVKDONJSA-N 0 3 283.393 2.873 20 10 CFCDHN C[C@H](NCCCSc1nccs1)c1ccn(C)n1 ZINC000840724430 631176810 /nfs/dbraw/zinc/17/68/10/631176810.db2.gz WBPQJPTULXALCA-JTQLQIEISA-N 0 3 282.438 2.710 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2cn(C)cn2)c1[O-] ZINC000840763079 631220506 /nfs/dbraw/zinc/22/05/06/631220506.db2.gz GSBNHWCOKFZWFX-LLVKDONJSA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)C(=O)NC(C)C)c1[O-] ZINC000840890903 631253386 /nfs/dbraw/zinc/25/33/86/631253386.db2.gz PHQHDAKYSJTBEH-WDEREUQCSA-N 0 3 298.814 2.918 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCSCC1 ZINC000840909199 631259075 /nfs/dbraw/zinc/25/90/75/631259075.db2.gz BZVKGFXLZBEMIQ-UHFFFAOYSA-N 0 3 250.411 2.610 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]3CCC[NH2+][C@@H]3C2)c(Cl)c1 ZINC000840918260 631264761 /nfs/dbraw/zinc/26/47/61/631264761.db2.gz QUAOBSDMWPEUKO-SMDDNHRTSA-N 0 3 280.799 2.538 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCC(O)(C(F)F)CC1 ZINC000840940408 631271803 /nfs/dbraw/zinc/27/18/03/631271803.db2.gz YPTNRXXGJXZCBM-UHFFFAOYSA-N 0 3 298.377 2.653 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1cccc(OCC)c1[O-] ZINC000809751723 631281260 /nfs/dbraw/zinc/28/12/60/631281260.db2.gz JCXPXRJNTSJDMR-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1cccc(OCC)c1[O-] ZINC000809751723 631281263 /nfs/dbraw/zinc/28/12/63/631281263.db2.gz JCXPXRJNTSJDMR-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC(C)(C)OCC1CC1 ZINC000840960442 631286142 /nfs/dbraw/zinc/28/61/42/631286142.db2.gz MNANDOKJFCPFSV-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc(O)c(CN2CC(CO)(c3ccccc3)C2)cc1C ZINC000840970424 631289774 /nfs/dbraw/zinc/28/97/74/631289774.db2.gz STUJIPGHOIRMNT-UHFFFAOYSA-N 0 3 297.398 2.755 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c1[O-] ZINC000840980150 631294592 /nfs/dbraw/zinc/29/45/92/631294592.db2.gz WLKMYLOXGLBAGH-NWDGAFQWSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)[C@@H]2C)c1[O-] ZINC000840980150 631294595 /nfs/dbraw/zinc/29/45/95/631294595.db2.gz WLKMYLOXGLBAGH-NWDGAFQWSA-N 0 3 283.799 2.947 20 10 CFCDHN [NH3+][C@H](CNCc1cc(Cl)cc(Cl)c1[O-])C1CC1 ZINC000841048027 631320989 /nfs/dbraw/zinc/32/09/89/631320989.db2.gz BCYGBAFCTNESPM-LLVKDONJSA-N 0 3 275.179 2.526 20 10 CFCDHN C[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1C[NH3+] ZINC000841099362 631339297 /nfs/dbraw/zinc/33/92/97/631339297.db2.gz IVFRGUSYLBFPLD-UWVGGRQHSA-N 0 3 286.778 2.601 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1COc2c(C)cccc2C1 ZINC000810177969 631340461 /nfs/dbraw/zinc/34/04/61/631340461.db2.gz FRUJSDFDEPRUMO-CQSZACIVSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2cn[nH]c2)c1[O-] ZINC000810248567 631349955 /nfs/dbraw/zinc/34/99/55/631349955.db2.gz XRPUHOZSNBJVSJ-JTQLQIEISA-N 0 3 279.771 2.970 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCOC)COC)c1ccc(C)cc1[O-] ZINC000810256485 631350507 /nfs/dbraw/zinc/35/05/07/631350507.db2.gz AORSVBLMRCDGGL-UKRRQHHQSA-N 0 3 281.396 2.793 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(CC(F)F)C1)c1cc(F)ccc1[O-] ZINC000841766055 631470185 /nfs/dbraw/zinc/47/01/85/631470185.db2.gz YKVVARSLLYNTRJ-MWLCHTKSSA-N 0 3 288.313 2.521 20 10 CFCDHN CO[C@@H](CC(C)C)C[N@H+](C)Cc1ccccc1[O-] ZINC000842153712 631555065 /nfs/dbraw/zinc/55/50/65/631555065.db2.gz QJSMECUSGCMUQZ-AWEZNQCLSA-N 0 3 251.370 2.885 20 10 CFCDHN CO[C@@H](CC(C)C)C[N@@H+](C)Cc1ccccc1[O-] ZINC000842153712 631555068 /nfs/dbraw/zinc/55/50/68/631555068.db2.gz QJSMECUSGCMUQZ-AWEZNQCLSA-N 0 3 251.370 2.885 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@]3(CCSC3)C2)c1 ZINC000842626113 631683993 /nfs/dbraw/zinc/68/39/93/631683993.db2.gz UYFWKZSBVFRIJD-MRXNPFEDSA-N 0 3 293.432 2.717 20 10 CFCDHN C[N@H+](CCC(C)(C)C)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000842630393 631685287 /nfs/dbraw/zinc/68/52/87/631685287.db2.gz DKSYYGKZPSXONO-AWEZNQCLSA-N 0 3 279.380 2.686 20 10 CFCDHN C[N@@H+](CCC(C)(C)C)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000842630393 631685293 /nfs/dbraw/zinc/68/52/93/631685293.db2.gz DKSYYGKZPSXONO-AWEZNQCLSA-N 0 3 279.380 2.686 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCS[C@H]2C)c([O-])c1 ZINC000842777713 631737666 /nfs/dbraw/zinc/73/76/66/631737666.db2.gz CNKZAWINULFSJH-GWCFXTLKSA-N 0 3 267.394 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+](C(C)C)[C@@H]2CCOC2)c([O-])c1 ZINC000812775614 631770882 /nfs/dbraw/zinc/77/08/82/631770882.db2.gz FDSZQKZCZJNASI-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@@H+](C(C)C)[C@@H]2CCOC2)c([O-])c1 ZINC000812775614 631770888 /nfs/dbraw/zinc/77/08/88/631770888.db2.gz FDSZQKZCZJNASI-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CC[C@@H]([NH2+]CCCc1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000842905261 631779593 /nfs/dbraw/zinc/77/95/93/631779593.db2.gz XBCXFINCUPQZFH-CQSZACIVSA-N 0 3 288.395 2.503 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)CO1 ZINC000842927238 631782612 /nfs/dbraw/zinc/78/26/12/631782612.db2.gz DFLTYPPMEXGFRI-SVDPJWKOSA-N 0 3 265.328 2.847 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000843124340 631843721 /nfs/dbraw/zinc/84/37/21/631843721.db2.gz YPZGBYFMPQWIDB-HNNXBMFYSA-N 0 3 280.799 2.621 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843415179 631947773 /nfs/dbraw/zinc/94/77/73/631947773.db2.gz BBKGDBNUKZILTB-IUODEOHRSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843415179 631947780 /nfs/dbraw/zinc/94/77/80/631947780.db2.gz BBKGDBNUKZILTB-IUODEOHRSA-N 0 3 279.355 2.922 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843417077 631948364 /nfs/dbraw/zinc/94/83/64/631948364.db2.gz OWENVHZDHHUAKJ-ZFWWWQNUSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843417077 631948369 /nfs/dbraw/zinc/94/83/69/631948369.db2.gz OWENVHZDHHUAKJ-ZFWWWQNUSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccccc2[O-])CC2(CCCC2)O1 ZINC000843435027 631959251 /nfs/dbraw/zinc/95/92/51/631959251.db2.gz PUARQJVDBWDQOD-CYBMUJFWSA-N 0 3 261.365 2.926 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccccc2[O-])CC2(CCCC2)O1 ZINC000843435027 631959253 /nfs/dbraw/zinc/95/92/53/631959253.db2.gz PUARQJVDBWDQOD-CYBMUJFWSA-N 0 3 261.365 2.926 20 10 CFCDHN CC[N@H+](CCSC)Cc1c([O-])cccc1OC ZINC000843437552 631960642 /nfs/dbraw/zinc/96/06/42/631960642.db2.gz LIVVCJJCDLFKEQ-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN CC[N@@H+](CCSC)Cc1c([O-])cccc1OC ZINC000843437552 631960647 /nfs/dbraw/zinc/96/06/47/631960647.db2.gz LIVVCJJCDLFKEQ-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1[O-])CN(C)C ZINC000813877177 631971237 /nfs/dbraw/zinc/97/12/37/631971237.db2.gz NIYJIVAFWFSATA-ZJUUUORDSA-N 0 3 272.339 2.519 20 10 CFCDHN COc1ccc(CNCc2cc(OC)ccc2F)c(O)c1 ZINC000816597126 632492190 /nfs/dbraw/zinc/49/21/90/632492190.db2.gz FNAPBPIDFYMNSX-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN Cc1cccc(CN2C[C@]3(CCCO3)[C@H]2C2CC2)c1O ZINC000816666278 632508239 /nfs/dbraw/zinc/50/82/39/632508239.db2.gz JIOPHGPEUZNIFS-IAGOWNOFSA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1cccc(CN2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1O ZINC000816666279 632508878 /nfs/dbraw/zinc/50/88/78/632508878.db2.gz JIOPHGPEUZNIFS-IRXDYDNUSA-N 0 3 273.376 2.844 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccccc1[O-] ZINC000845991945 632608941 /nfs/dbraw/zinc/60/89/41/632608941.db2.gz XZPRRTYYPATRAA-NSHDSACASA-N 0 3 271.364 2.854 20 10 CFCDHN C[C@H](O)[C@H](NCc1ccccc1O)c1ccccc1F ZINC000846016923 632615507 /nfs/dbraw/zinc/61/55/07/632615507.db2.gz KLVBBSXJEZSZGE-ZBEGNZNMSA-N 0 3 275.323 2.743 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2OC)c([O-])c1 ZINC000846056381 632625258 /nfs/dbraw/zinc/62/52/58/632625258.db2.gz OHNCUMYBLUTXFB-GDBMZVCRSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@H](C)OCC23CCC3)c1 ZINC000846066830 632627557 /nfs/dbraw/zinc/62/75/57/632627557.db2.gz HFGAYUSKQIZJCD-ZDUSSCGKSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cc([O-])c(CN(C)C[C@@H]2CCC[N@@H+]2C)c(Cl)c1 ZINC000817417453 632627784 /nfs/dbraw/zinc/62/77/84/632627784.db2.gz MVRILKDBLYZTBA-LBPRGKRZSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc([O-])c(CN(C)C[C@@H]2CCC[N@H+]2C)c(Cl)c1 ZINC000817417453 632627786 /nfs/dbraw/zinc/62/77/86/632627786.db2.gz MVRILKDBLYZTBA-LBPRGKRZSA-N 0 3 282.815 2.880 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000846182811 632655619 /nfs/dbraw/zinc/65/56/19/632655619.db2.gz DMUXBGKPXDGLEY-UBHSHLNASA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@H](N[C@@H]1CC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817944547 632747578 /nfs/dbraw/zinc/74/75/78/632747578.db2.gz GSKKCWFXNYMFLN-DGCLKSJQSA-N 0 3 256.349 2.558 20 10 CFCDHN CC[NH2+]CCN[C@H](CC)c1cccc(Cl)c1[O-] ZINC000817951216 632751630 /nfs/dbraw/zinc/75/16/30/632751630.db2.gz BRIKYXTYGGUVLF-GFCCVEGCSA-N 0 3 256.777 2.696 20 10 CFCDHN CC(C)C[C@@H](CN)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000817958079 632756471 /nfs/dbraw/zinc/75/64/71/632756471.db2.gz HGGVZODQCDTWKF-JQWIXIFHSA-N 0 3 254.349 2.555 20 10 CFCDHN CC[C@H]([NH2+][C@H](CN)CC(C)C)c1ccc(F)cc1[O-] ZINC000817957915 632756581 /nfs/dbraw/zinc/75/65/81/632756581.db2.gz GEAZUAJOXCJLMI-JSGCOSHPSA-N 0 3 268.376 2.945 20 10 CFCDHN C[C@@H]([NH2+][C@H](CN)C1CC1)c1ccc(Br)cc1[O-] ZINC000817959759 632757971 /nfs/dbraw/zinc/75/79/71/632757971.db2.gz IJTCZIRCFZGXCQ-PRHODGIISA-N 0 3 299.212 2.543 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CNCC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000817969726 632768486 /nfs/dbraw/zinc/76/84/86/632768486.db2.gz YUVNZZWVHPHLAJ-BPNCWPANSA-N 0 3 266.360 2.570 20 10 CFCDHN COc1cc(Br)cc(C[NH2+][C@@H]2CC23CC3)c1[O-] ZINC000818229877 632816666 /nfs/dbraw/zinc/81/66/66/632816666.db2.gz GIFACCCYUZMRKR-LLVKDONJSA-N 0 3 298.180 2.805 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1c3ccccc3C[C@@H]1O)CC2 ZINC000848564646 633290317 /nfs/dbraw/zinc/29/03/17/633290317.db2.gz AHEAWXPBPQQZEN-ZVZYQTTQSA-N 0 3 281.355 2.627 20 10 CFCDHN CCc1cccc(CNCc2cccnc2N(C)C)c1O ZINC000848893391 633380079 /nfs/dbraw/zinc/38/00/79/633380079.db2.gz VVRRISQSVYEKLK-UHFFFAOYSA-N 0 3 285.391 2.705 20 10 CFCDHN CCc1cccc(CNCc2ccc(F)cn2)c1O ZINC000848899644 633388441 /nfs/dbraw/zinc/38/84/41/633388441.db2.gz RICIUEXEAAAQLC-UHFFFAOYSA-N 0 3 260.312 2.779 20 10 CFCDHN CCc1cccc(C[NH2+][C@H]2CCC[C@@H]2CCO)c1[O-] ZINC000848904095 633390718 /nfs/dbraw/zinc/39/07/18/633390718.db2.gz KKZZLWUKSPRVCR-HIFRSBDPSA-N 0 3 263.381 2.595 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](C1CC1)[C@@H]1CCCCO1 ZINC000848921970 633403624 /nfs/dbraw/zinc/40/36/24/633403624.db2.gz KMAUTBCYHCTKHI-JKSUJKDBSA-N 0 3 279.355 2.969 20 10 CFCDHN C[C@@H](NCc1cnc2n1CCC2)c1ccc(N(C)C)cc1 ZINC000850251981 633913368 /nfs/dbraw/zinc/91/33/68/633913368.db2.gz JTZISCJIBJTDJA-CYBMUJFWSA-N 0 3 284.407 2.746 20 10 CFCDHN C[C@@H](NCc1cnn2c1CCC2)c1ccc(N(C)C)cc1 ZINC000850251669 633913512 /nfs/dbraw/zinc/91/35/12/633913512.db2.gz BWIJISHMUNTZBP-CYBMUJFWSA-N 0 3 284.407 2.746 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCN(C(C)(C)C)C2)c([O-])c1 ZINC000850350273 633949791 /nfs/dbraw/zinc/94/97/91/633949791.db2.gz AFFQDCVPDNLAJJ-CQSZACIVSA-N 0 3 292.423 2.753 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@]2(C)CC2(F)F)c([O-])c1 ZINC000850379491 633966524 /nfs/dbraw/zinc/96/65/24/633966524.db2.gz RFNNJSSGHNDYCD-CYBMUJFWSA-N 0 3 271.307 2.926 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)CN1CCC(C)CC1 ZINC000850387729 633971317 /nfs/dbraw/zinc/97/13/17/633971317.db2.gz YLPGFSXTMWGFBX-AWEZNQCLSA-N 0 3 292.423 2.611 20 10 CFCDHN CC(C)(C)OC(=O)C1(C[NH2+]Cc2ccccc2[O-])CCC1 ZINC000850413861 633982901 /nfs/dbraw/zinc/98/29/01/633982901.db2.gz UKMPPPFXLZYPPO-UHFFFAOYSA-N 0 3 291.391 2.994 20 10 CFCDHN C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccccc1[O-] ZINC000850411897 633983388 /nfs/dbraw/zinc/98/33/88/633983388.db2.gz NNIHIJZREAOHGI-SUMWQHHRSA-N 0 3 271.360 2.646 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C1CCC1)c1ccc(C)cc1[O-] ZINC000850487163 634014513 /nfs/dbraw/zinc/01/45/13/634014513.db2.gz FSBBXQULRBJSLB-GJZGRUSLSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@@H]([S@](C)=O)C1)c1cc(F)ccc1[O-] ZINC000850500462 634019851 /nfs/dbraw/zinc/01/98/51/634019851.db2.gz DNBZVHGMYGQNEA-YBQGDOTASA-N 0 3 299.411 2.872 20 10 CFCDHN C[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000850502464 634021585 /nfs/dbraw/zinc/02/15/85/634021585.db2.gz PXVIMFCHEYTSRY-PSUSHLJKSA-N 0 3 293.432 2.659 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)CC1CC1)c1cc(F)ccc1[O-] ZINC000850545877 634046408 /nfs/dbraw/zinc/04/64/08/634046408.db2.gz UCRTVKJBSMUOJN-CMPLNLGQSA-N 0 3 267.344 2.591 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CO)CCC(C)C)c([O-])c1 ZINC000858241529 636161720 /nfs/dbraw/zinc/16/17/20/636161720.db2.gz XADQUSPCTIPVKG-AWEZNQCLSA-N 0 3 281.396 2.678 20 10 CFCDHN CCCN(Cc1ccccc1O)Cc1nccnc1C ZINC000857015048 635906306 /nfs/dbraw/zinc/90/63/06/635906306.db2.gz VSOLMHHBDGATCT-UHFFFAOYSA-N 0 3 271.364 2.903 20 10 CFCDHN CC[C@@H](C)[C@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135073 636135708 /nfs/dbraw/zinc/13/57/08/636135708.db2.gz LLTROYYQENCGDY-MEBBXXQBSA-N 0 3 286.366 2.527 20 10 CFCDHN CC[C@@]1(CO)CCCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862336762 637324446 /nfs/dbraw/zinc/32/44/46/637324446.db2.gz KFGQIJLKWUBMCC-INIZCTEOSA-N 0 3 298.377 2.768 20 10 CFCDHN COc1cc(O)c(CN[C@@H](C)c2ccns2)cc1OC ZINC000862540027 637413992 /nfs/dbraw/zinc/41/39/92/637413992.db2.gz XHXJWMPUIUEMNL-VIFPVBQESA-N 0 3 294.376 2.717 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000189993367 650405970 /nfs/dbraw/zinc/40/59/70/650405970.db2.gz JZJKZWOBQKXTLM-VXGBXAGGSA-N 0 3 294.395 2.956 20 10 CFCDHN C[C@@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1ccccc1[O-] ZINC000865715028 638530154 /nfs/dbraw/zinc/53/01/54/638530154.db2.gz HHJNTQUULRIRBY-KRWDZBQOSA-N 0 3 289.350 2.615 20 10 CFCDHN c1cc(CNCc2ccc3c(c2)CCO3)c2c(c1)COCC2 ZINC000865725390 638537483 /nfs/dbraw/zinc/53/74/83/638537483.db2.gz IBFLOMMBXAZLGN-UHFFFAOYSA-N 0 3 295.382 2.984 20 10 CFCDHN CN1Cc2ccccc2[C@H]1C[NH2+]Cc1ccccc1[O-] ZINC000865807517 638585208 /nfs/dbraw/zinc/58/52/08/638585208.db2.gz SZUQXLGMNSYICR-MRXNPFEDSA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@@H](NC/C=C\c1ccc(N(C)C)cc1)c1ccnn1C ZINC000865838234 638603703 /nfs/dbraw/zinc/60/37/03/638603703.db2.gz RXPJNXNOIDHPIM-GEXIGZQTSA-N 0 3 284.407 2.850 20 10 CFCDHN CC[C@H]([NH2+][C@H]1[C@@H]2OC[C@H]3C[C@H]1C[C@H]23)c1ccccc1[O-] ZINC000866444664 638822269 /nfs/dbraw/zinc/82/22/69/638822269.db2.gz JJAJIVBXKUVNFY-QKZBUQIKSA-N 0 3 273.376 2.856 20 10 CFCDHN COc1cccc([C@H](C)N[C@@H](C)c2ccnn2C)c1O ZINC000866615923 638855240 /nfs/dbraw/zinc/85/52/40/638855240.db2.gz XUHRBAJGDOOXAX-QWRGUYRKSA-N 0 3 275.352 2.546 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866639645 638860099 /nfs/dbraw/zinc/86/00/99/638860099.db2.gz VFLMTYAUSGJZHW-RYDUCSDGSA-N 0 3 279.355 2.973 20 10 CFCDHN Cc1nc2ccccn2c1C[NH2+]Cc1ccccc1[O-] ZINC000122431002 639029976 /nfs/dbraw/zinc/02/99/76/639029976.db2.gz ZPEZUDRYAUSQIH-UHFFFAOYSA-N 0 3 267.332 2.638 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000191608972 650512694 /nfs/dbraw/zinc/51/26/94/650512694.db2.gz CFAXKCSCLYLISR-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN CCc1cccc(CN2CCN(C)c3ncccc3C2)c1O ZINC000872267503 641727654 /nfs/dbraw/zinc/72/76/54/641727654.db2.gz SRUXKHNWYPYXCX-UHFFFAOYSA-N 0 3 297.402 2.802 20 10 CFCDHN Oc1cc2c(cc1CN1CCO[C@H](C(F)F)CC1)CCC2 ZINC000872678914 641893909 /nfs/dbraw/zinc/89/39/09/641893909.db2.gz OMPUZWYKKPUZTR-HNNXBMFYSA-N 0 3 297.345 2.737 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])NC(=O)OC(C)(C)C ZINC000194945481 650733535 /nfs/dbraw/zinc/73/35/35/650733535.db2.gz GLACPRISPMSCHT-JTQLQIEISA-N 0 3 298.358 2.534 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000020093241 642298533 /nfs/dbraw/zinc/29/85/33/642298533.db2.gz KVHVOVXZNXQVEN-LBPRGKRZSA-N 0 3 284.359 2.603 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1COc2ccccc2O1)c1ccccc1[O-] ZINC000020137838 642305795 /nfs/dbraw/zinc/30/57/95/642305795.db2.gz SDGZRMCCNWAJHV-OLZOCXBDSA-N 0 3 285.343 2.883 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c([O-])c1 ZINC000876627360 642950213 /nfs/dbraw/zinc/95/02/13/642950213.db2.gz RCMGPBFDNFNOPH-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)c([O-])c1 ZINC000876627360 642950216 /nfs/dbraw/zinc/95/02/16/642950216.db2.gz RCMGPBFDNFNOPH-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(n2ccnc2)CC1 ZINC000876650895 642959293 /nfs/dbraw/zinc/95/92/93/642959293.db2.gz JQNJYOXXBMOTGU-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCC(=O)OC(C)(C)C ZINC000876769431 643001511 /nfs/dbraw/zinc/00/15/11/643001511.db2.gz XBTFMGJYYIDXBH-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000876769431 643001516 /nfs/dbraw/zinc/00/15/16/643001516.db2.gz XBTFMGJYYIDXBH-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876807329 643018686 /nfs/dbraw/zinc/01/86/86/643018686.db2.gz BJYHAMGRIGZCKN-HOCLYGCPSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876807329 643018691 /nfs/dbraw/zinc/01/86/91/643018691.db2.gz BJYHAMGRIGZCKN-HOCLYGCPSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)c1ccccc1 ZINC000876888257 643053506 /nfs/dbraw/zinc/05/35/06/643053506.db2.gz BZXMCGMEGUZMQK-INIZCTEOSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCN1Cc2ccccc2C1 ZINC000876917096 643064154 /nfs/dbraw/zinc/06/41/54/643064154.db2.gz AEOOHXQANVGEFQ-UHFFFAOYSA-N 0 3 282.387 2.806 20 10 CFCDHN Cc1cccc(C(=O)NCC[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000876958105 643081423 /nfs/dbraw/zinc/08/14/23/643081423.db2.gz RRENWGGJYDNYPQ-UHFFFAOYSA-N 0 3 298.386 2.529 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)CCC(C)C)c([O-])c1 ZINC000877050465 643121603 /nfs/dbraw/zinc/12/16/03/643121603.db2.gz NCGVDHYWQNRNIU-INIZCTEOSA-N 0 3 265.397 2.977 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)Cc2ccncc2)c([O-])c1 ZINC000877073345 643135501 /nfs/dbraw/zinc/13/55/01/643135501.db2.gz ITGMEDTVCLICQQ-CYBMUJFWSA-N 0 3 256.349 2.816 20 10 CFCDHN CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877077316 643138260 /nfs/dbraw/zinc/13/82/60/643138260.db2.gz CJOZAKSGIOBPCL-SXGZJXTBSA-N 0 3 295.448 2.870 20 10 CFCDHN COC1CCC(C[NH2+]Cc2c(C)cccc2[O-])CC1 ZINC000877082164 643141811 /nfs/dbraw/zinc/14/18/11/643141811.db2.gz XTJCVXSYGUXUFN-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](C)C[C@H](O)c1ccco1 ZINC000877128311 643167191 /nfs/dbraw/zinc/16/71/91/643167191.db2.gz GBBWBZWBNAMVOR-DOMZBBRYSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@H]1CCCC[C@@H]1O ZINC000877166951 643185107 /nfs/dbraw/zinc/18/51/07/643185107.db2.gz JKBIRTVQRCFGEL-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@H]1CCCC[C@@H]1O ZINC000877166951 643185111 /nfs/dbraw/zinc/18/51/11/643185111.db2.gz JKBIRTVQRCFGEL-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C1Cc2ccccc2C1 ZINC000877360179 643248143 /nfs/dbraw/zinc/24/81/43/643248143.db2.gz LDZZKUWVAUDVTC-UHFFFAOYSA-N 0 3 253.345 2.958 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000877464211 643284262 /nfs/dbraw/zinc/28/42/62/643284262.db2.gz IBLMISPVBUMWJU-INIZCTEOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2[C@H](C)O)c([O-])c1 ZINC000877465238 643285435 /nfs/dbraw/zinc/28/54/35/643285435.db2.gz RSJHGPHKRNCKCD-KCQAQPDRSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2[C@H](C)O)c([O-])c1 ZINC000877465238 643285442 /nfs/dbraw/zinc/28/54/42/643285442.db2.gz RSJHGPHKRNCKCD-KCQAQPDRSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](c2ccnn2C)C(C)C)c([O-])c1 ZINC000877467715 643286849 /nfs/dbraw/zinc/28/68/49/643286849.db2.gz NBCNNJWLCZMTPI-OAHLLOKOSA-N 0 3 287.407 2.964 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](c2ccnn2C)C(C)C)c([O-])c1 ZINC000877467714 643287576 /nfs/dbraw/zinc/28/75/76/643287576.db2.gz NBCNNJWLCZMTPI-HNNXBMFYSA-N 0 3 287.407 2.964 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000877508301 643318590 /nfs/dbraw/zinc/31/85/90/643318590.db2.gz WKSWIZYONPURGP-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000877508301 643318595 /nfs/dbraw/zinc/31/85/95/643318595.db2.gz WKSWIZYONPURGP-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN COC(=O)CCCCC[NH2+]Cc1c(C)cccc1[O-] ZINC000877523450 643328098 /nfs/dbraw/zinc/32/80/98/643328098.db2.gz KUAZGHBJHVHAJN-UHFFFAOYSA-N 0 3 265.353 2.524 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H](O)c2ccccc2)c([O-])c1 ZINC000877526320 643329710 /nfs/dbraw/zinc/32/97/10/643329710.db2.gz HVKFWHQBRYENPZ-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H](O)c1ccccc1 ZINC000877525916 643330123 /nfs/dbraw/zinc/33/01/23/643330123.db2.gz BTSUVKSZOQAXBA-INIZCTEOSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)Cc2cccc(F)c2)c([O-])c1 ZINC000877556981 643358687 /nfs/dbraw/zinc/35/86/87/643358687.db2.gz MCCKVABYMBLING-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN CCOC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877570278 643368955 /nfs/dbraw/zinc/36/89/55/643368955.db2.gz GFVDTEBLQNWROY-KGLIPLIRSA-N 0 3 277.364 2.522 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCOC(C)(C)C2)c([O-])c1 ZINC000877577758 643375104 /nfs/dbraw/zinc/37/51/04/643375104.db2.gz ITOXGJHHQHSKII-ZDUSSCGKSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@H]1C[C@@H]([NH2+]Cc2c(C)cccc2[O-])C12CCC2 ZINC000877585118 643380236 /nfs/dbraw/zinc/38/02/36/643380236.db2.gz PYLCNQHGJHWDAE-CABCVRRESA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)OCC1CC1 ZINC000877589131 643384230 /nfs/dbraw/zinc/38/42/30/643384230.db2.gz HFWZDMTVMJMBDS-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN CC[C@H]([NH2+]Cc1c(C)cccc1[O-])[C@H](O)C(C)C ZINC000877591459 643385484 /nfs/dbraw/zinc/38/54/84/643385484.db2.gz ULSBSULEFPGJFE-DZGCQCFKSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)Cc2ccccn2)c([O-])c1 ZINC000877618253 643405357 /nfs/dbraw/zinc/40/53/57/643405357.db2.gz MVLURCFVIBEVNR-CYBMUJFWSA-N 0 3 256.349 2.816 20 10 CFCDHN COCC1(C2CCC2)C[NH+](Cc2c(C)cccc2[O-])C1 ZINC000877625380 643411655 /nfs/dbraw/zinc/41/16/55/643411655.db2.gz KLPVUTXFVOOBKC-UHFFFAOYSA-N 0 3 275.392 2.949 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877639407 643424160 /nfs/dbraw/zinc/42/41/60/643424160.db2.gz IVPFHEGEJOJEBD-RDJZCZTQSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]CC2SCCS2)c([O-])c1 ZINC000877638917 643424244 /nfs/dbraw/zinc/42/42/44/643424244.db2.gz RWUVMUBCOUCGEZ-UHFFFAOYSA-N 0 3 255.408 2.596 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1SCCS1 ZINC000877638671 643424445 /nfs/dbraw/zinc/42/44/45/643424445.db2.gz KWHQVAWNHJIPKO-UHFFFAOYSA-N 0 3 255.408 2.596 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2Cc3ccccc3CO2)c([O-])c1 ZINC000877649921 643431050 /nfs/dbraw/zinc/43/10/50/643431050.db2.gz LNMHDCPNKHKLLX-KRWDZBQOSA-N 0 3 283.371 2.932 20 10 CFCDHN COC(=O)Cc1ccc(C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877650534 643431687 /nfs/dbraw/zinc/43/16/87/643431687.db2.gz KFXBIODNKWHTCC-UHFFFAOYSA-N 0 3 299.370 2.706 20 10 CFCDHN CC(=O)N(C)c1ccc(C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877654948 643435766 /nfs/dbraw/zinc/43/57/66/643435766.db2.gz YBWQLCMQKBIJIV-UHFFFAOYSA-N 0 3 298.386 2.973 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(SC)CC1 ZINC000877663758 643440564 /nfs/dbraw/zinc/44/05/64/643440564.db2.gz YVJUKAMIPNILKW-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCCCCNC(=O)CC2)c([O-])c1 ZINC000877684979 643453581 /nfs/dbraw/zinc/45/35/81/643453581.db2.gz GSUMWCPQAHYQIY-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCCCCNC(=O)CC2)c([O-])c1 ZINC000877684979 643453590 /nfs/dbraw/zinc/45/35/90/643453590.db2.gz GSUMWCPQAHYQIY-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@](O)(CC)C2)c([O-])c1 ZINC000877691758 643458313 /nfs/dbraw/zinc/45/83/13/643458313.db2.gz VOSBMIKEILSHGQ-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@](O)(CC)C2)c([O-])c1 ZINC000877691758 643458318 /nfs/dbraw/zinc/45/83/18/643458318.db2.gz VOSBMIKEILSHGQ-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CC1(NCc2cc(-c3ccccc3)ccc2O)COC1 ZINC000877691943 643458329 /nfs/dbraw/zinc/45/83/29/643458329.db2.gz YEWLMRAVNNEOLK-UHFFFAOYSA-N 0 3 269.344 2.938 20 10 CFCDHN CC1([NH2+]Cc2cc(-c3ccccc3)ccc2[O-])COC1 ZINC000877691943 643458335 /nfs/dbraw/zinc/45/83/35/643458335.db2.gz YEWLMRAVNNEOLK-UHFFFAOYSA-N 0 3 269.344 2.938 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](C1CCC1)[C@@H]1CCCO1 ZINC000877701526 643464488 /nfs/dbraw/zinc/46/44/88/643464488.db2.gz ZEIAJFMJCODSHF-JKSUJKDBSA-N 0 3 279.355 2.969 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@H]2CN3CCC2CC3)c1[O-] ZINC000877706248 643473641 /nfs/dbraw/zinc/47/36/41/643473641.db2.gz ITYQCEYBLXQYEW-HNNXBMFYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@H]2CN3CCC2CC3)c1[O-] ZINC000877706248 643473644 /nfs/dbraw/zinc/47/36/44/643473644.db2.gz ITYQCEYBLXQYEW-HNNXBMFYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CCC2)[C@H]2CCOC2)c([O-])c1 ZINC000877709674 643476302 /nfs/dbraw/zinc/47/63/02/643476302.db2.gz GDVXFOWBYHMHQJ-DOTOQJQBSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc1Cl ZINC000877741047 643510671 /nfs/dbraw/zinc/51/06/71/643510671.db2.gz MGSDNYAKWWIUHU-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)cc1Cl ZINC000877741047 643510675 /nfs/dbraw/zinc/51/06/75/643510675.db2.gz MGSDNYAKWWIUHU-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@H](CC[N@H+]3C)C2)c(Cl)c1 ZINC000877742989 643515798 /nfs/dbraw/zinc/51/57/98/643515798.db2.gz SPTGFQOOPSKNQW-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c(Cl)c1 ZINC000877742989 643515804 /nfs/dbraw/zinc/51/58/04/643515804.db2.gz SPTGFQOOPSKNQW-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccccc1[O-] ZINC000877758148 643538410 /nfs/dbraw/zinc/53/84/10/643538410.db2.gz KUEUYKHNWONHDH-QWHCGFSZSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@H]([NH2+]Cc1ccnn1CC1CC1)c1ccccc1[O-] ZINC000877758412 643538581 /nfs/dbraw/zinc/53/85/81/643538581.db2.gz ZAXJXOFPBKVHBZ-LBPRGKRZSA-N 0 3 271.364 2.850 20 10 CFCDHN CCC[N@H+](Cc1cc[nH]c(=O)c1)Cc1ccccc1[O-] ZINC000878150673 643762251 /nfs/dbraw/zinc/76/22/51/643762251.db2.gz HHNWWGKJQMYSPN-UHFFFAOYSA-N 0 3 272.348 2.905 20 10 CFCDHN CCC[N@@H+](Cc1cc[nH]c(=O)c1)Cc1ccccc1[O-] ZINC000878150673 643762255 /nfs/dbraw/zinc/76/22/55/643762255.db2.gz HHNWWGKJQMYSPN-UHFFFAOYSA-N 0 3 272.348 2.905 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H]2c2cn[nH]c2)cc1 ZINC000878875984 644058151 /nfs/dbraw/zinc/05/81/51/644058151.db2.gz IAJVWMKYFQFLAV-MRXNPFEDSA-N 0 3 270.380 2.813 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N[C@H]1CCCC[C@@H]1C)c1ccccc1[O-] ZINC000879647609 644361174 /nfs/dbraw/zinc/36/11/74/644361174.db2.gz GCTNYFIJNOJTJK-GUTXKFCHSA-N 0 3 290.407 2.738 20 10 CFCDHN CCCCCCNC(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648051 644361352 /nfs/dbraw/zinc/36/13/52/644361352.db2.gz XCKOPQVWQFPNKF-CYBMUJFWSA-N 0 3 278.396 2.739 20 10 CFCDHN CC(C)N(C(=O)C[NH2+][C@H](C)c1ccccc1[O-])C(C)C ZINC000879647639 644361924 /nfs/dbraw/zinc/36/19/24/644361924.db2.gz GUJCWCSYNFXRPS-CYBMUJFWSA-N 0 3 278.396 2.688 20 10 CFCDHN CCn1cc(CC[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000879650946 644364573 /nfs/dbraw/zinc/36/45/73/644364573.db2.gz ZDRZBLVXZDOMHA-LBPRGKRZSA-N 0 3 259.353 2.502 20 10 CFCDHN C[C@H]([NH2+]CCO[C@H]1CCCCO1)c1ccccc1[O-] ZINC000879650477 644364827 /nfs/dbraw/zinc/36/48/27/644364827.db2.gz BYCXMZKIAQZSLB-WFASDCNBSA-N 0 3 265.353 2.586 20 10 CFCDHN CC[N@H+](C)C[C@@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000093770267 650945719 /nfs/dbraw/zinc/94/57/19/650945719.db2.gz CFDXZWQZPIRZSH-LBPRGKRZSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[N@@H+](C)C[C@@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000093770267 650945726 /nfs/dbraw/zinc/94/57/26/650945726.db2.gz CFDXZWQZPIRZSH-LBPRGKRZSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[C@@H]([NH2+]CC(=O)NCc1ccccc1)c1ccccc1[O-] ZINC000128572246 644813411 /nfs/dbraw/zinc/81/34/11/644813411.db2.gz CEGDYPFCIKMCGW-MRXNPFEDSA-N 0 3 298.386 2.749 20 10 CFCDHN CCC[N@H+](Cc1cccc(C(N)=O)c1)Cc1ccccc1[O-] ZINC000130731271 645562402 /nfs/dbraw/zinc/56/24/02/645562402.db2.gz CFLSCRWXZUPEFE-UHFFFAOYSA-N 0 3 298.386 2.903 20 10 CFCDHN CCC[N@@H+](Cc1cccc(C(N)=O)c1)Cc1ccccc1[O-] ZINC000130731271 645562407 /nfs/dbraw/zinc/56/24/07/645562407.db2.gz CFLSCRWXZUPEFE-UHFFFAOYSA-N 0 3 298.386 2.903 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCSC)c1[O-] ZINC000130777797 645569464 /nfs/dbraw/zinc/56/94/64/645569464.db2.gz MFQYDXMHKXQZAC-UHFFFAOYSA-N 0 3 261.774 2.507 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000883243406 645690988 /nfs/dbraw/zinc/69/09/88/645690988.db2.gz KAZQOHYACBJGKH-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN CC[C@@H]([NH2+]CC1(CO)CCCC1)c1ccccc1[O-] ZINC000135073041 646454944 /nfs/dbraw/zinc/45/49/44/646454944.db2.gz GLACSYMLIOEPCP-CQSZACIVSA-N 0 3 263.381 2.986 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1c([O-])cccc1F ZINC000886487554 647016260 /nfs/dbraw/zinc/01/62/60/647016260.db2.gz IVZSOBFVFBCEGB-LLVKDONJSA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1c([O-])cccc1F ZINC000886501676 647021101 /nfs/dbraw/zinc/02/11/01/647021101.db2.gz TYDRPUWTIPCFMN-NEPJUHHUSA-N 0 3 278.371 2.666 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@H](C)c2c([O-])cccc2F)C1 ZINC000886506129 647023058 /nfs/dbraw/zinc/02/30/58/647023058.db2.gz CZLFYRHDMZGDQD-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886612670 647066963 /nfs/dbraw/zinc/06/69/63/647066963.db2.gz QZLVEFBXJSFEKM-NWDGAFQWSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@H+](C)C[C@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886612670 647066969 /nfs/dbraw/zinc/06/69/69/647066969.db2.gz QZLVEFBXJSFEKM-NWDGAFQWSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@@H+](C)C[C@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886612670 647066973 /nfs/dbraw/zinc/06/69/73/647066973.db2.gz QZLVEFBXJSFEKM-NWDGAFQWSA-N 0 3 268.376 2.911 20 10 CFCDHN C[C@H](NCc1ccc(N2CCCC2)cc1)c1ccnnc1 ZINC000924647509 648018268 /nfs/dbraw/zinc/01/82/68/648018268.db2.gz HJEFUFNSBIBKBD-AWEZNQCLSA-N 0 3 282.391 2.928 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCc2cc(N)ccn2)cc1 ZINC000925772568 648316341 /nfs/dbraw/zinc/31/63/41/648316341.db2.gz UFECLLUJSWQRIK-ZDUSSCGKSA-N 0 3 284.407 2.971 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1ccccc1[O-] ZINC000927057843 648693080 /nfs/dbraw/zinc/69/30/80/648693080.db2.gz MFAKRWNMPUGZPB-LWWSYDQCSA-N 0 3 277.364 2.725 20 10 CFCDHN Cn1nc(CC[NH2+]Cc2ccccc2[O-])c2ccccc21 ZINC000187389547 648974773 /nfs/dbraw/zinc/97/47/73/648974773.db2.gz CEJNVWTVPUQJJC-UHFFFAOYSA-N 0 3 281.359 2.611 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000721417636 770137114 /nfs/dbraw/zinc/13/71/14/770137114.db2.gz RHSLNQBYXLPMNM-JQWIXIFHSA-N 0 3 275.270 2.592 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@@H]2COCC[C@@H]2C1 ZINC000723661166 770643538 /nfs/dbraw/zinc/64/35/38/770643538.db2.gz RAHKURLKUZVHTI-BPLDGKMQSA-N 0 3 261.365 2.687 20 10 CFCDHN CC[NH+](CC)[C@H]1CCN(Cc2ccc(Cl)cc2[O-])C1 ZINC001140465372 770684509 /nfs/dbraw/zinc/68/45/09/770684509.db2.gz KTLROVPZARDBGW-AWEZNQCLSA-N 0 3 282.815 2.962 20 10 CFCDHN CC[NH+](CC)[C@@H]1CCN(Cc2ccc(Cl)cc2[O-])C1 ZINC001140465373 770684398 /nfs/dbraw/zinc/68/43/98/770684398.db2.gz KTLROVPZARDBGW-CQSZACIVSA-N 0 3 282.815 2.962 20 10 CFCDHN Cc1c(O)ccc(CN2CC(C)(C)OC(C)(C)C2)c1O ZINC001140748336 775395889 /nfs/dbraw/zinc/39/58/89/775395889.db2.gz WIUBFFFGODRVAE-UHFFFAOYSA-N 0 3 279.380 2.796 20 10 CFCDHN C[C@H]1CCN(Cc2ccc(N(C)C)cc2Cl)CC[C@H]1O ZINC001140921481 775651352 /nfs/dbraw/zinc/65/13/52/775651352.db2.gz FIYCRXPSCWPNJA-BLLLJJGKSA-N 0 3 296.842 2.999 20 10 CFCDHN COc1ccc(C[N@@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC000711475650 777209671 /nfs/dbraw/zinc/20/96/71/777209671.db2.gz JTWPZNXUFDVNLX-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN COc1ccc(C[N@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC000711475650 777209680 /nfs/dbraw/zinc/20/96/80/777209680.db2.gz JTWPZNXUFDVNLX-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001231589208 777268190 /nfs/dbraw/zinc/26/81/90/777268190.db2.gz FSCQFPRLZWEHJI-ZIAGYGMSSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001231589208 777268192 /nfs/dbraw/zinc/26/81/92/777268192.db2.gz FSCQFPRLZWEHJI-ZIAGYGMSSA-N 0 3 269.344 2.909 20 10 CFCDHN Oc1ccc2ccccc2c1CN1C[C@H]2CC[C@@H]1CO2 ZINC001231589208 777268200 /nfs/dbraw/zinc/26/82/00/777268200.db2.gz FSCQFPRLZWEHJI-ZIAGYGMSSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCC[C@H](O)C1 ZINC001231588918 777268407 /nfs/dbraw/zinc/26/84/07/777268407.db2.gz ZDTBEKFSSBTHRI-AWEZNQCLSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCC[C@H](O)C1 ZINC001231588918 777268412 /nfs/dbraw/zinc/26/84/12/777268412.db2.gz ZDTBEKFSSBTHRI-AWEZNQCLSA-N 0 3 271.360 2.892 20 10 CFCDHN Cc1cccc(CN2CCc3cnccc3C2)c1O ZINC001231590998 777272139 /nfs/dbraw/zinc/27/21/39/777272139.db2.gz NKZGBHHCQQHMIA-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001231841872 777344757 /nfs/dbraw/zinc/34/47/57/777344757.db2.gz FIMOKORUQUXCST-WMLDXEAASA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001231841872 777344764 /nfs/dbraw/zinc/34/47/64/777344764.db2.gz FIMOKORUQUXCST-WMLDXEAASA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001231842787 777346621 /nfs/dbraw/zinc/34/66/21/777346621.db2.gz PTMYZBNOXDMAEK-PBHICJAKSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001231842787 777346627 /nfs/dbraw/zinc/34/66/27/777346627.db2.gz PTMYZBNOXDMAEK-PBHICJAKSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]3C[N@@H+](C)C[C@H]32)cc1Cl ZINC001231871087 777358502 /nfs/dbraw/zinc/35/85/02/777358502.db2.gz XZJLPHMIEIASSC-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]3C[N@H+](C)C[C@H]32)cc1Cl ZINC001231871087 777358505 /nfs/dbraw/zinc/35/85/05/777358505.db2.gz XZJLPHMIEIASSC-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN COC(=O)c1c(CN2CCC[C@@H]2C)c2ccccc2n1C ZINC001232402601 777549509 /nfs/dbraw/zinc/54/95/09/777549509.db2.gz YRYJNXIIXSBFAW-LBPRGKRZSA-N 0 3 286.375 2.949 20 10 CFCDHN COC(=O)c1c(CN2CCCCC2)c2ccccc2n1C ZINC001232401150 777549519 /nfs/dbraw/zinc/54/95/19/777549519.db2.gz HBCMOIPXENKBFY-UHFFFAOYSA-N 0 3 286.375 2.951 20 10 CFCDHN CCN(Cc1cnc(C)[nH]1)Cc1ccc(N(C)C)cc1 ZINC001232465412 777570137 /nfs/dbraw/zinc/57/01/37/777570137.db2.gz LXHPFCKRWATIBR-UHFFFAOYSA-N 0 3 272.396 2.806 20 10 CFCDHN CCOC(=O)c1c(CN2C[C@@H]3C[C@@H]3C2)c2ccccc2n1C ZINC001233271428 777857076 /nfs/dbraw/zinc/85/70/76/777857076.db2.gz YZCFJDBBWOCIKF-BETUJISGSA-N 0 3 298.386 2.807 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001233287900 777870132 /nfs/dbraw/zinc/87/01/32/777870132.db2.gz MFGYTKNWJGBSIR-MEBBXXQBSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001233287900 777870133 /nfs/dbraw/zinc/87/01/33/777870133.db2.gz MFGYTKNWJGBSIR-MEBBXXQBSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@@](C)(O)[C@H](C)C2)c1O ZINC001233287900 777870139 /nfs/dbraw/zinc/87/01/39/777870139.db2.gz MFGYTKNWJGBSIR-MEBBXXQBSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1ccc2ccc([O-])c(C[NH+]3CC(C4COC4)C3)c2c1 ZINC001234518794 778242423 /nfs/dbraw/zinc/24/24/23/778242423.db2.gz NELRBIOTSMCCFP-UHFFFAOYSA-N 0 3 299.370 2.632 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@H](C(C)=O)C3)c2c1 ZINC001234570413 778255491 /nfs/dbraw/zinc/25/54/91/778255491.db2.gz ZPTPBRNRSSTGJU-AWEZNQCLSA-N 0 3 299.370 2.965 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@H](C(C)=O)C3)c2c1 ZINC001234570413 778255497 /nfs/dbraw/zinc/25/54/97/778255497.db2.gz ZPTPBRNRSSTGJU-AWEZNQCLSA-N 0 3 299.370 2.965 20 10 CFCDHN Cc1cc([O-])c(CN2CCCCC23C[NH2+]C3)cc1Cl ZINC001235101448 778380755 /nfs/dbraw/zinc/38/07/55/778380755.db2.gz GKRRCCKUWBESTP-UHFFFAOYSA-N 0 3 280.799 2.682 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](CO)C2)c([O-])c1 ZINC001235676954 778534142 /nfs/dbraw/zinc/53/41/42/778534142.db2.gz YPKMNMMBCCRMMO-CYBMUJFWSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H](CO)C2)c([O-])c1 ZINC001235676954 778534146 /nfs/dbraw/zinc/53/41/46/778534146.db2.gz YPKMNMMBCCRMMO-CYBMUJFWSA-N 0 3 277.408 2.894 20 10 CFCDHN [O-]c1cccc(F)c1C[N@@H+]1CCN[C@@H](c2ccccc2)C1 ZINC001235858671 778583068 /nfs/dbraw/zinc/58/30/68/778583068.db2.gz IJNJYSOFALTQSE-MRXNPFEDSA-N 0 3 286.350 2.678 20 10 CFCDHN [O-]c1cccc(F)c1C[N@H+]1CCN[C@@H](c2ccccc2)C1 ZINC001235858671 778583072 /nfs/dbraw/zinc/58/30/72/778583072.db2.gz IJNJYSOFALTQSE-MRXNPFEDSA-N 0 3 286.350 2.678 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H]2CCC[C@@H](C1)N2 ZINC001236093047 778687872 /nfs/dbraw/zinc/68/78/72/778687872.db2.gz LQWVSQBJBHBNGW-GASCZTMLSA-N 0 3 282.387 2.872 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H]2CCC[C@@H](C1)N2 ZINC001236093047 778687874 /nfs/dbraw/zinc/68/78/74/778687874.db2.gz LQWVSQBJBHBNGW-GASCZTMLSA-N 0 3 282.387 2.872 20 10 CFCDHN C[N@H+](Cc1cc(O)c(Br)cc1[O-])CC1CC1 ZINC001236771448 778931591 /nfs/dbraw/zinc/93/15/91/778931591.db2.gz AQCKCGZDDKQNSY-UHFFFAOYSA-N 0 3 286.169 2.702 20 10 CFCDHN C[N@@H+](Cc1cc(O)c(Br)cc1[O-])CC1CC1 ZINC001236771448 778931586 /nfs/dbraw/zinc/93/15/86/778931586.db2.gz AQCKCGZDDKQNSY-UHFFFAOYSA-N 0 3 286.169 2.702 20 10 CFCDHN CC(C)[N@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236773096 778931991 /nfs/dbraw/zinc/93/19/91/778931991.db2.gz NKORWDXNNZAPMN-UHFFFAOYSA-N 0 3 274.158 2.701 20 10 CFCDHN CC(C)[N@@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236773096 778931996 /nfs/dbraw/zinc/93/19/96/778931996.db2.gz NKORWDXNNZAPMN-UHFFFAOYSA-N 0 3 274.158 2.701 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236782382 778933302 /nfs/dbraw/zinc/93/33/02/778933302.db2.gz ATZDCZZGTQSGJL-RDJZCZTQSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236782382 778933305 /nfs/dbraw/zinc/93/33/05/778933305.db2.gz ATZDCZZGTQSGJL-RDJZCZTQSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H](CO)CC[C@H]2C)c([O-])c1 ZINC001236782751 778934257 /nfs/dbraw/zinc/93/42/57/778934257.db2.gz DPVCGAIMHMOTQF-OCCSQVGLSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H](CO)CC[C@H]2C)c([O-])c1 ZINC001236782751 778934261 /nfs/dbraw/zinc/93/42/61/778934261.db2.gz DPVCGAIMHMOTQF-OCCSQVGLSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](C(=O)OC)C[C@H](C)C2)c([O-])c1 ZINC001236787302 778937930 /nfs/dbraw/zinc/93/79/30/778937930.db2.gz ATLXCSFHZJPUMB-SWLSCSKDSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](C(=O)OC)C[C@H](C)C2)c([O-])c1 ZINC001236787302 778937935 /nfs/dbraw/zinc/93/79/35/778937935.db2.gz ATLXCSFHZJPUMB-SWLSCSKDSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H]2C(C)(C)O)c([O-])c1 ZINC001236793389 778939527 /nfs/dbraw/zinc/93/95/27/778939527.db2.gz VWERSPUNAZRRHK-HNNXBMFYSA-N 0 3 263.381 2.690 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)O)c([O-])c1 ZINC001236793389 778939531 /nfs/dbraw/zinc/93/95/31/778939531.db2.gz VWERSPUNAZRRHK-HNNXBMFYSA-N 0 3 263.381 2.690 20 10 CFCDHN CCc1ccc(CN2CCOC[C@H]2C(C)C)c(O)c1 ZINC001236795748 778941004 /nfs/dbraw/zinc/94/10/04/778941004.db2.gz ZPALVYDDVLWADR-HNNXBMFYSA-N 0 3 263.381 2.811 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001236807114 778946654 /nfs/dbraw/zinc/94/66/54/778946654.db2.gz BZHYSLUOBFMVHB-GDZNZVCISA-N 0 3 291.391 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001236807114 778946657 /nfs/dbraw/zinc/94/66/57/778946657.db2.gz BZHYSLUOBFMVHB-GDZNZVCISA-N 0 3 291.391 2.709 20 10 CFCDHN COc1ccc(C[N@H+](C)CCN2CCCC2)c([O-])c1Cl ZINC001236807564 778947321 /nfs/dbraw/zinc/94/73/21/778947321.db2.gz QLENMPZHUGQFQQ-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN COc1ccc(C[N@@H+](C)CCN2CCCC2)c([O-])c1Cl ZINC001236807564 778947323 /nfs/dbraw/zinc/94/73/23/778947323.db2.gz QLENMPZHUGQFQQ-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)CC2CCOCC2)c([O-])c1 ZINC001236808588 778949200 /nfs/dbraw/zinc/94/92/00/778949200.db2.gz QPQDALFGOXKYRE-UHFFFAOYSA-N 0 3 279.380 2.568 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)CC2CCOCC2)c([O-])c1 ZINC001236808588 778949203 /nfs/dbraw/zinc/94/92/03/778949203.db2.gz QPQDALFGOXKYRE-UHFFFAOYSA-N 0 3 279.380 2.568 20 10 CFCDHN COCCC1CC[NH+](Cc2c(C)cc(OC)cc2[O-])CC1 ZINC001236814353 778950540 /nfs/dbraw/zinc/95/05/40/778950540.db2.gz QTCOKHIKKIFAFM-UHFFFAOYSA-N 0 3 293.407 2.958 20 10 CFCDHN COc1cc(C)c(C[NH+]2CCC(F)CC2)c([O-])c1 ZINC001236819061 778954155 /nfs/dbraw/zinc/95/41/55/778954155.db2.gz SMRJMHMAVHIJGM-UHFFFAOYSA-N 0 3 253.317 2.643 20 10 CFCDHN OC[C@H]1C[C@H](F)CN(Cc2cc3ccccc3cc2O)C1 ZINC001236826183 778955621 /nfs/dbraw/zinc/95/56/21/778955621.db2.gz HUTQTKXXGHFJRH-LRDDRELGSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@@H](F)C[C@H](CO)C1 ZINC001236826183 778955625 /nfs/dbraw/zinc/95/56/25/778955625.db2.gz HUTQTKXXGHFJRH-LRDDRELGSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@@H](F)C[C@H](CO)C1 ZINC001236826183 778955630 /nfs/dbraw/zinc/95/56/30/778955630.db2.gz HUTQTKXXGHFJRH-LRDDRELGSA-N 0 3 289.350 2.698 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])CC[C@H]1O ZINC001236827838 778956655 /nfs/dbraw/zinc/95/66/55/778956655.db2.gz VRAAYYVXIMVEJB-MLGOLLRUSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])CC[C@H]1O ZINC001236827838 778956658 /nfs/dbraw/zinc/95/66/58/778956658.db2.gz VRAAYYVXIMVEJB-MLGOLLRUSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827981 778956805 /nfs/dbraw/zinc/95/68/05/778956805.db2.gz YGYMACUZSDRUJL-ABAIWWIYSA-N 0 3 257.333 2.501 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827981 778956810 /nfs/dbraw/zinc/95/68/10/778956810.db2.gz YGYMACUZSDRUJL-ABAIWWIYSA-N 0 3 257.333 2.501 20 10 CFCDHN CCOc1ccc(CN2CC(c3cccnc3)C2)c(O)c1 ZINC001237042017 778996348 /nfs/dbraw/zinc/99/63/48/778996348.db2.gz COYDWXRVYSJRSB-UHFFFAOYSA-N 0 3 284.359 2.785 20 10 CFCDHN CCOc1ccc(C[NH+]2CC(c3cccnc3)C2)c([O-])c1 ZINC001237042017 778996350 /nfs/dbraw/zinc/99/63/50/778996350.db2.gz COYDWXRVYSJRSB-UHFFFAOYSA-N 0 3 284.359 2.785 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCOC[C@H](C)C2)c([O-])c1 ZINC001237046662 778998419 /nfs/dbraw/zinc/99/84/19/778998419.db2.gz VDFAGTKSKYGXON-CYBMUJFWSA-N 0 3 263.381 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCOC[C@H](C)C2)c([O-])c1 ZINC001237046662 778998425 /nfs/dbraw/zinc/99/84/25/778998425.db2.gz VDFAGTKSKYGXON-CYBMUJFWSA-N 0 3 263.381 2.984 20 10 CFCDHN CCOc1ccc(CN2CCC[C@@H]2CF)c(O)c1 ZINC001237046322 778999188 /nfs/dbraw/zinc/99/91/88/778999188.db2.gz AKKSOFNDHJICNK-GFCCVEGCSA-N 0 3 253.317 2.725 20 10 CFCDHN CC(C)c1ccc(C[N@H+](C)CC2(C)COC2)c([O-])c1 ZINC001237053408 779000342 /nfs/dbraw/zinc/00/03/42/779000342.db2.gz LJJQBJUMDASKMV-UHFFFAOYSA-N 0 3 263.381 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@@H+](C)CC2(C)COC2)c([O-])c1 ZINC001237053408 779000350 /nfs/dbraw/zinc/00/03/50/779000350.db2.gz LJJQBJUMDASKMV-UHFFFAOYSA-N 0 3 263.381 2.984 20 10 CFCDHN CCNC(=O)[C@@H]1CCCN1Cc1ccc(C(C)C)cc1O ZINC001237050908 779001155 /nfs/dbraw/zinc/00/11/55/779001155.db2.gz FTEVMTGFSCGRKN-HNNXBMFYSA-N 0 3 290.407 2.616 20 10 CFCDHN CN(C)c1ccc(CN2CCNC3=CCCC[C@@H]32)cc1 ZINC001237218112 779050803 /nfs/dbraw/zinc/05/08/03/779050803.db2.gz FJMDVTKVBMLPDQ-KRWDZBQOSA-N 0 3 271.408 2.594 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237383092 779087754 /nfs/dbraw/zinc/08/77/54/779087754.db2.gz OCZFZUAQWWFZGR-SMDDNHRTSA-N 0 3 280.799 2.620 20 10 CFCDHN CCOC(=O)CC[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC001237686122 779161163 /nfs/dbraw/zinc/16/11/63/779161163.db2.gz HMIKUSAGKASHIZ-UHFFFAOYSA-N 0 3 285.771 2.739 20 10 CFCDHN CCOC(=O)CC[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC001237686122 779161167 /nfs/dbraw/zinc/16/11/67/779161167.db2.gz HMIKUSAGKASHIZ-UHFFFAOYSA-N 0 3 285.771 2.739 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2CO)c1[O-] ZINC001237685993 779161350 /nfs/dbraw/zinc/16/13/50/779161350.db2.gz SFYLSEGOEKNCSL-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2CO)c1[O-] ZINC001237685993 779161354 /nfs/dbraw/zinc/16/13/54/779161354.db2.gz SFYLSEGOEKNCSL-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCCC[C@@](C)(O)C2)c1[O-] ZINC001238057709 779240669 /nfs/dbraw/zinc/24/06/69/779240669.db2.gz LKPAVUYSMSNARK-OAHLLOKOSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCCC[C@@](C)(O)C2)c1[O-] ZINC001238057709 779240673 /nfs/dbraw/zinc/24/06/73/779240673.db2.gz LKPAVUYSMSNARK-OAHLLOKOSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC(C)(C)C[C@@]2(C)CO)c1[O-] ZINC001238061185 779242862 /nfs/dbraw/zinc/24/28/62/779242862.db2.gz KRVPUAFTIBLBAD-INIZCTEOSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC(C)(C)C[C@@]2(C)CO)c1[O-] ZINC001238061185 779242866 /nfs/dbraw/zinc/24/28/66/779242866.db2.gz KRVPUAFTIBLBAD-INIZCTEOSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c1[O-] ZINC001238060389 779243043 /nfs/dbraw/zinc/24/30/43/779243043.db2.gz HRCWWYSJCKNOCK-SLEUVZQESA-N 0 3 279.355 2.839 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c1[O-] ZINC001238060389 779243045 /nfs/dbraw/zinc/24/30/45/779243045.db2.gz HRCWWYSJCKNOCK-SLEUVZQESA-N 0 3 279.355 2.839 20 10 CFCDHN Cc1cc(F)cc(CN2CCC[C@]3(CCC(=O)O3)C2)c1O ZINC001238067296 779243850 /nfs/dbraw/zinc/24/38/50/779243850.db2.gz NPNGSYGBCOEHML-INIZCTEOSA-N 0 3 293.338 2.511 20 10 CFCDHN COC(=O)CC[C@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065873 779244101 /nfs/dbraw/zinc/24/41/01/779244101.db2.gz CEDZHSGMRLTHPY-LBPRGKRZSA-N 0 3 295.354 2.615 20 10 CFCDHN COC(=O)CC[C@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065873 779244106 /nfs/dbraw/zinc/24/41/06/779244106.db2.gz CEDZHSGMRLTHPY-LBPRGKRZSA-N 0 3 295.354 2.615 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@H](C)C1 ZINC001238065844 779244202 /nfs/dbraw/zinc/24/42/02/779244202.db2.gz FQDLTDXBRXLHPR-RISCZKNCSA-N 0 3 267.344 2.839 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@H](C)C1 ZINC001238065844 779244210 /nfs/dbraw/zinc/24/42/10/779244210.db2.gz FQDLTDXBRXLHPR-RISCZKNCSA-N 0 3 267.344 2.839 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(C[C@@H](F)CO3)CC2)c1[O-] ZINC001238070077 779245200 /nfs/dbraw/zinc/24/52/00/779245200.db2.gz MMZJHONLCMHCIL-CQSZACIVSA-N 0 3 297.345 2.933 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236213682 779501857 /nfs/dbraw/zinc/50/18/57/779501857.db2.gz AVPKNTHIBARGDD-QWHCGFSZSA-N 0 3 268.788 2.747 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC001236795365 779638598 /nfs/dbraw/zinc/63/85/98/779638598.db2.gz UZPKWERHRPZXFI-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC001236795365 779638605 /nfs/dbraw/zinc/63/86/05/779638605.db2.gz UZPKWERHRPZXFI-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN C[C@H]1CN(Cc2cc(C(F)(F)F)ccc2O)CC[C@H]1O ZINC001237138122 779665512 /nfs/dbraw/zinc/66/55/12/779665512.db2.gz UBRZTXRTOQYHKD-JOYOIKCWSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])CC[C@H]1O ZINC001237138122 779665517 /nfs/dbraw/zinc/66/55/17/779665517.db2.gz UBRZTXRTOQYHKD-JOYOIKCWSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])CC[C@H]1O ZINC001237138122 779665521 /nfs/dbraw/zinc/66/55/21/779665521.db2.gz UBRZTXRTOQYHKD-JOYOIKCWSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@@H]1CN(Cc2cc(C(F)(F)F)ccc2O)CC[C@@H]1O ZINC001237138127 779665575 /nfs/dbraw/zinc/66/55/75/779665575.db2.gz UBRZTXRTOQYHKD-SKDRFNHKSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])CC[C@@H]1O ZINC001237138127 779665579 /nfs/dbraw/zinc/66/55/79/779665579.db2.gz UBRZTXRTOQYHKD-SKDRFNHKSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])CC[C@@H]1O ZINC001237138127 779665584 /nfs/dbraw/zinc/66/55/84/779665584.db2.gz UBRZTXRTOQYHKD-SKDRFNHKSA-N 0 3 289.297 2.614 20 10 CFCDHN CC(C)CC(=O)NC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC001203555929 780029945 /nfs/dbraw/zinc/02/99/45/780029945.db2.gz JZZDRBNXWLLORO-UHFFFAOYSA-N 0 3 290.407 2.519 20 10 CFCDHN CCN(Cc1ccccc1O)Cc1ccc(C)nc1N ZINC001143207682 780977511 /nfs/dbraw/zinc/97/75/11/780977511.db2.gz CDKPJCQZYVCPQG-UHFFFAOYSA-N 0 3 271.364 2.700 20 10 CFCDHN COC1CCC([NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000703826625 781068111 /nfs/dbraw/zinc/06/81/11/781068111.db2.gz HKHVIYHFJZLVCI-RUXDESIVSA-N 0 3 261.365 2.927 20 10 CFCDHN [NH3+][C@H]1CCCCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000709009616 781287256 /nfs/dbraw/zinc/28/72/56/781287256.db2.gz VUOKAGAEHLXLAR-ZDUSSCGKSA-N 0 3 268.788 2.749 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])C(C)(C)O ZINC000295001364 199293821 /nfs/dbraw/zinc/29/38/21/199293821.db2.gz MAOQJBXQQKVQKI-FZMZJTMJSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297498042 282301088 /nfs/dbraw/zinc/30/10/88/282301088.db2.gz BUEMRYRIVRXXSL-IINYFYTJSA-N 0 3 271.364 2.772 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC[C@H](C)CCO)c([O-])c1 ZINC000295121659 199356426 /nfs/dbraw/zinc/35/64/26/199356426.db2.gz NGXHHHBYQIYEAD-ZDUSSCGKSA-N 0 3 281.396 2.679 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC[C@@H](C)CCO)c([O-])c1 ZINC000295121658 199356648 /nfs/dbraw/zinc/35/66/48/199356648.db2.gz NGXHHHBYQIYEAD-CYBMUJFWSA-N 0 3 281.396 2.679 20 10 CFCDHN OCC[C@@H](NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000077468396 347194004 /nfs/dbraw/zinc/19/40/04/347194004.db2.gz HNEDLOYNUQRVRQ-QGZVFWFLSA-N 0 3 283.371 2.835 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)CCc1ccccc1)CC2 ZINC000296515751 199917489 /nfs/dbraw/zinc/91/74/89/199917489.db2.gz QSIFBPAJMBGGPI-IRXDYDNUSA-N 0 3 297.398 2.963 20 10 CFCDHN C[C@H](O)CC(C)(C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296815084 200005710 /nfs/dbraw/zinc/00/57/10/200005710.db2.gz MAAXENINJISPJZ-AAEUAGOBSA-N 0 3 263.381 2.766 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000297037240 200068578 /nfs/dbraw/zinc/06/85/78/200068578.db2.gz UZWWYWVAUJHSNF-CZUORRHYSA-N 0 3 275.392 2.766 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)CC2 ZINC000297161753 200102021 /nfs/dbraw/zinc/10/20/21/200102021.db2.gz CWGCZJCPVDDQAP-JKSUJKDBSA-N 0 3 283.371 2.573 20 10 CFCDHN C[C@@H](CCO)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000297378493 200168085 /nfs/dbraw/zinc/16/80/85/200168085.db2.gz QVJJJNFCXUTIBC-GHMZBOCLSA-N 0 3 255.333 2.591 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(CCO)CCCC1)CC2 ZINC000297885832 200298990 /nfs/dbraw/zinc/29/89/90/200298990.db2.gz VJCKXIIVLJHNLJ-AWEZNQCLSA-N 0 3 275.392 2.912 20 10 CFCDHN COc1ccc(CC[NH2+]Cc2cc(OC)ccc2[O-])cc1 ZINC000020088175 372227192 /nfs/dbraw/zinc/22/71/92/372227192.db2.gz OCKYYPWNSHCNQY-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000038013867 372768112 /nfs/dbraw/zinc/76/81/12/372768112.db2.gz QTYUKHKMTPEAMA-OLZOCXBDSA-N 0 3 278.396 2.656 20 10 CFCDHN C[C@@H]1CCCC[C@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879273 372963699 /nfs/dbraw/zinc/96/36/99/372963699.db2.gz XFNRBTYFQFULRZ-ZYHUDNBSSA-N 0 3 263.337 2.789 20 10 CFCDHN CC[C@@H](C)[C@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880444 372963861 /nfs/dbraw/zinc/96/38/61/372963861.db2.gz ZKMICAGICRMYKU-ZJUUUORDSA-N 0 3 251.326 2.645 20 10 CFCDHN CCN(CC)CCC[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000062744884 373765698 /nfs/dbraw/zinc/76/56/98/373765698.db2.gz WGQKDNRQHBAELM-LBPRGKRZSA-N 0 3 268.376 2.914 20 10 CFCDHN CC[NH+](CC)CCCN[C@@H](C)c1ccc(F)cc1[O-] ZINC000062744884 373765706 /nfs/dbraw/zinc/76/57/06/373765706.db2.gz WGQKDNRQHBAELM-LBPRGKRZSA-N 0 3 268.376 2.914 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000092325871 375101692 /nfs/dbraw/zinc/10/16/92/375101692.db2.gz ZLSPJMBPANOVSP-NSHDSACASA-N 0 3 273.380 2.902 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2cccc(OC)c2[O-])C1 ZINC000093419325 375233717 /nfs/dbraw/zinc/23/37/17/375233717.db2.gz CANWXCUVEQXEMC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2cccc(OC)c2[O-])C1 ZINC000093419325 375233722 /nfs/dbraw/zinc/23/37/22/375233722.db2.gz CANWXCUVEQXEMC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000093686747 375295483 /nfs/dbraw/zinc/29/54/83/375295483.db2.gz JREWWDQQCMAQPF-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000093686747 375295488 /nfs/dbraw/zinc/29/54/88/375295488.db2.gz JREWWDQQCMAQPF-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000112960126 375978721 /nfs/dbraw/zinc/97/87/21/375978721.db2.gz MFMIEOAXOMZYMU-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000112960126 375978725 /nfs/dbraw/zinc/97/87/25/375978725.db2.gz MFMIEOAXOMZYMU-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN COc1ccc(N2CCCN(Cc3ccncc3)CC2)cc1 ZINC000118888586 376321644 /nfs/dbraw/zinc/32/16/44/376321644.db2.gz DCSPCIGCDGQIOZ-UHFFFAOYSA-N 0 3 297.402 2.803 20 10 CFCDHN CN(C)[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2[O-])C1 ZINC000124586482 377066985 /nfs/dbraw/zinc/06/69/85/377066985.db2.gz JTMXNOICOFTPJO-GFCCVEGCSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(C)[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2[O-])C1 ZINC000124586482 377066991 /nfs/dbraw/zinc/06/69/91/377066991.db2.gz JTMXNOICOFTPJO-GFCCVEGCSA-N 0 3 268.788 2.572 20 10 CFCDHN Cc1cccc(C[NH2+]CCOCCC(C)C)c1[O-] ZINC000124747290 377084313 /nfs/dbraw/zinc/08/43/13/377084313.db2.gz WLXUSRYAIXOKSV-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN C[C@H](N[C@@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1[O-] ZINC000530216072 328716708 /nfs/dbraw/zinc/71/67/08/328716708.db2.gz MHVMHLNUPKELPO-IINYFYTJSA-N 0 3 280.799 2.981 20 10 CFCDHN CCOc1cccc(C[N@H+](C[C@@H]2CCOC2)C2CC2)c1[O-] ZINC000129962813 377495379 /nfs/dbraw/zinc/49/53/79/377495379.db2.gz VRLCACICDCCBSC-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c1[O-] ZINC000129962813 377495389 /nfs/dbraw/zinc/49/53/89/377495389.db2.gz VRLCACICDCCBSC-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(Cl)cc(CN(C)[C@H](C)C[S@](C)=O)c1O ZINC000130949937 377635025 /nfs/dbraw/zinc/63/50/25/377635025.db2.gz FSUFVVHBEMOGCX-MLCYQJTMSA-N 0 3 289.828 2.553 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCN(CC(F)(F)F)CC1 ZINC000134232450 377995043 /nfs/dbraw/zinc/99/50/43/377995043.db2.gz KCWGBJJZOQMCMV-UHFFFAOYSA-N 0 3 288.313 2.509 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733612 378161118 /nfs/dbraw/zinc/16/11/18/378161118.db2.gz HDXKOYNSEMNGBA-WCQYABFASA-N 0 3 278.396 2.736 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CC[C@H](CO)CC2)c([O-])c1 ZINC000153153504 378478767 /nfs/dbraw/zinc/47/87/67/378478767.db2.gz BUJFDSCLCHRRST-OTVXOJSOSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000153997886 378531414 /nfs/dbraw/zinc/53/14/14/378531414.db2.gz JQLHITXRPWBGHX-SJKOYZFVSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)c1[O-] ZINC000529567172 383731025 /nfs/dbraw/zinc/73/10/25/383731025.db2.gz IYZMGODUFAJCOK-SWHYSGLUSA-N 0 3 261.365 2.925 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000177224429 380318467 /nfs/dbraw/zinc/31/84/67/380318467.db2.gz RMWKOXLTBPZBSU-SFHVURJKSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000177224429 380318472 /nfs/dbraw/zinc/31/84/72/380318472.db2.gz RMWKOXLTBPZBSU-SFHVURJKSA-N 0 3 299.370 2.930 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CCN2C2CCCC2)c1 ZINC000529668520 383745361 /nfs/dbraw/zinc/74/53/61/383745361.db2.gz GQGYKJYRMRZDFK-HNNXBMFYSA-N 0 3 290.407 2.507 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[N@H+](C)Cc1ccccc1[O-] ZINC000179584264 380560995 /nfs/dbraw/zinc/56/09/95/380560995.db2.gz RCABAPAUDQOVEE-CQSZACIVSA-N 0 3 271.364 2.635 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccccc1[O-] ZINC000179584264 380560998 /nfs/dbraw/zinc/56/09/98/380560998.db2.gz RCABAPAUDQOVEE-CQSZACIVSA-N 0 3 271.364 2.635 20 10 CFCDHN CCOc1cccc(CN2CCSC[C@@H]2C)c1O ZINC000179663288 380568854 /nfs/dbraw/zinc/56/88/54/380568854.db2.gz MFQMKAVOBLSVAO-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@H]1CSCCN1Cc1ccc(N(C)C)cc1 ZINC000179660999 380568917 /nfs/dbraw/zinc/56/89/17/380568917.db2.gz CUISMPOEVHVMGD-LBPRGKRZSA-N 0 3 250.411 2.690 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC(CO)CC2)c1[O-] ZINC000179668614 380570643 /nfs/dbraw/zinc/57/06/43/380570643.db2.gz PWELJZCAKYTJTD-UHFFFAOYSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCCN(C3CC3)CC2)cc1C ZINC000179729841 380573918 /nfs/dbraw/zinc/57/39/18/380573918.db2.gz SNSPMVFZSKTYMJ-UHFFFAOYSA-N 0 3 274.408 2.679 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCCN(C3CC3)CC2)cc1C ZINC000179729841 380573924 /nfs/dbraw/zinc/57/39/24/380573924.db2.gz SNSPMVFZSKTYMJ-UHFFFAOYSA-N 0 3 274.408 2.679 20 10 CFCDHN CC(C)CO[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180273915 380642083 /nfs/dbraw/zinc/64/20/83/380642083.db2.gz BGVGYQUCDRCQHN-CQSZACIVSA-N 0 3 267.344 2.778 20 10 CFCDHN CC(C)CO[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180273915 380642087 /nfs/dbraw/zinc/64/20/87/380642087.db2.gz BGVGYQUCDRCQHN-CQSZACIVSA-N 0 3 267.344 2.778 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)NCc1ccccc1 ZINC000179878553 380591206 /nfs/dbraw/zinc/59/12/06/380591206.db2.gz TWKDNFKBYFXDCK-UONOGXRCSA-N 0 3 298.386 2.748 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCO[C@@H](C)C2)c1[O-] ZINC000180028203 380611611 /nfs/dbraw/zinc/61/16/11/380611611.db2.gz RLJDBGDMADULSF-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCO[C@@H](C)C2)c1[O-] ZINC000180028203 380611619 /nfs/dbraw/zinc/61/16/19/380611619.db2.gz RLJDBGDMADULSF-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(Cc3nccn3C)CC2)c1[O-] ZINC000180115960 380621585 /nfs/dbraw/zinc/62/15/85/380621585.db2.gz PMMSSXCHTOUOEK-UHFFFAOYSA-N 0 3 299.418 2.889 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000180172289 380628300 /nfs/dbraw/zinc/62/83/00/380628300.db2.gz LQCVIMUJMSQANP-LBPRGKRZSA-N 0 3 255.358 2.859 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000180172289 380628302 /nfs/dbraw/zinc/62/83/02/380628302.db2.gz LQCVIMUJMSQANP-LBPRGKRZSA-N 0 3 255.358 2.859 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c1[O-] ZINC000180719506 380693756 /nfs/dbraw/zinc/69/37/56/380693756.db2.gz MHBURWIVCZGLOK-XJKSGUPXSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c1[O-] ZINC000180719506 380693761 /nfs/dbraw/zinc/69/37/61/380693761.db2.gz MHBURWIVCZGLOK-XJKSGUPXSA-N 0 3 285.391 2.980 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000180739157 380695053 /nfs/dbraw/zinc/69/50/53/380695053.db2.gz ALHKPGSMFUSHIM-INIZCTEOSA-N 0 3 275.323 2.529 20 10 CFCDHN C[C@](CO)([NH2+]Cc1cc(F)ccc1[O-])C1CCCCC1 ZINC000180770591 380698395 /nfs/dbraw/zinc/69/83/95/380698395.db2.gz NYYHIKGBDWFLEG-MRXNPFEDSA-N 0 3 281.371 2.952 20 10 CFCDHN CC[C@@H]([NH2+]CCC1(O)CCOCC1)c1ccc(C)cc1[O-] ZINC000287565401 380868491 /nfs/dbraw/zinc/86/84/91/380868491.db2.gz QHSLUFUXEJCQHX-OAHLLOKOSA-N 0 3 293.407 2.673 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccccc1[O-] ZINC000368103619 380927462 /nfs/dbraw/zinc/92/74/62/380927462.db2.gz XLQWJUNDWLBTJM-YPMHNXCESA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccccc1[O-] ZINC000368103619 380927471 /nfs/dbraw/zinc/92/74/71/380927471.db2.gz XLQWJUNDWLBTJM-YPMHNXCESA-N 0 3 271.364 2.714 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4cc(C)c(C)cc4[O-])[C@H]1[C@H]3C2 ZINC000289264607 381027678 /nfs/dbraw/zinc/02/76/78/381027678.db2.gz FWAGFLUBELVIGB-YARXLOAZSA-N 0 3 287.403 2.864 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4cc(C)c(C)cc4[O-])[C@H]1[C@H]3C2 ZINC000289264607 381027688 /nfs/dbraw/zinc/02/76/88/381027688.db2.gz FWAGFLUBELVIGB-YARXLOAZSA-N 0 3 287.403 2.864 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@@H](C)C2)c1 ZINC000182449886 381091150 /nfs/dbraw/zinc/09/11/50/381091150.db2.gz OFXQEQFZGCLCIQ-KGLIPLIRSA-N 0 3 292.423 2.783 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc3c(c1)OCO3)CC2 ZINC000295816714 381095131 /nfs/dbraw/zinc/09/51/31/381095131.db2.gz DAQRIKJFRRAORZ-ZDUSSCGKSA-N 0 3 283.327 2.898 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1cn3ccccc3n1)CC2 ZINC000295872206 381127914 /nfs/dbraw/zinc/12/79/14/381127914.db2.gz HDRIWNJLIFZWRI-OAHLLOKOSA-N 0 3 293.370 2.860 20 10 CFCDHN Cc1noc(C)c1CN[C@@H]1CCc2cccc(O)c21 ZINC000295952427 381178574 /nfs/dbraw/zinc/17/85/74/381178574.db2.gz LPPNNKPWNNZEBJ-CYBMUJFWSA-N 0 3 258.321 2.774 20 10 CFCDHN CC[C@H]([NH2+]CCCc1cnn(C)c1)c1ccccc1[O-] ZINC000183323312 381253628 /nfs/dbraw/zinc/25/36/28/381253628.db2.gz USNBINZUMUQRSI-HNNXBMFYSA-N 0 3 273.380 2.799 20 10 CFCDHN CC(C)C[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)N(C)C ZINC000296101333 381255125 /nfs/dbraw/zinc/25/51/25/381255125.db2.gz UITSQHBUSBYSAL-GJZGRUSLSA-N 0 3 276.424 2.945 20 10 CFCDHN CCCN1CC[C@H](C[NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000183440785 381271095 /nfs/dbraw/zinc/27/10/95/381271095.db2.gz LOPBFDOOJCRCFI-UONOGXRCSA-N 0 3 262.397 2.775 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1[O-] ZINC000183544888 381286382 /nfs/dbraw/zinc/28/63/82/381286382.db2.gz NACKIHOXALDXRF-MCIONIFRSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(CO)c(F)c1)c1ccccc1[O-] ZINC000183443218 381273372 /nfs/dbraw/zinc/27/33/72/381273372.db2.gz UKFSMKWDITWZMF-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN COc1cc([O-])c(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1OC ZINC000183462553 381275598 /nfs/dbraw/zinc/27/55/98/381275598.db2.gz VHUJPOKGWDSHRO-VXGBXAGGSA-N 0 3 279.380 2.887 20 10 CFCDHN C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1cc(F)ccc1[O-] ZINC000296310973 381342558 /nfs/dbraw/zinc/34/25/58/381342558.db2.gz GJXKDIDLDNYWGJ-NDNKKMJESA-N 0 3 278.371 2.807 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC(C)(CO)CC2)cc1C ZINC000184066574 381366014 /nfs/dbraw/zinc/36/60/14/381366014.db2.gz JKAUPQSFLKKMBO-UHFFFAOYSA-N 0 3 263.381 2.603 20 10 CFCDHN CC[C@@H](NCc1n[nH]c(C2CC2)n1)c1ccc(N(C)C)cc1 ZINC000296541764 381441360 /nfs/dbraw/zinc/44/13/60/381441360.db2.gz RALNKBNDWGSNBX-OAHLLOKOSA-N 0 3 299.422 2.989 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)[C@H]2CCSC2)c1[O-] ZINC000184678932 381458512 /nfs/dbraw/zinc/45/85/12/381458512.db2.gz BVLBOPOWWWJINC-NSHDSACASA-N 0 3 287.812 2.992 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCSC2)c1[O-] ZINC000184678932 381458516 /nfs/dbraw/zinc/45/85/16/381458516.db2.gz BVLBOPOWWWJINC-NSHDSACASA-N 0 3 287.812 2.992 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@@H](O)C(F)F ZINC000296654786 381492913 /nfs/dbraw/zinc/49/29/13/381492913.db2.gz ZFPNUXJSJFYLRU-XHVZSJERSA-N 0 3 273.323 2.756 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H]2c3ccccc3C[C@@H]2O)c1 ZINC000185122292 381541056 /nfs/dbraw/zinc/54/10/56/381541056.db2.gz MYRQYUSMWNDKJE-CNOZUTPLSA-N 0 3 299.370 2.710 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1nccs1)CC2 ZINC000297913853 381575907 /nfs/dbraw/zinc/57/59/07/381575907.db2.gz WTFURVLTVYQGIO-LLVKDONJSA-N 0 3 260.362 2.668 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297498045 381563166 /nfs/dbraw/zinc/56/31/66/381563166.db2.gz BUEMRYRIVRXXSL-QMTHXVAHSA-N 0 3 271.364 2.772 20 10 CFCDHN CN(C)c1cccnc1CN[C@@H]1CCc2cccc(O)c21 ZINC000297486684 381564011 /nfs/dbraw/zinc/56/40/11/381564011.db2.gz ZRXQBBWNHRAXIT-CYBMUJFWSA-N 0 3 283.375 2.630 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297562441 381565154 /nfs/dbraw/zinc/56/51/54/381565154.db2.gz GFQNAGKOCNUJNS-WFASDCNBSA-N 0 3 285.391 2.810 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1cccc(O)c1)CC2 ZINC000297664082 381569822 /nfs/dbraw/zinc/56/98/22/381569822.db2.gz KRYMHYCOGPVKPV-CQSZACIVSA-N 0 3 255.317 2.875 20 10 CFCDHN C[C@@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1cc(F)ccc1[O-] ZINC000185475949 381643747 /nfs/dbraw/zinc/64/37/47/381643747.db2.gz FENRVFJTBQCQPB-GIGQVBGESA-N 0 3 287.400 2.729 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CCO)c([O-])c1 ZINC000185609148 381680206 /nfs/dbraw/zinc/68/02/06/381680206.db2.gz GQMAJQUISCZDEZ-GFCCVEGCSA-N 0 3 251.370 2.760 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185637076 381689843 /nfs/dbraw/zinc/68/98/43/381689843.db2.gz GZILWYVFQSRSHL-UHFFFAOYSA-N 0 3 283.371 2.876 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCOCC1(C)C)c1ccccc1[O-] ZINC000186169138 381841887 /nfs/dbraw/zinc/84/18/87/381841887.db2.gz BRPWXDQJYXTGFR-OAHLLOKOSA-N 0 3 292.423 2.544 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)CCO)c1ccccc1[O-] ZINC000186225137 381858031 /nfs/dbraw/zinc/85/80/31/381858031.db2.gz FSYCVKHRGZHWFP-CYBMUJFWSA-N 0 3 251.370 2.842 20 10 CFCDHN C/C=C/C[C@@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000186505144 381930530 /nfs/dbraw/zinc/93/05/30/381930530.db2.gz MTMJQGBVHGZHMQ-BMPPAVAUSA-N 0 3 253.317 2.509 20 10 CFCDHN Cn1ccnc1[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000373227634 381955104 /nfs/dbraw/zinc/95/51/04/381955104.db2.gz KNOFYVWSBQIBTC-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000373227634 381955108 /nfs/dbraw/zinc/95/51/08/381955108.db2.gz KNOFYVWSBQIBTC-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000362386551 382042515 /nfs/dbraw/zinc/04/25/15/382042515.db2.gz ULRREWDOIPWLCL-APHBMKBZSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000362386551 382042522 /nfs/dbraw/zinc/04/25/22/382042522.db2.gz ULRREWDOIPWLCL-APHBMKBZSA-N 0 3 291.391 2.646 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000373610983 382020681 /nfs/dbraw/zinc/02/06/81/382020681.db2.gz OITUITABGVTWFK-KRWDZBQOSA-N 0 3 291.391 2.552 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000373610983 382020687 /nfs/dbraw/zinc/02/06/87/382020687.db2.gz OITUITABGVTWFK-KRWDZBQOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC000375315660 382079845 /nfs/dbraw/zinc/07/98/45/382079845.db2.gz BQQMKMRHPBFNTM-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC000375315660 382079850 /nfs/dbraw/zinc/07/98/50/382079850.db2.gz BQQMKMRHPBFNTM-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](O)C23CCCC3)c1[O-] ZINC000293510963 382150841 /nfs/dbraw/zinc/15/08/41/382150841.db2.gz ADIGUULKDPRGSV-HNNXBMFYSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](O)C23CCCC3)c1[O-] ZINC000293510963 382150847 /nfs/dbraw/zinc/15/08/47/382150847.db2.gz ADIGUULKDPRGSV-HNNXBMFYSA-N 0 3 291.391 2.670 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@@H](O)Cc2ccccc2)c1 ZINC000293822100 382292509 /nfs/dbraw/zinc/29/25/09/382292509.db2.gz FXLFJMBPVUZPAD-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c1 ZINC000293822100 382292513 /nfs/dbraw/zinc/29/25/13/382292513.db2.gz FXLFJMBPVUZPAD-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@@H](O)Cc1ccccc1 ZINC000293820053 382292538 /nfs/dbraw/zinc/29/25/38/382292538.db2.gz FTVCGLGYBJCAMD-INIZCTEOSA-N 0 3 289.350 2.567 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@@H](O)Cc1ccccc1 ZINC000293820053 382292544 /nfs/dbraw/zinc/29/25/44/382292544.db2.gz FTVCGLGYBJCAMD-INIZCTEOSA-N 0 3 289.350 2.567 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000377236947 382240200 /nfs/dbraw/zinc/24/02/00/382240200.db2.gz GWXLGRCVXJWKNJ-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000377236947 382240208 /nfs/dbraw/zinc/24/02/08/382240208.db2.gz GWXLGRCVXJWKNJ-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293814884 382290227 /nfs/dbraw/zinc/29/02/27/382290227.db2.gz RTRMJEKSGARAJZ-KBPBESRZSA-N 0 3 292.423 2.964 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCc2cnn(C)c2)c([O-])c1 ZINC000293751783 382264160 /nfs/dbraw/zinc/26/41/60/382264160.db2.gz OENWACKVEVPLLM-CYBMUJFWSA-N 0 3 273.380 2.636 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293773918 382273998 /nfs/dbraw/zinc/27/39/98/382273998.db2.gz YUKSUVJTRYFOHD-MRXNPFEDSA-N 0 3 273.376 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293773918 382274004 /nfs/dbraw/zinc/27/40/04/382274004.db2.gz YUKSUVJTRYFOHD-MRXNPFEDSA-N 0 3 273.376 2.783 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cc(OC)c(OC)cc1[O-])C(C)C ZINC000188002743 382321552 /nfs/dbraw/zinc/32/15/52/382321552.db2.gz VEPDMOMUEATZSX-CYBMUJFWSA-N 0 3 297.395 2.560 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000188036007 382330246 /nfs/dbraw/zinc/33/02/46/382330246.db2.gz BSQAYNASGPQHJT-NFAWXSAZSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@H](O)Cc2ccccc2)c1 ZINC000293822102 382293464 /nfs/dbraw/zinc/29/34/64/382293464.db2.gz FXLFJMBPVUZPAD-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c1 ZINC000293822102 382293469 /nfs/dbraw/zinc/29/34/69/382293469.db2.gz FXLFJMBPVUZPAD-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cc(CN2CCc3cc[nH]c(=O)c3C2)ccc1N(C)C ZINC000294053949 382396923 /nfs/dbraw/zinc/39/69/23/382396923.db2.gz JPGJQMSRMGBZRX-UHFFFAOYSA-N 0 3 297.402 2.720 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](O)C23CCCC3)c1[O-] ZINC000293989697 382367840 /nfs/dbraw/zinc/36/78/40/382367840.db2.gz RYWOZUWIMBGFBA-AWEZNQCLSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](O)C23CCCC3)c1[O-] ZINC000293989697 382367845 /nfs/dbraw/zinc/36/78/45/382367845.db2.gz RYWOZUWIMBGFBA-AWEZNQCLSA-N 0 3 261.365 2.580 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000365330967 382378166 /nfs/dbraw/zinc/37/81/66/382378166.db2.gz NKSUUCNONCBPKB-LLVKDONJSA-N 0 3 275.348 2.885 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000365330967 382378170 /nfs/dbraw/zinc/37/81/70/382378170.db2.gz NKSUUCNONCBPKB-LLVKDONJSA-N 0 3 275.348 2.885 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](O)CC2)c1[O-] ZINC000294074267 382405354 /nfs/dbraw/zinc/40/53/54/382405354.db2.gz QQBYBJYQQPNSDH-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](O)CC2)c1[O-] ZINC000294074267 382405359 /nfs/dbraw/zinc/40/53/59/382405359.db2.gz QQBYBJYQQPNSDH-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000294228620 382468276 /nfs/dbraw/zinc/46/82/76/382468276.db2.gz ZDKSPFCWTIBYTH-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000294228620 382468278 /nfs/dbraw/zinc/46/82/78/382468278.db2.gz ZDKSPFCWTIBYTH-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN CC(C)(C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1)C(N)=O ZINC000294761234 382526864 /nfs/dbraw/zinc/52/68/64/382526864.db2.gz JDXLUDPWGYRGTN-ZDUSSCGKSA-N 0 3 290.407 2.506 20 10 CFCDHN CC(C)(C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1)C(N)=O ZINC000294761234 382526870 /nfs/dbraw/zinc/52/68/70/382526870.db2.gz JDXLUDPWGYRGTN-ZDUSSCGKSA-N 0 3 290.407 2.506 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])OC ZINC000294320334 382507781 /nfs/dbraw/zinc/50/77/81/382507781.db2.gz WQRLZZMCPKCKFD-QMTHXVAHSA-N 0 3 255.333 2.682 20 10 CFCDHN CCOCc1cc(CN[C@@H](C)[C@H](C)OC)ccc1OC ZINC000189099984 382542233 /nfs/dbraw/zinc/54/22/33/382542233.db2.gz ZDPRVXJTQZSTKJ-STQMWFEESA-N 0 3 281.396 2.745 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1 ZINC000367028873 382556607 /nfs/dbraw/zinc/55/66/07/382556607.db2.gz XQTFDTWAJOSQMF-CYBMUJFWSA-N 0 3 299.374 2.951 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1 ZINC000367028873 382556612 /nfs/dbraw/zinc/55/66/12/382556612.db2.gz XQTFDTWAJOSQMF-CYBMUJFWSA-N 0 3 299.374 2.951 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1C[C@H](C(=O)OC)C(C)(C)C1 ZINC000367316918 382564173 /nfs/dbraw/zinc/56/41/73/382564173.db2.gz FYVAPVCWOGAJTI-KGLIPLIRSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1C[C@H](C(=O)OC)C(C)(C)C1 ZINC000367316918 382564178 /nfs/dbraw/zinc/56/41/78/382564178.db2.gz FYVAPVCWOGAJTI-KGLIPLIRSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C(=O)OC)C(C)(C)C1 ZINC000367316919 382564714 /nfs/dbraw/zinc/56/47/14/382564714.db2.gz FYVAPVCWOGAJTI-UONOGXRCSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@@H](C(=O)OC)C(C)(C)C1 ZINC000367316919 382564718 /nfs/dbraw/zinc/56/47/18/382564718.db2.gz FYVAPVCWOGAJTI-UONOGXRCSA-N 0 3 291.391 2.974 20 10 CFCDHN Cc1ncsc1CC[NH2+]Cc1cc(C)ccc1[O-] ZINC000295074419 382572981 /nfs/dbraw/zinc/57/29/81/382572981.db2.gz RGQGMYXSRAACQP-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccccn1 ZINC000294884654 382538096 /nfs/dbraw/zinc/53/80/96/382538096.db2.gz VYKJWXZUCODMDN-UHFFFAOYSA-N 0 3 274.339 2.994 20 10 CFCDHN CS[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000295129566 382578482 /nfs/dbraw/zinc/57/84/82/382578482.db2.gz XTLGEJIOXXJZPN-GFCCVEGCSA-N 0 3 268.401 2.829 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCSCC[C@H]2C)cc1OC ZINC000189920970 382645384 /nfs/dbraw/zinc/64/53/84/382645384.db2.gz HWRWQFIFARVFDL-LLVKDONJSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCSCC[C@H]2C)cc1OC ZINC000189920970 382645385 /nfs/dbraw/zinc/64/53/85/382645385.db2.gz HWRWQFIFARVFDL-LLVKDONJSA-N 0 3 297.420 2.737 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2C[C@H](O)C2(C)C)c1[O-] ZINC000189966028 382647606 /nfs/dbraw/zinc/64/76/06/382647606.db2.gz WKAMKWXIFMKFML-RYUDHWBXSA-N 0 3 269.772 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H](O)C2(C)C)c1[O-] ZINC000189966008 382647624 /nfs/dbraw/zinc/64/76/24/382647624.db2.gz WKAMKWXIFMKFML-NEPJUHHUSA-N 0 3 269.772 2.603 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])CC1(O)CCCCCC1 ZINC000190138942 382654320 /nfs/dbraw/zinc/65/43/20/382654320.db2.gz WAVLDVUBMGEHSX-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])CC1(O)CCCCCC1 ZINC000190138942 382654321 /nfs/dbraw/zinc/65/43/21/382654321.db2.gz WAVLDVUBMGEHSX-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2(C)OCCCO2)c1 ZINC000190658796 382676561 /nfs/dbraw/zinc/67/65/61/382676561.db2.gz MZYQDRPOPIFKAS-LBPRGKRZSA-N 0 3 265.353 2.504 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H]2c3ccccc3C[C@H]2O)c1 ZINC000248499641 383251763 /nfs/dbraw/zinc/25/17/63/383251763.db2.gz MYRQYUSMWNDKJE-UZCIPKQKSA-N 0 3 299.370 2.710 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000248527922 383253619 /nfs/dbraw/zinc/25/36/19/383253619.db2.gz IFEKNVZZPZUSNS-CHWSQXEVSA-N 0 3 278.396 2.536 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000268968722 384704076 /nfs/dbraw/zinc/70/40/76/384704076.db2.gz LVYJNDJYOCEPRO-AWEZNQCLSA-N 0 3 291.391 2.982 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000281385969 385192162 /nfs/dbraw/zinc/19/21/62/385192162.db2.gz WMIILUIGOGJPLX-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000281385969 385192170 /nfs/dbraw/zinc/19/21/70/385192170.db2.gz WMIILUIGOGJPLX-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@@H]([NH2+]CC1([S@](C)=O)CC1)c1ccc(C)cc1[O-] ZINC000282411504 385303313 /nfs/dbraw/zinc/30/33/13/385303313.db2.gz SDTYSTDNZIABCR-YJYMSZOUSA-N 0 3 281.421 2.652 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)/C=C/CN(C)C ZINC000282581943 385345117 /nfs/dbraw/zinc/34/51/17/385345117.db2.gz WDCDULLYCRMCSW-DHZHZOJOSA-N 0 3 290.407 2.639 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000271218061 385377851 /nfs/dbraw/zinc/37/78/51/385377851.db2.gz FMBGMDXCJBUEJZ-TZMCWYRMSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1[O-] ZINC000271504842 385384292 /nfs/dbraw/zinc/38/42/92/385384292.db2.gz LCXKZFPUCDSLFU-HIFRSBDPSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCn2ccnc2C)c1 ZINC000271773991 385391705 /nfs/dbraw/zinc/39/17/05/385391705.db2.gz DQJVSKDVOZTOAK-GFCCVEGCSA-N 0 3 289.379 2.647 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@](C)(O)C(F)(F)F)c1[O-] ZINC000271785304 385392928 /nfs/dbraw/zinc/39/29/28/385392928.db2.gz FLQONXBZOHNGGX-LLVKDONJSA-N 0 3 297.704 2.757 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CCO)C(C)C)c1[O-] ZINC000271813792 385393649 /nfs/dbraw/zinc/39/36/49/385393649.db2.gz NTQSHLLUQPYDAB-UHFFFAOYSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CCO)C(C)C)c1[O-] ZINC000271813792 385393653 /nfs/dbraw/zinc/39/36/53/385393653.db2.gz NTQSHLLUQPYDAB-UHFFFAOYSA-N 0 3 257.761 2.557 20 10 CFCDHN CCn1cc(C[NH2+]Cc2cc(Cl)cc(C)c2[O-])cn1 ZINC000271817785 385394075 /nfs/dbraw/zinc/39/40/75/385394075.db2.gz MJCNMTQMXULIKV-UHFFFAOYSA-N 0 3 279.771 2.860 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CSC2(C)C)c1 ZINC000282970454 385417595 /nfs/dbraw/zinc/41/75/95/385417595.db2.gz DCZSNCLVSLORBD-TVQRCGJNSA-N 0 3 267.394 2.945 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC(=O)NC23CCC3)c1 ZINC000283346710 385457655 /nfs/dbraw/zinc/45/76/55/385457655.db2.gz MCHKZEFLAYQPIF-WFASDCNBSA-N 0 3 288.391 2.553 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(C)(OC)CC2)c1[O-] ZINC000272350643 385516631 /nfs/dbraw/zinc/51/66/31/385516631.db2.gz KKJFZZMBZMTTDX-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCn2cccn2)c([O-])c1 ZINC000284321471 385547701 /nfs/dbraw/zinc/54/77/01/385547701.db2.gz ZVSAQJSSZHLEHK-CQSZACIVSA-N 0 3 273.380 2.946 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c([O-])c1 ZINC000284909965 385551194 /nfs/dbraw/zinc/55/11/94/385551194.db2.gz COMYUSGYRWANKI-HZSPNIEDSA-N 0 3 261.365 2.597 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@H](O)C2(C)C)c([O-])c1 ZINC000285402649 385555156 /nfs/dbraw/zinc/55/51/56/385555156.db2.gz XGPREKOBOOURGM-YUTCNCBUSA-N 0 3 263.381 2.819 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000272892147 385643931 /nfs/dbraw/zinc/64/39/31/385643931.db2.gz SSTIMZLATRCNTF-SWLSCSKDSA-N 0 3 289.350 2.786 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000273397974 385680625 /nfs/dbraw/zinc/68/06/25/385680625.db2.gz FUHCDDOJSCYLEQ-XJKSGUPXSA-N 0 3 295.354 2.743 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1 ZINC000273502189 385686024 /nfs/dbraw/zinc/68/60/24/385686024.db2.gz QLBCYBHEQGTNRY-BXKDBHETSA-N 0 3 277.286 2.665 20 10 CFCDHN C[C@H]([NH2+]CC1=CCN(C)CC1)c1cc(Cl)ccc1[O-] ZINC000273514754 385686701 /nfs/dbraw/zinc/68/67/01/385686701.db2.gz SHXIWEPFUUKDKI-NSHDSACASA-N 0 3 280.799 2.958 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273583663 385689158 /nfs/dbraw/zinc/68/91/58/385689158.db2.gz NFPQORPOWMJPKM-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H](C)c1cc(Cl)ccc1[O-] ZINC000273582443 385690119 /nfs/dbraw/zinc/69/01/19/385690119.db2.gz MYTHOAWLCQBHBE-SNVBAGLBSA-N 0 3 279.771 2.901 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CO[C@H]2CCOC2)c([O-])c1C ZINC000273598690 385690709 /nfs/dbraw/zinc/69/07/09/385690709.db2.gz RKKVLFQEUVZJSK-QEJZJMRPSA-N 0 3 293.407 2.854 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cc(C)ccc2[O-])[C@]12CCCO2 ZINC000273609492 385691518 /nfs/dbraw/zinc/69/15/18/385691518.db2.gz OBIKUWYUKGGDHW-GVDBMIGSSA-N 0 3 291.391 2.517 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCCCC[C@H]2O)c1 ZINC000287053761 385771166 /nfs/dbraw/zinc/77/11/66/385771166.db2.gz NAVFDENJVVBQIG-DJSGYFEHSA-N 0 3 279.380 2.745 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@H]1CCCCO1)CC2 ZINC000296574938 285396771 /nfs/dbraw/zinc/39/67/71/285396771.db2.gz VJPGWAJWVQHBQZ-KGLIPLIRSA-N 0 3 261.365 2.928 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1COC3(CCCC3)O1)CC2 ZINC000296936260 285396779 /nfs/dbraw/zinc/39/67/79/285396779.db2.gz QDOPNADMNWFZJE-KBPBESRZSA-N 0 3 289.375 2.655 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1COc3ccccc3C1)CC2 ZINC000297502530 285396790 /nfs/dbraw/zinc/39/67/90/285396790.db2.gz CAXUPQCMQDIIDL-GJZGRUSLSA-N 0 3 281.355 2.973 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCO[C@H](COC(C)C)C1 ZINC000372516577 393451041 /nfs/dbraw/zinc/45/10/41/393451041.db2.gz ROXQKCIOGKOTRF-GOEBONIOSA-N 0 3 293.407 2.969 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCO[C@@H](COC(C)C)C1 ZINC000372516575 393451197 /nfs/dbraw/zinc/45/11/97/393451197.db2.gz ROXQKCIOGKOTRF-GDBMZVCRSA-N 0 3 293.407 2.969 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H](c2nnc[nH]2)C1 ZINC000372598861 393452829 /nfs/dbraw/zinc/45/28/29/393452829.db2.gz IOAGOQJLJHSASC-JSGCOSHPSA-N 0 3 286.379 2.841 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H](c2nnc[nH]2)C1 ZINC000372598861 393452830 /nfs/dbraw/zinc/45/28/30/393452830.db2.gz IOAGOQJLJHSASC-JSGCOSHPSA-N 0 3 286.379 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@]1(CO)Cc1ccccc1 ZINC000372757224 393455407 /nfs/dbraw/zinc/45/54/07/393455407.db2.gz KDPBTLOEBRNJHI-IBGZPJMESA-N 0 3 297.398 2.962 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@]1(CO)Cc1ccccc1 ZINC000372757224 393455419 /nfs/dbraw/zinc/45/54/19/393455419.db2.gz KDPBTLOEBRNJHI-IBGZPJMESA-N 0 3 297.398 2.962 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@]1(CO)Cc1ccccc1 ZINC000372757225 393455587 /nfs/dbraw/zinc/45/55/87/393455587.db2.gz KDPBTLOEBRNJHI-LJQANCHMSA-N 0 3 297.398 2.962 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@]1(CO)Cc1ccccc1 ZINC000372757225 393455591 /nfs/dbraw/zinc/45/55/91/393455591.db2.gz KDPBTLOEBRNJHI-LJQANCHMSA-N 0 3 297.398 2.962 20 10 CFCDHN C[C@H](C[S@](C)=O)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000186540707 393546565 /nfs/dbraw/zinc/54/65/65/393546565.db2.gz CBFBCQGSPAZHES-JGRMJRGVSA-N 0 3 295.448 2.689 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)[C@@H](N)c1ccccc1 ZINC000237576231 393794421 /nfs/dbraw/zinc/79/44/21/393794421.db2.gz GMVBPLPGBFTCFA-CXAGYDPISA-N 0 3 298.386 2.687 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)[C@@H]1CCOC1 ZINC000106857955 393868082 /nfs/dbraw/zinc/86/80/82/393868082.db2.gz HMFQXAQMAVSYHH-CYBMUJFWSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)[C@@H]1CCOC1 ZINC000106857955 393868086 /nfs/dbraw/zinc/86/80/86/393868086.db2.gz HMFQXAQMAVSYHH-CYBMUJFWSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@H+](CCCOCC(F)(F)F)Cc1ccccc1[O-] ZINC000109772802 393879775 /nfs/dbraw/zinc/87/97/75/393879775.db2.gz LLTIEPGMCFQLBL-UHFFFAOYSA-N 0 3 277.286 2.793 20 10 CFCDHN C[N@@H+](CCCOCC(F)(F)F)Cc1ccccc1[O-] ZINC000109772802 393879776 /nfs/dbraw/zinc/87/97/76/393879776.db2.gz LLTIEPGMCFQLBL-UHFFFAOYSA-N 0 3 277.286 2.793 20 10 CFCDHN C[C@@H]([NH2+]CCc1cn2c(n1)SCC2)c1ccccc1[O-] ZINC000274371879 394041948 /nfs/dbraw/zinc/04/19/48/394041948.db2.gz KWYOTBVNBXWLQF-LLVKDONJSA-N 0 3 289.404 2.588 20 10 CFCDHN CCCC[N@H+](CCn1cccn1)Cc1ccccc1[O-] ZINC000282383881 394123996 /nfs/dbraw/zinc/12/39/96/394123996.db2.gz GDEJEYYMMPUXSX-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN CCCC[N@@H+](CCn1cccn1)Cc1ccccc1[O-] ZINC000282383881 394123997 /nfs/dbraw/zinc/12/39/97/394123997.db2.gz GDEJEYYMMPUXSX-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN Cc1cccc(C[N@@H+](CC2CCC2)[C@H](C)CO)c1[O-] ZINC000284336991 394135943 /nfs/dbraw/zinc/13/59/43/394135943.db2.gz XPBZCKROWFTRAP-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+](CC2CCC2)[C@H](C)CO)c1[O-] ZINC000284336991 394135949 /nfs/dbraw/zinc/13/59/49/394135949.db2.gz XPBZCKROWFTRAP-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@H]1CCCN(CC[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000296019947 394305296 /nfs/dbraw/zinc/30/52/96/394305296.db2.gz PMEHSBOFUIGFOV-ZFWWWQNUSA-N 0 3 274.408 2.701 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000297037235 394312964 /nfs/dbraw/zinc/31/29/64/394312964.db2.gz UZWWYWVAUJHSNF-BBRMVZONSA-N 0 3 275.392 2.766 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1 ZINC000296325689 292166223 /nfs/dbraw/zinc/16/62/23/292166223.db2.gz HARRCMAETKWENX-RYUDHWBXSA-N 0 3 251.370 2.901 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@]2(C)CCCC[C@@H]2O)c1 ZINC000185644150 286338880 /nfs/dbraw/zinc/33/88/80/286338880.db2.gz ANPVKUUBMRBLHJ-DQYPLSBCSA-N 0 3 293.407 2.993 20 10 CFCDHN CC[C@@H](NCC1(C)OCCCO1)c1ccc(N(C)C)cc1 ZINC000190651696 286903056 /nfs/dbraw/zinc/90/30/56/286903056.db2.gz IQLKKOKEHJPGPR-MRXNPFEDSA-N 0 3 292.423 2.946 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCCCCCC1)OCO2 ZINC000007074894 170266731 /nfs/dbraw/zinc/26/67/31/170266731.db2.gz RIVQGBAFAIAVFA-UHFFFAOYSA-N 0 3 263.337 2.887 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCCC1)c1ccccc1[O-] ZINC000020128763 171016137 /nfs/dbraw/zinc/01/61/37/171016137.db2.gz GEWLFISCAIJKTM-AWEZNQCLSA-N 0 3 262.397 2.919 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccccc1[O-] ZINC000020146666 171033330 /nfs/dbraw/zinc/03/33/30/171033330.db2.gz IYPIURACBXOYPA-KGLIPLIRSA-N 0 3 279.380 2.629 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000038014012 173985182 /nfs/dbraw/zinc/98/51/82/173985182.db2.gz JLFAFHFXZNIKRF-QWHCGFSZSA-N 0 3 278.396 2.656 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)N2CCCCC2)c1 ZINC000038028449 174017299 /nfs/dbraw/zinc/01/72/99/174017299.db2.gz MMTZDPRJZYZADQ-ZIAGYGMSSA-N 0 3 292.423 2.926 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(CC)CC1)c1ccccc1[O-] ZINC000038097941 174111857 /nfs/dbraw/zinc/11/18/57/174111857.db2.gz PHZCILRTIUOCBS-HNNXBMFYSA-N 0 3 262.397 2.917 20 10 CFCDHN C[C@@H]([NH2+]CCN(C)C1CCCC1)c1ccccc1[O-] ZINC000071376736 176142444 /nfs/dbraw/zinc/14/24/44/176142444.db2.gz VSCOKMDJRSYWOM-CYBMUJFWSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCOC[C@H]2CCCO2)c1 ZINC000035628896 260030630 /nfs/dbraw/zinc/03/06/30/260030630.db2.gz UIVOZUUCLPEPJC-LSDHHAIUSA-N 0 3 293.407 2.937 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1ccccc1[O-] ZINC000367436073 262010513 /nfs/dbraw/zinc/01/05/13/262010513.db2.gz DNOLMOHFZJNFRP-GFCCVEGCSA-N 0 3 271.364 2.776 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCOCC3(CCC3)C2)c1 ZINC000363923606 262034046 /nfs/dbraw/zinc/03/40/46/262034046.db2.gz NACQKPUMROKUFH-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCOCC3(CCC3)C2)c1 ZINC000363923606 262034044 /nfs/dbraw/zinc/03/40/44/262034044.db2.gz NACQKPUMROKUFH-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000292711087 263133987 /nfs/dbraw/zinc/13/39/87/263133987.db2.gz ORBDLKITMLJWFI-LBPRGKRZSA-N 0 3 292.423 2.651 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@](F)(CO)C1 ZINC000367691077 267110025 /nfs/dbraw/zinc/11/00/25/267110025.db2.gz ZYLGXLVHOLPIGX-DZGCQCFKSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@](F)(CO)C1 ZINC000367691077 267110026 /nfs/dbraw/zinc/11/00/26/267110026.db2.gz ZYLGXLVHOLPIGX-DZGCQCFKSA-N 0 3 267.344 2.640 20 10 CFCDHN CN1Cc2ccccc2[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000368023635 267135952 /nfs/dbraw/zinc/13/59/52/267135952.db2.gz XPMIJQHBCPOSOB-INIZCTEOSA-N 0 3 286.350 2.808 20 10 CFCDHN COCC1(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])CCOCC1 ZINC000368363788 267166312 /nfs/dbraw/zinc/16/63/12/267166312.db2.gz KDMXMZFHGASFML-AWEZNQCLSA-N 0 3 293.407 2.794 20 10 CFCDHN CCOc1cccc(C[NH2+]C2(C3CC3)CCOCC2)c1[O-] ZINC000368623758 267191923 /nfs/dbraw/zinc/19/19/23/267191923.db2.gz JLRRKDKXWPNSJH-UHFFFAOYSA-N 0 3 291.391 2.840 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCO[C@]2(CCOC2)C1)c1cc(F)ccc1[O-] ZINC000369902177 267275543 /nfs/dbraw/zinc/27/55/43/267275543.db2.gz KXURYFUSLXLOOE-DETPVDSQSA-N 0 3 295.354 2.520 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000370397282 267316663 /nfs/dbraw/zinc/31/66/63/267316663.db2.gz MNQIGOHMPXPXQJ-SKDRFNHKSA-N 0 3 291.782 2.977 20 10 CFCDHN OC[C@H]1c2ccccc2CCN1Cc1cc(F)ccc1O ZINC000180163917 275050328 /nfs/dbraw/zinc/05/03/28/275050328.db2.gz KUSSYTFMSGOAOP-INIZCTEOSA-N 0 3 287.334 2.623 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000378490467 275061071 /nfs/dbraw/zinc/06/10/71/275061071.db2.gz CTKFAKQLHJCCFA-OAHLLOKOSA-N 0 3 278.371 2.592 20 10 CFCDHN Oc1ccccc1CN1CCC2(C1)Oc1ccccc1O2 ZINC000290236834 275061684 /nfs/dbraw/zinc/06/16/84/275061684.db2.gz UELGPBMBHMQZQU-UHFFFAOYSA-N 0 3 283.327 2.766 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000248527999 276175153 /nfs/dbraw/zinc/17/51/53/276175153.db2.gz IKZGMFLHAAAXCA-ZIAGYGMSSA-N 0 3 262.397 2.836 20 10 CFCDHN CCCN(CC(=O)N(C)C)Cc1cc(Cl)cc(C)c1O ZINC000179827839 276248654 /nfs/dbraw/zinc/24/86/54/276248654.db2.gz ULXTVUJWZVMPNC-UHFFFAOYSA-N 0 3 298.814 2.654 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)C1CCOCC1 ZINC000296652299 279548829 /nfs/dbraw/zinc/54/88/29/279548829.db2.gz DLYVQYBRSRQHBL-FZMZJTMJSA-N 0 3 261.365 2.784 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C(=O)N1CCCC1)c1ccc(C)cc1[O-] ZINC000281421018 280191769 /nfs/dbraw/zinc/19/17/69/280191769.db2.gz BTPPFFCTUZAURC-DZGCQCFKSA-N 0 3 290.407 2.752 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(OC)ccc2[O-])C12CCC2 ZINC000181966058 329238464 /nfs/dbraw/zinc/23/84/64/329238464.db2.gz FRBIUUTUOBPLGV-HZPDHXFCSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1cc(O)c(CN[C@H]2Cc3ccccc3NC2=O)cc1C ZINC000527801072 330284106 /nfs/dbraw/zinc/28/41/06/330284106.db2.gz QEOQIGMNVQLUAT-INIZCTEOSA-N 0 3 296.370 2.662 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@]2(C)OC(C)C)c([O-])c1 ZINC000527801767 330284272 /nfs/dbraw/zinc/28/42/72/330284272.db2.gz WVRHSMMIVPRHKX-CVEARBPZSA-N 0 3 279.380 2.837 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1 ZINC000527999161 330299840 /nfs/dbraw/zinc/29/98/40/330299840.db2.gz CODZEDMNLXMIOD-VZTWBHMWSA-N 0 3 279.380 2.863 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2Cc3ccccc3NC2=O)c([O-])c1 ZINC000528000717 330300056 /nfs/dbraw/zinc/30/00/56/330300056.db2.gz NWWJUSDMWIELJA-BLLLJJGKSA-N 0 3 296.370 2.915 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)C(=O)N1CCCC1)c1ccccc1[O-] ZINC000528014129 330304144 /nfs/dbraw/zinc/30/41/44/330304144.db2.gz FSVVDLFNJYQARK-ZDUSSCGKSA-N 0 3 290.407 2.691 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2COC2)c1[O-] ZINC000528024287 330304943 /nfs/dbraw/zinc/30/49/43/330304943.db2.gz DUXQWVCEYGPSFB-SECBINFHSA-N 0 3 255.745 2.651 20 10 CFCDHN Cc1c2ccccc2n(C)c1CNCC1=CCCOC1 ZINC000355127200 335767064 /nfs/dbraw/zinc/76/70/64/335767064.db2.gz SSVHEJZYWZMYCF-UHFFFAOYSA-N 0 3 270.376 2.923 20 10 CFCDHN CC[C@H](C)[C@@H](O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000155807869 521878943 /nfs/dbraw/zinc/87/89/43/521878943.db2.gz UEYUQJAPAOWACI-WHOFXGATSA-N 0 3 251.370 2.840 20 10 CFCDHN CN(C)c1ccc(CNC[C@H](O)c2ccsc2)cc1 ZINC000219094718 522207657 /nfs/dbraw/zinc/20/76/57/522207657.db2.gz OLKGQRGWVXJARB-HNNXBMFYSA-N 0 3 276.405 2.637 20 10 CFCDHN CC[C@@H](C[NH2+]Cc1cc(Cl)cc(C)c1[O-])OC ZINC000290378684 522547522 /nfs/dbraw/zinc/54/75/22/522547522.db2.gz AXCMCOFIQPNQCW-LBPRGKRZSA-N 0 3 257.761 2.869 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])cn1 ZINC000279200998 519718029 /nfs/dbraw/zinc/71/80/29/519718029.db2.gz XIFWHADVMVLDOM-GFCCVEGCSA-N 0 3 299.374 2.905 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000272835556 519800107 /nfs/dbraw/zinc/80/01/07/519800107.db2.gz IQVIBLXSBYHMJD-SWLSCSKDSA-N 0 3 263.381 2.840 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cc(OC)ccc1[O-])C(C)C ZINC000188003416 520150418 /nfs/dbraw/zinc/15/04/18/520150418.db2.gz NCLMJNVOXRMPIO-AWEZNQCLSA-N 0 3 267.369 2.552 20 10 CFCDHN CCOCc1cc(CN[C@@H]2CCOC2(C)C)ccc1OC ZINC000294802565 520186218 /nfs/dbraw/zinc/18/62/18/520186218.db2.gz NCDQNNOMTBKVEE-MRXNPFEDSA-N 0 3 293.407 2.889 20 10 CFCDHN CCN(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(C)c(C)c1O ZINC000276583723 520201792 /nfs/dbraw/zinc/20/17/92/520201792.db2.gz INBAWVLERCVKRU-CHWSQXEVSA-N 0 3 278.396 2.526 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c([O-])c1 ZINC000275703349 520350891 /nfs/dbraw/zinc/35/08/91/520350891.db2.gz BVRKSETUNDSWAH-INIZCTEOSA-N 0 3 293.407 2.774 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c([O-])c1 ZINC000275703349 520350900 /nfs/dbraw/zinc/35/09/00/520350900.db2.gz BVRKSETUNDSWAH-INIZCTEOSA-N 0 3 293.407 2.774 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H](CC)OC)c([O-])c1 ZINC000289684289 520367141 /nfs/dbraw/zinc/36/71/41/520367141.db2.gz CPGDNNNHBIYGNK-ZDUSSCGKSA-N 0 3 267.369 2.696 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])[C@H]1OC ZINC000274988830 520368916 /nfs/dbraw/zinc/36/89/16/520368916.db2.gz YQYRNPWLKBUAFD-UMVBOHGHSA-N 0 3 299.798 2.636 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCC[C@H]2CCO)c([O-])c1 ZINC000189968466 520372022 /nfs/dbraw/zinc/37/20/22/520372022.db2.gz YAACVJFCGWKEDH-XJKSGUPXSA-N 0 3 293.407 2.822 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)CN(C)C(C)C)c([O-])c1 ZINC000289835222 520374863 /nfs/dbraw/zinc/37/48/63/520374863.db2.gz ONCBVHJYAJXSDP-CQSZACIVSA-N 0 3 294.439 2.999 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+]Cc2cccc(OC)c2[O-])C12CCC2 ZINC000266191220 520550277 /nfs/dbraw/zinc/55/02/77/520550277.db2.gz YQEHFRQSFVYWMC-CABCVRRESA-N 0 3 291.391 2.838 20 10 CFCDHN CCCCOC[C@@H](O)C[N@H+](CCC)Cc1ccccc1[O-] ZINC000279840289 520800126 /nfs/dbraw/zinc/80/01/26/520800126.db2.gz AHRSNJQPYXYTOK-INIZCTEOSA-N 0 3 295.423 2.782 20 10 CFCDHN CCCCOC[C@@H](O)C[N@@H+](CCC)Cc1ccccc1[O-] ZINC000279840289 520800133 /nfs/dbraw/zinc/80/01/33/520800133.db2.gz AHRSNJQPYXYTOK-INIZCTEOSA-N 0 3 295.423 2.782 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(OCC)ccc1[O-] ZINC000278716889 520958644 /nfs/dbraw/zinc/95/86/44/520958644.db2.gz PGKHFQWFOBEHDX-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(OCC)ccc1[O-] ZINC000278716889 520958655 /nfs/dbraw/zinc/95/86/55/520958655.db2.gz PGKHFQWFOBEHDX-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@H](C)C(=O)NCCNCc1ccc(OC)c(C)c1 ZINC000292831001 520998298 /nfs/dbraw/zinc/99/82/98/520998298.db2.gz XSTPBFJAZKFEIS-ZDUSSCGKSA-N 0 3 292.423 2.646 20 10 CFCDHN CCN(CC[NH2+]Cc1cc(Cl)cc(OC)c1[O-])C1CC1 ZINC000230934312 521078802 /nfs/dbraw/zinc/07/88/02/521078802.db2.gz OCYQJXAZUQESEW-UHFFFAOYSA-N 0 3 298.814 2.628 20 10 CFCDHN CCCC[C@H](COC)[NH2+]Cc1cccc(OC)c1[O-] ZINC000076768205 521198903 /nfs/dbraw/zinc/19/89/03/521198903.db2.gz VPNQEMZFOBCVHY-CYBMUJFWSA-N 0 3 267.369 2.696 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H]2CCN(C)C[C@H]2C)c1[O-] ZINC000290316362 521333454 /nfs/dbraw/zinc/33/34/54/521333454.db2.gz COGCURFTZMAILJ-UKRRQHHQSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@H]2C)c1[O-] ZINC000290316362 521333460 /nfs/dbraw/zinc/33/34/60/521333460.db2.gz COGCURFTZMAILJ-UKRRQHHQSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[NH2+]CCN(C)C2CCCC2)c1[O-] ZINC000071376689 521361191 /nfs/dbraw/zinc/36/11/91/521361191.db2.gz WNYXWZZMGCZBAP-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CCOc1cccc(C[NH2+]CC[C@@H]2CCCCO2)c1[O-] ZINC000227340266 521364299 /nfs/dbraw/zinc/36/42/99/521364299.db2.gz WACIAEWUWYXJKR-AWEZNQCLSA-N 0 3 279.380 2.840 20 10 CFCDHN CCOC(CC[NH2+][C@@H](C)c1ccccc1[O-])OCC ZINC000276520611 521629482 /nfs/dbraw/zinc/62/94/82/521629482.db2.gz MFLHYJASMGREEH-LBPRGKRZSA-N 0 3 267.369 2.832 20 10 CFCDHN CCOCC(C)(C)[NH2+]Cc1cc(OCC)ccc1[O-] ZINC000292983306 521671196 /nfs/dbraw/zinc/67/11/96/521671196.db2.gz NIQRQKIYXAQBPY-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000062747640 521717926 /nfs/dbraw/zinc/71/79/26/521717926.db2.gz LVRBEJTXZDZJKO-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN CC[C@H](CSC)[NH2+]Cc1cc(OC)ccc1[O-] ZINC000164790587 522282766 /nfs/dbraw/zinc/28/27/66/522282766.db2.gz OYCSCJKKBRUIRP-LLVKDONJSA-N 0 3 255.383 2.632 20 10 CFCDHN CC[C@@H](CCO)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000094949418 522509460 /nfs/dbraw/zinc/50/94/60/522509460.db2.gz SBVALKVSFPENMC-OLZOCXBDSA-N 0 3 251.370 2.760 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCCSC)c1[O-] ZINC000228675177 522539955 /nfs/dbraw/zinc/53/99/55/522539955.db2.gz DMEUNIHIDFZGPL-UHFFFAOYSA-N 0 3 275.801 2.897 20 10 CFCDHN CC[C@H]([NH2+]CCCn1ccnc1)c1ccccc1[O-] ZINC000020506195 522591759 /nfs/dbraw/zinc/59/17/59/522591759.db2.gz XZYGQUYSJNMKLO-AWEZNQCLSA-N 0 3 259.353 2.720 20 10 CFCDHN COC1CCC([N@H+](C)Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000265166854 522683225 /nfs/dbraw/zinc/68/32/25/522683225.db2.gz GJEZFWJNEBSMBB-UHFFFAOYSA-N 0 3 293.363 2.510 20 10 CFCDHN COC1CCC([N@@H+](C)Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000265166854 522683232 /nfs/dbraw/zinc/68/32/32/522683232.db2.gz GJEZFWJNEBSMBB-UHFFFAOYSA-N 0 3 293.363 2.510 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279996365 522692771 /nfs/dbraw/zinc/69/27/71/522692771.db2.gz FRPXPELQNDZWTK-DZKIICNBSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H](O)C1(C)C)c1ccc(C)cc1[O-] ZINC000280009246 522726365 /nfs/dbraw/zinc/72/63/65/522726365.db2.gz GOOWJROULRDSLB-NWANDNLSSA-N 0 3 263.381 2.901 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@H](O)C1(C)C)c1ccc(C)cc1[O-] ZINC000280009250 522762970 /nfs/dbraw/zinc/76/29/70/522762970.db2.gz GOOWJROULRDSLB-QEJZJMRPSA-N 0 3 263.381 2.901 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCS[C@H](C)CC2)cc1OC ZINC000191658726 522778761 /nfs/dbraw/zinc/77/87/61/522778761.db2.gz YBGHQOBSSCSYLA-LLVKDONJSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCS[C@H](C)CC2)cc1OC ZINC000191658726 522778765 /nfs/dbraw/zinc/77/87/65/522778765.db2.gz YBGHQOBSSCSYLA-LLVKDONJSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[NH+]2C[C@H]3CCC[C@@H]3C2)cc1OC ZINC000160389624 522779682 /nfs/dbraw/zinc/77/96/82/522779682.db2.gz AVCWZIHXRPFRJJ-VXGBXAGGSA-N 0 3 277.364 2.641 20 10 CFCDHN COCC1(CC[NH2+]Cc2cc(OC)ccc2[O-])CCC1 ZINC000293540340 522863486 /nfs/dbraw/zinc/86/34/86/522863486.db2.gz CUARBURKTAQZMW-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cnn(CC)c1)c1ccccc1[O-] ZINC000274920184 522892377 /nfs/dbraw/zinc/89/23/77/522892377.db2.gz OZFHGLNBFONEKJ-CQSZACIVSA-N 0 3 259.353 2.850 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952068 522908264 /nfs/dbraw/zinc/90/82/64/522908264.db2.gz BTKCCGFFWOYCPR-DZGCQCFKSA-N 0 3 290.407 2.752 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CCCO)c1ccc(C)cc1[O-] ZINC000279988739 522908609 /nfs/dbraw/zinc/90/86/09/522908609.db2.gz FEOZFQCWNWQETH-GXTWGEPZSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952077 522932040 /nfs/dbraw/zinc/93/20/40/522932040.db2.gz BTKCCGFFWOYCPR-UKRRQHHQSA-N 0 3 290.407 2.752 20 10 CFCDHN CC[C@@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[O-])C1 ZINC000160385863 523333509 /nfs/dbraw/zinc/33/35/09/523333509.db2.gz VDEAAFDCQLJFIN-LLVKDONJSA-N 0 3 265.353 2.641 20 10 CFCDHN CC[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[O-])C1 ZINC000160385863 523333520 /nfs/dbraw/zinc/33/35/20/523333520.db2.gz VDEAAFDCQLJFIN-LLVKDONJSA-N 0 3 265.353 2.641 20 10 CFCDHN CC[C@@](C)(O)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284050342 523674065 /nfs/dbraw/zinc/67/40/65/523674065.db2.gz KGEQODLTXQETGY-SWLSCSKDSA-N 0 3 251.370 2.821 20 10 CFCDHN CC[C@H](C)C[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000096477781 523869466 /nfs/dbraw/zinc/86/94/66/523869466.db2.gz UXDCGUHQZNLLDE-JTQLQIEISA-N 0 3 251.326 2.599 20 10 CFCDHN CC[C@H](C)C[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000096477781 523869470 /nfs/dbraw/zinc/86/94/70/523869470.db2.gz UXDCGUHQZNLLDE-JTQLQIEISA-N 0 3 251.326 2.599 20 10 CFCDHN CN1Cc2ccccc2[C@H]([NH2+]Cc2ccccc2[O-])C1 ZINC000361167217 524029747 /nfs/dbraw/zinc/02/97/47/524029747.db2.gz FJHMUKIAPBHHHX-MRXNPFEDSA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094617922 524167650 /nfs/dbraw/zinc/16/76/50/524167650.db2.gz WAGUPFMIBCMRKV-GHMZBOCLSA-N 0 3 254.349 2.522 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](O)c2ccsc2)c1[O-] ZINC000224858130 524431597 /nfs/dbraw/zinc/43/15/97/524431597.db2.gz KNEVMOJEOSWDSN-ZDUSSCGKSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)c1[O-] ZINC000291609397 524432014 /nfs/dbraw/zinc/43/20/14/524432014.db2.gz QXODIJHZVYCOLP-PKOBYXMFSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1[O-] ZINC000158134823 524433937 /nfs/dbraw/zinc/43/39/37/524433937.db2.gz XWNHMJRZFLEAKR-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2COc3ccc(F)cc3C2)c1[O-] ZINC000289250678 524438360 /nfs/dbraw/zinc/43/83/60/524438360.db2.gz AYPMFUUHMPQSFE-HNNXBMFYSA-N 0 3 287.334 2.933 20 10 CFCDHN Cc1ccc(CNCc2ccc3c(c2)CCO3)cn1 ZINC000058062602 524582383 /nfs/dbraw/zinc/58/23/83/524582383.db2.gz BNUGDOSWZXICKT-UHFFFAOYSA-N 0 3 254.333 2.615 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCCOC(C)(C)C2)c1 ZINC000364988320 524759920 /nfs/dbraw/zinc/75/99/20/524759920.db2.gz XLHPNJUXTXBFOJ-GFCCVEGCSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCCOC(C)(C)C2)c1 ZINC000364988320 524759930 /nfs/dbraw/zinc/75/99/30/524759930.db2.gz XLHPNJUXTXBFOJ-GFCCVEGCSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(C)CCOCC2)c1 ZINC000230668265 524761589 /nfs/dbraw/zinc/76/15/89/524761589.db2.gz MSMKKQUWORDOMA-GFCCVEGCSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H]2c3ccccc3C[C@H]2O)c1 ZINC000248499639 524773628 /nfs/dbraw/zinc/77/36/28/524773628.db2.gz MYRQYUSMWNDKJE-PDSMFRHLSA-N 0 3 299.370 2.710 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CCCCCO)c1[O-] ZINC000279467153 524861629 /nfs/dbraw/zinc/86/16/29/524861629.db2.gz RQNTYSBCDITPSP-UHFFFAOYSA-N 0 3 271.788 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CCCCCO)c1[O-] ZINC000279467153 524861638 /nfs/dbraw/zinc/86/16/38/524861638.db2.gz RQNTYSBCDITPSP-UHFFFAOYSA-N 0 3 271.788 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCCOC2)c1[O-] ZINC000290268133 524874665 /nfs/dbraw/zinc/87/46/65/524874665.db2.gz XMJWYAMMBMTAEB-LBPRGKRZSA-N 0 3 255.745 2.623 20 10 CFCDHN C[C@@H](C[S@](C)=O)NCc1ccc(N2CCCCC2)cc1 ZINC000168152962 524883719 /nfs/dbraw/zinc/88/37/19/524883719.db2.gz NRPFFYBTUQWBQJ-VBKZILBWSA-N 0 3 294.464 2.534 20 10 CFCDHN C[C@](CO)([NH2+]Cc1ccccc1[O-])C1CCCCC1 ZINC000265771656 525142324 /nfs/dbraw/zinc/14/23/24/525142324.db2.gz MIWSZCXEUNRXQJ-MRXNPFEDSA-N 0 3 263.381 2.813 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1ccccc1[O-])C1CCCCC1 ZINC000191673576 525178610 /nfs/dbraw/zinc/17/86/10/525178610.db2.gz YFMYOIDGAFONQS-INIZCTEOSA-N 0 3 263.381 2.813 20 10 CFCDHN Cc1cc(O)c(CN[C@@]2(CO)CCc3ccccc32)cc1C ZINC000305121303 525322520 /nfs/dbraw/zinc/32/25/20/525322520.db2.gz BLWDHERRELMBFX-LJQANCHMSA-N 0 3 297.398 2.933 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@]2(CO)CCc3ccccc32)cc1C ZINC000305121303 525322525 /nfs/dbraw/zinc/32/25/25/525322525.db2.gz BLWDHERRELMBFX-LJQANCHMSA-N 0 3 297.398 2.933 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@H](CO)CC(C)C)c1 ZINC000290639684 525339371 /nfs/dbraw/zinc/33/93/71/525339371.db2.gz YKRZITJFNQGXGX-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@H](CO)CC(C)C)c1 ZINC000290639684 525339380 /nfs/dbraw/zinc/33/93/80/525339380.db2.gz YKRZITJFNQGXGX-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290411497 525344134 /nfs/dbraw/zinc/34/41/34/525344134.db2.gz KBSAOJFXSQLZGW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290411497 525344139 /nfs/dbraw/zinc/34/41/39/525344139.db2.gz KBSAOJFXSQLZGW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN C[C@H]([NH2+]CCN1CCCCCC1)c1ccccc1[O-] ZINC000040767476 525350760 /nfs/dbraw/zinc/35/07/60/525350760.db2.gz XNNLTAQDTMBZQK-AWEZNQCLSA-N 0 3 262.397 2.919 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H](CO)c2ccc(F)cc2)c1 ZINC000265258230 525352112 /nfs/dbraw/zinc/35/21/12/525352112.db2.gz QHLDWVJBUBCUHS-HNNXBMFYSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCCc3c2cnn3C)c1 ZINC000071407688 525355668 /nfs/dbraw/zinc/35/56/68/525355668.db2.gz MZZOGAOMOMTCJH-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2CCCc3c2cnn3C)c1 ZINC000071407688 525355672 /nfs/dbraw/zinc/35/56/72/525355672.db2.gz MZZOGAOMOMTCJH-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]Cc2ccc(C)n(C)c2=O)c1 ZINC000279396120 525362949 /nfs/dbraw/zinc/36/29/49/525362949.db2.gz CNXZJXQOWUZMSV-CYBMUJFWSA-N 0 3 286.375 2.559 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)NCc2ccc(C)n(C)c2=O)c1 ZINC000279396120 525362955 /nfs/dbraw/zinc/36/29/55/525362955.db2.gz CNXZJXQOWUZMSV-CYBMUJFWSA-N 0 3 286.375 2.559 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1ccccc1[O-] ZINC000272916036 525396890 /nfs/dbraw/zinc/39/68/90/525396890.db2.gz XKNQTHRQQHXAKC-QWHCGFSZSA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(C2CC2)CC1)c1ccccc1[O-] ZINC000037141039 525402064 /nfs/dbraw/zinc/40/20/64/525402064.db2.gz RWJRWEPHKHVENT-GFCCVEGCSA-N 0 3 260.381 2.670 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCCCCC1)c1ccccc1[O-] ZINC000040767478 525448200 /nfs/dbraw/zinc/44/82/00/525448200.db2.gz XNNLTAQDTMBZQK-CQSZACIVSA-N 0 3 262.397 2.919 20 10 CFCDHN C[C@@H]([NH2+]CCOCC(F)(F)C(F)F)c1ccccc1[O-] ZINC000276154467 525450974 /nfs/dbraw/zinc/45/09/74/525450974.db2.gz CMBXLCXHOCXWJJ-SECBINFHSA-N 0 3 295.276 2.960 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000062747649 525484284 /nfs/dbraw/zinc/48/42/84/525484284.db2.gz NJONNSWYGJGYBT-NEPJUHHUSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1ccc(F)cc1[O-] ZINC000062748558 525490147 /nfs/dbraw/zinc/49/01/47/525490147.db2.gz QPFCQIYJYHDKRH-QWHCGFSZSA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCOC[C@@H]1C)c1cc(F)ccc1[O-] ZINC000278456371 525573281 /nfs/dbraw/zinc/57/32/81/525573281.db2.gz ITQWNUBWRWGFSZ-OUJBWJOFSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1cc(F)ccc1[O-] ZINC000094617921 525596250 /nfs/dbraw/zinc/59/62/50/525596250.db2.gz WAGUPFMIBCMRKV-WDEREUQCSA-N 0 3 254.349 2.522 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000062999532 525669928 /nfs/dbraw/zinc/66/99/28/525669928.db2.gz XNEKQJUDDODELO-IUODEOHRSA-N 0 3 257.333 2.776 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2([S@](C)=O)CCC2)c([O-])c1 ZINC000280896561 525916144 /nfs/dbraw/zinc/91/61/44/525916144.db2.gz BXOHULOPTSKQLW-BUXKBTBVSA-N 0 3 281.421 2.652 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccccc3[C@H]2O)c([O-])c1 ZINC000290399826 525946539 /nfs/dbraw/zinc/94/65/39/525946539.db2.gz SUZGEZDCEDVIML-XLWVJDPXSA-N 0 3 299.370 2.846 20 10 CFCDHN COc1cccc(C[NH2+]C2CC(OC(C)(C)C)C2)c1[O-] ZINC000273039009 526010624 /nfs/dbraw/zinc/01/06/24/526010624.db2.gz AAIXDJVATHTWAJ-UHFFFAOYSA-N 0 3 279.380 2.837 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)CC2(OC)CCC2)c1[O-] ZINC000289448577 526029939 /nfs/dbraw/zinc/02/99/39/526029939.db2.gz MVESXVLGKXRJKE-LBPRGKRZSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@H](C)[C@@H](OC)C23CCC3)c1[O-] ZINC000365024308 526033507 /nfs/dbraw/zinc/03/35/07/526033507.db2.gz WWFNPVGCKKMUSB-IUIKQTSFSA-N 0 3 291.391 2.694 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@H+](Cc3cc(C)c(C)cc3[O-])C2)c1 ZINC000290365404 526266995 /nfs/dbraw/zinc/26/69/95/526266995.db2.gz AEGZNIWAXSUZHZ-MRXNPFEDSA-N 0 3 285.391 2.961 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@@H+](Cc3cc(C)c(C)cc3[O-])C2)c1 ZINC000290365404 526266997 /nfs/dbraw/zinc/26/69/97/526266997.db2.gz AEGZNIWAXSUZHZ-MRXNPFEDSA-N 0 3 285.391 2.961 20 10 CFCDHN Cc1cnn([C@H]2CC[N@H+](Cc3cc(C)c(C)cc3[O-])C2)c1 ZINC000290365395 526268516 /nfs/dbraw/zinc/26/85/16/526268516.db2.gz AEGZNIWAXSUZHZ-INIZCTEOSA-N 0 3 285.391 2.961 20 10 CFCDHN Cc1cnn([C@H]2CC[N@@H+](Cc3cc(C)c(C)cc3[O-])C2)c1 ZINC000290365395 526268519 /nfs/dbraw/zinc/26/85/19/526268519.db2.gz AEGZNIWAXSUZHZ-INIZCTEOSA-N 0 3 285.391 2.961 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCCC13CCC3)OCO2 ZINC000365838325 526335008 /nfs/dbraw/zinc/33/50/08/526335008.db2.gz QDPFDTJWFOMOKP-UHFFFAOYSA-N 0 3 261.321 2.639 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCCC13CCC3)OCO2 ZINC000365838325 526335012 /nfs/dbraw/zinc/33/50/12/526335012.db2.gz QDPFDTJWFOMOKP-UHFFFAOYSA-N 0 3 261.321 2.639 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@]2(CCCCO2)C1 ZINC000364804008 526372169 /nfs/dbraw/zinc/37/21/69/526372169.db2.gz CTQAVHPLIPTTQU-MRXNPFEDSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@]2(CCCCO2)C1 ZINC000364804008 526372172 /nfs/dbraw/zinc/37/21/72/526372172.db2.gz CTQAVHPLIPTTQU-MRXNPFEDSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCN(Cc2ccccc2)C1 ZINC000037047743 526374211 /nfs/dbraw/zinc/37/42/11/526374211.db2.gz GMSWYGVWFRVORO-KRWDZBQOSA-N 0 3 282.387 2.756 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000291731646 526374475 /nfs/dbraw/zinc/37/44/75/526374475.db2.gz NUCFDBFHQVKYRR-AWEZNQCLSA-N 0 3 286.350 2.900 20 10 CFCDHN Cc1ncc(C[NH2+][C@H]2CCc3cccc([O-])c32)s1 ZINC000297544500 527278823 /nfs/dbraw/zinc/27/88/23/527278823.db2.gz FGFKPBLCQFJPDX-LBPRGKRZSA-N 0 3 260.362 2.934 20 10 CFCDHN Cc1ncsc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296658074 527489949 /nfs/dbraw/zinc/48/99/49/527489949.db2.gz ZMQZPYUDAXQWQB-LBPRGKRZSA-N 0 3 274.389 2.977 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000727470727 574052052 /nfs/dbraw/zinc/05/20/52/574052052.db2.gz JUJIJURPISZTAW-UHFFFAOYSA-N 0 3 253.305 2.558 20 10 CFCDHN CCCN(Cc1cnc(C)nc1)Cc1ccccc1O ZINC000727831373 574067473 /nfs/dbraw/zinc/06/74/73/574067473.db2.gz YBKXYOFMMYMARP-UHFFFAOYSA-N 0 3 271.364 2.903 20 10 CFCDHN C[C@H]1C[C@@H]1CN(C)c1ccc(OCCN(C)C)cc1 ZINC000754147662 574077661 /nfs/dbraw/zinc/07/76/61/574077661.db2.gz DMUZTYVHOLEACN-UONOGXRCSA-N 0 3 262.397 2.719 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCSC[C@@H](C)C2)c([O-])c1 ZINC000754155574 574078512 /nfs/dbraw/zinc/07/85/12/574078512.db2.gz IVRTVXYSEWMHHU-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCSC[C@@H](C)C2)c([O-])c1 ZINC000754155574 574078514 /nfs/dbraw/zinc/07/85/14/574078514.db2.gz IVRTVXYSEWMHHU-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCOC(C)(C)C2)c([O-])c1 ZINC000754081084 574088813 /nfs/dbraw/zinc/08/88/13/574088813.db2.gz YMWYPMLZXGGINK-ZDUSSCGKSA-N 0 3 279.380 2.838 20 10 CFCDHN CC(C)([NH2+]Cc1ccccc1[O-])C(=O)Nc1ccccc1 ZINC000731041829 574107353 /nfs/dbraw/zinc/10/73/53/574107353.db2.gz YYIAYGQIGPIKRG-UHFFFAOYSA-N 0 3 284.359 2.899 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CC[C@@H](C)C2)c1 ZINC000756630474 574127535 /nfs/dbraw/zinc/12/75/35/574127535.db2.gz WHUKRRSVPSLSBA-KGLIPLIRSA-N 0 3 262.397 2.693 20 10 CFCDHN C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870860 574131333 /nfs/dbraw/zinc/13/13/33/574131333.db2.gz ZZXXNRAYGAWHNN-UTUOFQBUSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C1=CC(=O)CS1 ZINC000731870860 574131334 /nfs/dbraw/zinc/13/13/34/574131334.db2.gz ZZXXNRAYGAWHNN-UTUOFQBUSA-N 0 3 296.436 2.550 20 10 CFCDHN C[NH+](C)C1(CNC(=O)c2cc([O-])cs2)CCCCCC1 ZINC000731867346 574132242 /nfs/dbraw/zinc/13/22/42/574132242.db2.gz GPQRJSFGNOKKDU-UHFFFAOYSA-N 0 3 296.436 2.838 20 10 CFCDHN C[C@@H]1CCC[C@@](CNC(=O)c2cc([O-])cs2)([NH+](C)C)C1 ZINC000732276436 574149267 /nfs/dbraw/zinc/14/92/67/574149267.db2.gz KBWVQWUTNBBCBD-IAQYHMDHSA-N 0 3 296.436 2.694 20 10 CFCDHN CC[NH+](CC)CCC[C@@H](C)NC(=O)c1cc([O-])cs1 ZINC000732275147 574149385 /nfs/dbraw/zinc/14/93/85/574149385.db2.gz FPNPOYLTUJHDAT-LLVKDONJSA-N 0 3 284.425 2.694 20 10 CFCDHN CC(C)[N@H+](C)CC1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000732276368 574149449 /nfs/dbraw/zinc/14/94/49/574149449.db2.gz IEYOPKSODMQNPN-UHFFFAOYSA-N 0 3 296.436 2.646 20 10 CFCDHN CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000732276368 574149450 /nfs/dbraw/zinc/14/94/50/574149450.db2.gz IEYOPKSODMQNPN-UHFFFAOYSA-N 0 3 296.436 2.646 20 10 CFCDHN CCC[NH+](CCC)CCCNC(=O)c1cc([O-])cs1 ZINC000732285004 574150024 /nfs/dbraw/zinc/15/00/24/574150024.db2.gz MOKCFVSSWOFJJR-UHFFFAOYSA-N 0 3 284.425 2.696 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCOC1 ZINC000752106494 574159931 /nfs/dbraw/zinc/15/99/31/574159931.db2.gz YXRUQWJLJNSTLF-MRXNPFEDSA-N 0 3 269.344 2.938 20 10 CFCDHN CC[C@H](C)CN1CCN(c2ccc(OC)cc2)CC1 ZINC000755881238 574193646 /nfs/dbraw/zinc/19/36/46/574193646.db2.gz SLNSHDPIKVZRDB-AWEZNQCLSA-N 0 3 262.397 2.863 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+]Cc2cc(C)ccc2[O-])cc1 ZINC000733322207 574220930 /nfs/dbraw/zinc/22/09/30/574220930.db2.gz CLVUJNQPXLAEDQ-UHFFFAOYSA-N 0 3 284.359 2.949 20 10 CFCDHN CCc1cccc(NC(=O)CNCc2cc(C)ccc2O)c1 ZINC000733328647 574221778 /nfs/dbraw/zinc/22/17/78/574221778.db2.gz XCQGCBKWYSSFMS-UHFFFAOYSA-N 0 3 298.386 2.991 20 10 CFCDHN COC[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756342667 574226922 /nfs/dbraw/zinc/22/69/22/574226922.db2.gz UFUKQBYOYOBDTK-RYUDHWBXSA-N 0 3 263.381 2.957 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccco2)c([O-])c1 ZINC000756379733 574231463 /nfs/dbraw/zinc/23/14/63/574231463.db2.gz AVFFQPNHPVPKHD-RISCZKNCSA-N 0 3 261.321 2.678 20 10 CFCDHN CCOCC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756418028 574235464 /nfs/dbraw/zinc/23/54/64/574235464.db2.gz NTYFSOQJDDGHCY-MWLCHTKSSA-N 0 3 253.317 2.706 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756432596 574236676 /nfs/dbraw/zinc/23/66/76/574236676.db2.gz JRYZWOSUYNKVLA-LLVKDONJSA-N 0 3 277.343 2.777 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756445264 574238107 /nfs/dbraw/zinc/23/81/07/574238107.db2.gz ZMAWXHZYRSEQOM-ZWNOBZJWSA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000756459080 574238965 /nfs/dbraw/zinc/23/89/65/574238965.db2.gz WJLUDNAROWTOHJ-MDZLAQPJSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCC(=O)Nc2ccccn2)c1 ZINC000756481368 574240039 /nfs/dbraw/zinc/24/00/39/574240039.db2.gz XIKVPNNBFSPJFN-ZDUSSCGKSA-N 0 3 299.374 2.775 20 10 CFCDHN C[C@H](Cc1cnccn1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756493493 574241184 /nfs/dbraw/zinc/24/11/84/574241184.db2.gz GCTSSUVQRASSMQ-MNOVXSKESA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)N(C)C ZINC000756537009 574244209 /nfs/dbraw/zinc/24/42/09/574244209.db2.gz YVJBJGMCSSAHIN-CKYFFXLPSA-N 0 3 266.360 2.619 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C3CC3)C2)c([O-])c1C ZINC000756545645 574245563 /nfs/dbraw/zinc/24/55/63/574245563.db2.gz NSQSSMWBNXLKAS-KBPBESRZSA-N 0 3 274.408 2.896 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c1 ZINC000756555762 574246891 /nfs/dbraw/zinc/24/68/91/574246891.db2.gz VOHDYEARGDDSGK-DZGCQCFKSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN(C)CC(F)(F)F)c([O-])c1 ZINC000756569507 574248826 /nfs/dbraw/zinc/24/88/26/574248826.db2.gz PTBQSXGZBGSUNE-NSHDSACASA-N 0 3 290.329 2.845 20 10 CFCDHN CC[S@](=O)CC[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756576685 574249513 /nfs/dbraw/zinc/24/95/13/574249513.db2.gz NZTUMXYLENRSGC-ODXCJYRJSA-N 0 3 295.448 2.690 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756576758 574250132 /nfs/dbraw/zinc/25/01/32/574250132.db2.gz OHCFTDBQZZCXBS-FIXISWKDSA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1cnn(CCN(Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000730085733 574251503 /nfs/dbraw/zinc/25/15/03/574251503.db2.gz GHJCEDOZQJPVNA-UHFFFAOYSA-N 0 3 298.434 2.922 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756605175 574251528 /nfs/dbraw/zinc/25/15/28/574251528.db2.gz RCKOWZLSSYLUDL-FOGDFJRCSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@H]1C)c1cc(F)ccc1[O-] ZINC000756617109 574252827 /nfs/dbraw/zinc/25/28/27/574252827.db2.gz MIRCJGKNNVDOPX-NEPJUHHUSA-N 0 3 266.360 2.666 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CC[C@@H](C)C2)c([O-])c1 ZINC000756626224 574253430 /nfs/dbraw/zinc/25/34/30/574253430.db2.gz AXLCEGMEWGLSPP-ZIAGYGMSSA-N 0 3 262.397 2.693 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@]2(O)CCSC2)c2c1c(F)ccc2[O-] ZINC000756636325 574254119 /nfs/dbraw/zinc/25/41/19/574254119.db2.gz ITTAJFZVBWCNIT-OSQNNJELSA-N 0 3 297.395 2.537 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2C=C[C@H](CO)C2)c2c1c(F)ccc2[O-] ZINC000756661213 574256564 /nfs/dbraw/zinc/25/65/64/574256564.db2.gz QEJZOQKMLNZIIY-KQXIARHKSA-N 0 3 277.339 2.606 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCn2cccn2)c([O-])c1C ZINC000756684734 574257397 /nfs/dbraw/zinc/25/73/97/574257397.db2.gz LSLSSKNPFZIQMW-ZDUSSCGKSA-N 0 3 259.353 2.556 20 10 CFCDHN Cc1noc(CCC[NH2+][C@@H](C)c2cc(F)ccc2[O-])n1 ZINC000756687928 574257574 /nfs/dbraw/zinc/25/75/74/574257574.db2.gz WPYMFAWXURAJJS-VIFPVBQESA-N 0 3 279.315 2.506 20 10 CFCDHN Cc1n[nH]cc1C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756736679 574260180 /nfs/dbraw/zinc/26/01/80/574260180.db2.gz CCNMBCUXJFKVJR-QPUJVOFHSA-N 0 3 275.327 2.901 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H](CO)CC2CC2)c2c1c(F)ccc2[O-] ZINC000756770478 574261771 /nfs/dbraw/zinc/26/17/71/574261771.db2.gz XTBLTPTZUFGPKW-CDMKHQONSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@@H](CO)CC(F)(F)F)c(O)c1C ZINC000756777151 574262483 /nfs/dbraw/zinc/26/24/83/574262483.db2.gz VZXIMQXQKXMWIW-GHMZBOCLSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)CC(F)(F)F)c([O-])c1C ZINC000756777151 574262485 /nfs/dbraw/zinc/26/24/85/574262485.db2.gz VZXIMQXQKXMWIW-GHMZBOCLSA-N 0 3 291.313 2.973 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccc(CO)cc1)c1cc(F)ccc1[O-] ZINC000756790759 574263212 /nfs/dbraw/zinc/26/32/12/574263212.db2.gz PDDFODZLEXITBY-GFCCVEGCSA-N 0 3 289.350 2.917 20 10 CFCDHN C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000756816819 574265007 /nfs/dbraw/zinc/26/50/07/574265007.db2.gz ARRSWYXKGIGVKN-KKZNHRDASA-N 0 3 267.344 2.829 20 10 CFCDHN COCC1([NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)CC1 ZINC000756852144 574269004 /nfs/dbraw/zinc/26/90/04/574269004.db2.gz YMRAHCCZVSLHRL-MWLCHTKSSA-N 0 3 265.328 2.848 20 10 CFCDHN CCOCc1cc(CNCCOC2CCC2)ccc1OC ZINC000742385750 574279571 /nfs/dbraw/zinc/27/95/71/574279571.db2.gz QPCWOAPFHHORNO-UHFFFAOYSA-N 0 3 293.407 2.890 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H](O)C1CC1 ZINC000734843781 574303546 /nfs/dbraw/zinc/30/35/46/574303546.db2.gz BXLNXMUNHXIGME-GOSISDBHSA-N 0 3 283.371 2.920 20 10 CFCDHN CCN(C)C[C@H]1CC[N@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743398350 574362285 /nfs/dbraw/zinc/36/22/85/574362285.db2.gz DGFDWFOUUTXZKY-CQSZACIVSA-N 0 3 299.418 2.714 20 10 CFCDHN CCN(C)C[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743398350 574362287 /nfs/dbraw/zinc/36/22/87/574362287.db2.gz DGFDWFOUUTXZKY-CQSZACIVSA-N 0 3 299.418 2.714 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC3(C1)CCOCC3)CCC2 ZINC000743404762 574363075 /nfs/dbraw/zinc/36/30/75/574363075.db2.gz BROCOUBRMBWBOK-UHFFFAOYSA-N 0 3 287.403 2.883 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC3(C1)CCOCC3)CCC2 ZINC000743404762 574363077 /nfs/dbraw/zinc/36/30/77/574363077.db2.gz BROCOUBRMBWBOK-UHFFFAOYSA-N 0 3 287.403 2.883 20 10 CFCDHN O=[N+]([O-])c1cc(CNC2CC2)ccc1N1CCCCC1 ZINC000743503153 574367281 /nfs/dbraw/zinc/36/72/81/574367281.db2.gz IOCYOYZCJHKFAX-UHFFFAOYSA-N 0 3 275.352 2.837 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@@H]2CCCCS2)cc1OC ZINC000753567771 574404736 /nfs/dbraw/zinc/40/47/36/574404736.db2.gz APXGRUTXDGPGSK-LBPRGKRZSA-N 0 3 297.420 2.785 20 10 CFCDHN CC(C)[C@H](CO)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806170256 617816546 /nfs/dbraw/zinc/81/65/46/617816546.db2.gz YMBVSEGXMOINSQ-MDZLAQPJSA-N 0 3 281.371 2.934 20 10 CFCDHN COc1ccc(CN2CC=C(C)CC2)c(O)c1OC ZINC000892069198 617936326 /nfs/dbraw/zinc/93/63/26/617936326.db2.gz GBVVOQOVQLIJCU-UHFFFAOYSA-N 0 3 263.337 2.561 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@H]21 ZINC000894096433 618324101 /nfs/dbraw/zinc/32/41/01/618324101.db2.gz UZWOIHGIDBCKJP-XHDPSFHLSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@H]21 ZINC000894096433 618324110 /nfs/dbraw/zinc/32/41/10/618324110.db2.gz UZWOIHGIDBCKJP-XHDPSFHLSA-N 0 3 296.361 2.587 20 10 CFCDHN COC1(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])CCC1 ZINC000186509634 618354225 /nfs/dbraw/zinc/35/42/25/618354225.db2.gz SVKXXPCFXXHBJJ-JTQLQIEISA-N 0 3 253.317 2.751 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CC[C@@H]3COCC[C@H]3C2)c([O-])c1 ZINC000894184553 618431554 /nfs/dbraw/zinc/43/15/54/618431554.db2.gz BETHKCUWXUNPER-NWANDNLSSA-N 0 3 291.391 2.696 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]([NH+](C)C)C2)c(Cl)c1 ZINC000840915995 618468055 /nfs/dbraw/zinc/46/80/55/618468055.db2.gz OAXPHAFQKBPNSM-GFCCVEGCSA-N 0 3 282.815 2.880 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000895438540 618586131 /nfs/dbraw/zinc/58/61/31/618586131.db2.gz GTSIDXDQGDXRRL-CHWSQXEVSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000895438540 618586135 /nfs/dbraw/zinc/58/61/35/618586135.db2.gz GTSIDXDQGDXRRL-CHWSQXEVSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(C)cc(CN[C@H]2CCCn3nccc32)c1O ZINC000895463687 618599140 /nfs/dbraw/zinc/59/91/40/618599140.db2.gz AELPURSFZVQHOC-ZDUSSCGKSA-N 0 3 287.363 2.530 20 10 CFCDHN COC1([C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)CCC1 ZINC000840883932 618647351 /nfs/dbraw/zinc/64/73/51/618647351.db2.gz HKIJJXRAXYOCQI-WCQYABFASA-N 0 3 261.365 2.927 20 10 CFCDHN COCC(C)(C)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000311512051 618714085 /nfs/dbraw/zinc/71/40/85/618714085.db2.gz NVHFYYZSEZJNNQ-UHFFFAOYSA-N 0 3 287.787 2.816 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cncs2)c1 ZINC000168895171 618719156 /nfs/dbraw/zinc/71/91/56/618719156.db2.gz VDTVTEIOOXQSCN-SECBINFHSA-N 0 3 264.350 2.708 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000168937978 618719280 /nfs/dbraw/zinc/71/92/80/618719280.db2.gz QDZRQWYLXWSMOB-BPUTZDHNSA-N 0 3 273.376 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC[C@H](CO)C2)c1 ZINC000311711633 618720404 /nfs/dbraw/zinc/72/04/04/618720404.db2.gz SEDFNXMYQVCZRK-MELADBBJSA-N 0 3 263.381 2.902 20 10 CFCDHN c1cn2cc(CNCc3ccc4c(c3)CCO4)sc2n1 ZINC000892791937 618746915 /nfs/dbraw/zinc/74/69/15/618746915.db2.gz BHUVHXFHYMFORY-UHFFFAOYSA-N 0 3 285.372 2.621 20 10 CFCDHN C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)[NH2+]Cc1ccccc1[O-] ZINC000309915875 618890292 /nfs/dbraw/zinc/89/02/92/618890292.db2.gz UHWLVPCUPLNVLB-VXGBXAGGSA-N 0 3 294.395 2.784 20 10 CFCDHN C[C@@H](c1ccncc1)N(C)Cc1cc2c(cc1O)OCO2 ZINC000183715192 618908262 /nfs/dbraw/zinc/90/82/62/618908262.db2.gz MRMGRHDOLNGMFF-NSHDSACASA-N 0 3 286.331 2.709 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@]2(C)CCCO2)c1[O-] ZINC000184710208 619066971 /nfs/dbraw/zinc/06/69/71/619066971.db2.gz ADMDFZCFIZIMIQ-AWEZNQCLSA-N 0 3 285.771 2.713 20 10 CFCDHN CC1CCN(c2ccc(CNCc3c[nH]cn3)cc2)CC1 ZINC000894250680 619283515 /nfs/dbraw/zinc/28/35/15/619283515.db2.gz NJQQMLNIVXWXJG-UHFFFAOYSA-N 0 3 284.407 2.936 20 10 CFCDHN CC1CCN(c2ccc(CNCc3cnc[nH]3)cc2)CC1 ZINC000894250680 619283517 /nfs/dbraw/zinc/28/35/17/619283517.db2.gz NJQQMLNIVXWXJG-UHFFFAOYSA-N 0 3 284.407 2.936 20 10 CFCDHN COc1cc(C)cc(CN[C@@H](CO)c2ccccc2)c1O ZINC000894326272 619334928 /nfs/dbraw/zinc/33/49/28/619334928.db2.gz OLNBFEWORLCXND-HNNXBMFYSA-N 0 3 287.359 2.532 20 10 CFCDHN COc1cccc(CNCc2ccnn2C2CCC2)c1O ZINC000894457661 619389966 /nfs/dbraw/zinc/38/99/66/619389966.db2.gz FZIGYOQBQSNZBV-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN COc1cc(C)cc(CN[C@@H](CO)c2ccsc2)c1O ZINC000894480604 619396940 /nfs/dbraw/zinc/39/69/40/619396940.db2.gz PXLAZCRMPJGHHB-ZDUSSCGKSA-N 0 3 293.388 2.594 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895657656 619577448 /nfs/dbraw/zinc/57/74/48/619577448.db2.gz CIQKLUOLDGAULO-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895843828 619617346 /nfs/dbraw/zinc/61/73/46/619617346.db2.gz DAJOLPFMSVXNRW-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895843828 619617348 /nfs/dbraw/zinc/61/73/48/619617348.db2.gz DAJOLPFMSVXNRW-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895843829 619617559 /nfs/dbraw/zinc/61/75/59/619617559.db2.gz DAJOLPFMSVXNRW-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895843829 619617561 /nfs/dbraw/zinc/61/75/61/619617561.db2.gz DAJOLPFMSVXNRW-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCC2(C[C@@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852384 619623328 /nfs/dbraw/zinc/62/33/28/619623328.db2.gz UNBQSIFPHWOVEO-UBHSHLNASA-N 0 3 295.354 2.677 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)c([O-])c1 ZINC000896489220 619744552 /nfs/dbraw/zinc/74/45/52/619744552.db2.gz VEFQCXYKMJEBLR-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)c([O-])c1 ZINC000896489220 619744554 /nfs/dbraw/zinc/74/45/54/619744554.db2.gz VEFQCXYKMJEBLR-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1cccc(F)c1 ZINC000896563764 619763309 /nfs/dbraw/zinc/76/33/09/619763309.db2.gz MSPOFKFXXJZCBY-INIZCTEOSA-N 0 3 293.313 2.668 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2cc(F)ccc2[O-])CCCCO1 ZINC000896924119 619893551 /nfs/dbraw/zinc/89/35/51/619893551.db2.gz KMLVCODIWGAKMD-AWEZNQCLSA-N 0 3 253.317 2.580 20 10 CFCDHN CN1C[C@@H]2C[N@H+](Cc3c([O-])ccc4ccccc43)C[C@]2(C)C1 ZINC000897621669 620260665 /nfs/dbraw/zinc/26/06/65/620260665.db2.gz MXVCMZQGNKJPJQ-BEFAXECRSA-N 0 3 296.414 2.929 20 10 CFCDHN CN1C[C@@H]2C[N@@H+](Cc3c([O-])ccc4ccccc43)C[C@]2(C)C1 ZINC000897621669 620260667 /nfs/dbraw/zinc/26/06/67/620260667.db2.gz MXVCMZQGNKJPJQ-BEFAXECRSA-N 0 3 296.414 2.929 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@H]1O ZINC000897684285 620271341 /nfs/dbraw/zinc/27/13/41/620271341.db2.gz LZWOIOCDGIXUJL-SCLBCKFNSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@H]1O ZINC000897684285 620271342 /nfs/dbraw/zinc/27/13/42/620271342.db2.gz LZWOIOCDGIXUJL-SCLBCKFNSA-N 0 3 283.371 2.872 20 10 CFCDHN COC(=O)C[C@H]([NH2+]Cc1ccc(C)cc1[O-])C(C)(C)C ZINC000897887336 620298514 /nfs/dbraw/zinc/29/85/14/620298514.db2.gz QOVHRVFNGOIURR-AWEZNQCLSA-N 0 3 279.380 2.768 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000898050335 620321926 /nfs/dbraw/zinc/32/19/26/620321926.db2.gz SDGNUFLYXQHJLU-LBPRGKRZSA-N 0 3 279.380 2.838 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCOC12CCOCC2)c1ccccc1[O-] ZINC000898116644 620336531 /nfs/dbraw/zinc/33/65/31/620336531.db2.gz TZFGAQDNGYLZPM-HOCLYGCPSA-N 0 3 291.391 2.771 20 10 CFCDHN C[C@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1ccccc1[O-] ZINC000926964389 620433324 /nfs/dbraw/zinc/43/33/24/620433324.db2.gz RNESEZQWVUGPCU-GWCFXTLKSA-N 0 3 290.329 2.925 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C/C=C\Cl)c1[O-] ZINC000898434411 620463906 /nfs/dbraw/zinc/46/39/06/620463906.db2.gz VHRWQSNGOXKVEV-IHWYPQMZSA-N 0 3 262.136 2.896 20 10 CFCDHN CN(Cc1cccc(=O)[nH]1)Cc1cc2c(cc1O)CCC2 ZINC000902568399 621120896 /nfs/dbraw/zinc/12/08/96/621120896.db2.gz CLDHHPZCHCJQFC-UHFFFAOYSA-N 0 3 284.359 2.614 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CO)CCc1ccccc1)CC2 ZINC000903292108 621311697 /nfs/dbraw/zinc/31/16/97/621311697.db2.gz BFDAYESCLCEZMJ-IAGOWNOFSA-N 0 3 297.398 2.963 20 10 CFCDHN COc1nn(C)cc1CN[C@@H](C)c1c(C)cc(C)cc1O ZINC000903336780 621333073 /nfs/dbraw/zinc/33/30/73/621333073.db2.gz DUYNNSSVPVLMKU-LBPRGKRZSA-N 0 3 289.379 2.602 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@H](C)c2cc(F)ccc2[O-])CCOC1 ZINC000903357525 621347472 /nfs/dbraw/zinc/34/74/72/621347472.db2.gz MZOAQUSSIBWEDK-WBMJQRKESA-N 0 3 297.370 2.766 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCOC23CCOCC3)c([O-])c1 ZINC000903391622 621351336 /nfs/dbraw/zinc/35/13/36/621351336.db2.gz ZQWTVBRMZAVGEV-BBRMVZONSA-N 0 3 291.391 2.689 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCCN(CC)C1=O)c1ccc(C)cc1[O-] ZINC000903387784 621358648 /nfs/dbraw/zinc/35/86/48/621358648.db2.gz JBJSTNVSYWUFBO-GJZGRUSLSA-N 0 3 290.407 2.752 20 10 CFCDHN Cc1ccc(O)c(CN2CCOc3ccc(N)cc3C2)c1 ZINC000903947086 621485073 /nfs/dbraw/zinc/48/50/73/621485073.db2.gz NRRDZFXQUCMWIX-UHFFFAOYSA-N 0 3 284.359 2.677 20 10 CFCDHN Cc1cc(O)c(CN2CCOc3ccc(N)cc3C2)cc1C ZINC000903947468 621485171 /nfs/dbraw/zinc/48/51/71/621485171.db2.gz WAMVRIDANTUBDD-UHFFFAOYSA-N 0 3 298.386 2.986 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2Cc3ccccc3[C@H]2N)c([O-])c1 ZINC000904462311 621597171 /nfs/dbraw/zinc/59/71/71/621597171.db2.gz UQBRFUAAGXDOCD-SJLPKXTDSA-N 0 3 298.386 2.505 20 10 CFCDHN CN(C)c1ccc(CN[C@](C)(CO)c2ccccc2)cc1 ZINC000227212431 623100901 /nfs/dbraw/zinc/10/09/01/623100901.db2.gz YAXOGTYXGJPSCM-GOSISDBHSA-N 0 3 284.403 2.750 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CCOC2)c1[O-] ZINC000169090159 623113011 /nfs/dbraw/zinc/11/30/11/623113011.db2.gz CJRSURDUOQKFJZ-VHSXEESVSA-N 0 3 285.771 2.569 20 10 CFCDHN CC(C)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000228969985 623171479 /nfs/dbraw/zinc/17/14/79/623171479.db2.gz JFHLVDPOUUKUAY-UONOGXRCSA-N 0 3 291.439 2.564 20 10 CFCDHN C[C@@H]1CC[C@H](C[NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000230402266 623275285 /nfs/dbraw/zinc/27/52/85/623275285.db2.gz NXLGGULLOGFHFM-MNOVXSKESA-N 0 3 263.337 2.647 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)CC2 ZINC000312013516 623487336 /nfs/dbraw/zinc/48/73/36/623487336.db2.gz JJRXBEMAWFNASZ-BNOWGMLFSA-N 0 3 261.365 2.520 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](OC)[C@H](C)CC)c([O-])c1 ZINC000824596808 623529367 /nfs/dbraw/zinc/52/93/67/623529367.db2.gz LPNKRDUBJTTWDT-WBMJQRKESA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637187 623537834 /nfs/dbraw/zinc/53/78/34/623537834.db2.gz WNWBHONHRHDVMG-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637187 623537840 /nfs/dbraw/zinc/53/78/40/623537840.db2.gz WNWBHONHRHDVMG-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824716385 623551242 /nfs/dbraw/zinc/55/12/42/623551242.db2.gz UBUYCEAVIHFUJE-LZWOXQAQSA-N 0 3 279.355 2.657 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824716385 623551244 /nfs/dbraw/zinc/55/12/44/623551244.db2.gz UBUYCEAVIHFUJE-LZWOXQAQSA-N 0 3 279.355 2.657 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C2CCN(C)CC2)cc1Cl ZINC000825065047 623621660 /nfs/dbraw/zinc/62/16/60/623621660.db2.gz RGWAFYREKYXBNP-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2COCC2(C)C)c1[O-] ZINC000825090533 623627246 /nfs/dbraw/zinc/62/72/46/623627246.db2.gz BEZVHQMQAYBSGU-LBPRGKRZSA-N 0 3 269.772 2.869 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC[C@H]2CCOC2)c([O-])c1 ZINC000825134140 623637416 /nfs/dbraw/zinc/63/74/16/623637416.db2.gz VPGAEUASINPFNY-ZDUSSCGKSA-N 0 3 279.380 2.697 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](C)CCN(C)C)cc1Cl ZINC000825173847 623644401 /nfs/dbraw/zinc/64/44/01/623644401.db2.gz UWQJGAKYLRZNBF-NSHDSACASA-N 0 3 270.804 2.784 20 10 CFCDHN Cc1nccn1CC[NH2+]Cc1cc(Cl)c(C)cc1[O-] ZINC000825174155 623645390 /nfs/dbraw/zinc/64/53/90/623645390.db2.gz ZAFUEMJUXZIEKT-UHFFFAOYSA-N 0 3 279.771 2.649 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H]2CCCN(C)C2)cc1Cl ZINC000825258287 623660657 /nfs/dbraw/zinc/66/06/57/623660657.db2.gz BSQFDABMXRFERU-LBPRGKRZSA-N 0 3 282.815 2.785 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CCCO)C2)c1[O-] ZINC000825339068 623676557 /nfs/dbraw/zinc/67/65/57/623676557.db2.gz ZPUNDVFBUIVCQT-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](CCCO)C2)c1[O-] ZINC000825339068 623676565 /nfs/dbraw/zinc/67/65/65/623676565.db2.gz ZPUNDVFBUIVCQT-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827284703 623981277 /nfs/dbraw/zinc/98/12/77/623981277.db2.gz VNJGMXUTPUWCPH-IAQYHMDHSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827284703 623981279 /nfs/dbraw/zinc/98/12/79/623981279.db2.gz VNJGMXUTPUWCPH-IAQYHMDHSA-N 0 3 297.782 2.523 20 10 CFCDHN C[C@H](CO)C[N@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000121392641 624781548 /nfs/dbraw/zinc/78/15/48/624781548.db2.gz IEVMBMSYCZFXIW-ZDUSSCGKSA-N 0 3 275.348 2.616 20 10 CFCDHN C[C@H](CO)C[N@@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000121392641 624781554 /nfs/dbraw/zinc/78/15/54/624781554.db2.gz IEVMBMSYCZFXIW-ZDUSSCGKSA-N 0 3 275.348 2.616 20 10 CFCDHN CCCN(CC(=O)NC(C)(C)CC)Cc1ccccc1O ZINC000069009854 625044933 /nfs/dbraw/zinc/04/49/33/625044933.db2.gz FSVBBUBNAOGNDH-UHFFFAOYSA-N 0 3 292.423 2.909 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834612841 625734604 /nfs/dbraw/zinc/73/46/04/625734604.db2.gz VKVODWPIXSNJOP-MRVWCRGKSA-N 0 3 263.381 2.766 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@H]1CCCO1 ZINC000834694495 625788600 /nfs/dbraw/zinc/78/86/00/625788600.db2.gz VULQBVUWTORQGL-GZBFAFLISA-N 0 3 261.365 2.927 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000083445857 625849811 /nfs/dbraw/zinc/84/98/11/625849811.db2.gz GEWVQKRIFXCGOG-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CCO)Cc1ccccc1)CC2 ZINC000834794011 625863529 /nfs/dbraw/zinc/86/35/29/625863529.db2.gz MAOSCUODHXDISA-IAGOWNOFSA-N 0 3 297.398 2.963 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000834879642 625907814 /nfs/dbraw/zinc/90/78/14/625907814.db2.gz ZZODYIJGOLAOBZ-UMNHJUIQSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1cc(F)ccc1[O-] ZINC000834899047 625914374 /nfs/dbraw/zinc/91/43/74/625914374.db2.gz FDEQAEWHGDNXAK-UHIISALHSA-N 0 3 267.344 2.733 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1O)CC2 ZINC000834899681 625914576 /nfs/dbraw/zinc/91/45/76/625914576.db2.gz JIQFVWWKOOVWBM-MELADBBJSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2cn(C)cn2)c2c1c(F)ccc2[O-] ZINC000840767526 625926094 /nfs/dbraw/zinc/92/60/94/625926094.db2.gz USTRSTSVDKHRQT-ZWNOBZJWSA-N 0 3 289.354 2.645 20 10 CFCDHN CCc1cc(CNCc2ccc3c(c2)CCCO3)n[nH]1 ZINC000921741064 626102634 /nfs/dbraw/zinc/10/26/34/626102634.db2.gz CEAUBGNRZBKLNO-UHFFFAOYSA-N 0 3 271.364 2.587 20 10 CFCDHN Cn1ccc(CNCc2ccc3c(c2)CCCO3)c1 ZINC000921808507 626138438 /nfs/dbraw/zinc/13/84/38/626138438.db2.gz AVOUWTBRMWZLRC-UHFFFAOYSA-N 0 3 256.349 2.640 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)C(OC)OC)cc1F ZINC000922314587 626266812 /nfs/dbraw/zinc/26/68/12/626266812.db2.gz JPLLSIKRTFOHHS-GFCCVEGCSA-N 0 3 298.402 2.769 20 10 CFCDHN CCc1onc(C)c1CNCc1cc(C)ccc1O ZINC000922984184 626437327 /nfs/dbraw/zinc/43/73/27/626437327.db2.gz WAAGHERVMUERBE-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2c3ccccc3CC[C@H]2O)cc1 ZINC000922988945 626440231 /nfs/dbraw/zinc/44/02/31/626440231.db2.gz ZNILJJJJSIDANZ-MOPGFXCFSA-N 0 3 296.414 2.891 20 10 CFCDHN CCOc1ccc(C[NH2+]C2([C@H]3CCCCO3)CC2)c([O-])c1 ZINC000923026907 626443965 /nfs/dbraw/zinc/44/39/65/626443965.db2.gz DNNDLBQJKBVSEU-MRXNPFEDSA-N 0 3 291.391 2.982 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@@H](OC)C23CCC3)c([O-])c1 ZINC000839179858 626529747 /nfs/dbraw/zinc/52/97/47/626529747.db2.gz ALQUIULUAINGGI-HZPDHXFCSA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCOCC3(CCC3)C2)c([O-])c1 ZINC000761226475 626817455 /nfs/dbraw/zinc/81/74/55/626817455.db2.gz QNNCZTFJDGODNQ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCOCC3(CCC3)C2)c([O-])c1 ZINC000761226475 626817458 /nfs/dbraw/zinc/81/74/58/626817458.db2.gz QNNCZTFJDGODNQ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(CNCc2ccc(F)cn2)c(O)c1 ZINC000763518564 626993673 /nfs/dbraw/zinc/99/36/73/626993673.db2.gz LWKRMDQXPMQXNW-UHFFFAOYSA-N 0 3 276.311 2.615 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCC(=O)N(CC)CC)cc1 ZINC000765331834 627131068 /nfs/dbraw/zinc/13/10/68/627131068.db2.gz GEAOGQFKYUCEAQ-CQSZACIVSA-N 0 3 291.439 2.662 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000767926118 627295246 /nfs/dbraw/zinc/29/52/46/627295246.db2.gz AQGUVVGSNSNKIR-AWEZNQCLSA-N 0 3 291.391 2.982 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000768892939 627384116 /nfs/dbraw/zinc/38/41/16/627384116.db2.gz UNRCFOQAWOHDSY-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000768892939 627384120 /nfs/dbraw/zinc/38/41/20/627384120.db2.gz UNRCFOQAWOHDSY-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)C[C@H]2CCCO2)c([O-])c1 ZINC000769029566 627396697 /nfs/dbraw/zinc/39/66/97/627396697.db2.gz KXJSTURKXCUYPQ-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)C[C@H]2CCCO2)c([O-])c1 ZINC000769029566 627396700 /nfs/dbraw/zinc/39/67/00/627396700.db2.gz KXJSTURKXCUYPQ-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@H](C)CCSC ZINC000769462230 627442474 /nfs/dbraw/zinc/44/24/74/627442474.db2.gz CKYUFZIJKILBDD-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@H](C)CCSC ZINC000769462230 627442477 /nfs/dbraw/zinc/44/24/77/627442477.db2.gz CKYUFZIJKILBDD-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCc1nccs1 ZINC000769544622 627454356 /nfs/dbraw/zinc/45/43/56/627454356.db2.gz ZKEUMGYKBNRCOE-UHFFFAOYSA-N 0 3 278.377 2.532 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCc1nccs1 ZINC000769544622 627454357 /nfs/dbraw/zinc/45/43/57/627454357.db2.gz ZKEUMGYKBNRCOE-UHFFFAOYSA-N 0 3 278.377 2.532 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1ccsc1)c1cc(F)ccc1[O-] ZINC000769990581 627494740 /nfs/dbraw/zinc/49/47/40/627494740.db2.gz UVXCBACOIREFKL-NOZJJQNGSA-N 0 3 281.352 2.977 20 10 CFCDHN C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)c1ccnn1C ZINC000774362266 627918855 /nfs/dbraw/zinc/91/88/55/627918855.db2.gz JIDMFAYUBXJKJK-CHWSQXEVSA-N 0 3 272.396 2.898 20 10 CFCDHN COc1cccc(CNc2ccnc3ccccc32)c1O ZINC000774528650 627935142 /nfs/dbraw/zinc/93/51/42/627935142.db2.gz JGPDGBMRJYWAJT-UHFFFAOYSA-N 0 3 280.327 2.983 20 10 CFCDHN CC[C@H]([NH2+]C1COC(C)(C)OC1)c1ccccc1[O-] ZINC000775552486 628036301 /nfs/dbraw/zinc/03/63/01/628036301.db2.gz WOJACSQBHCDTGS-ZDUSSCGKSA-N 0 3 265.353 2.584 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000775556385 628037055 /nfs/dbraw/zinc/03/70/55/628037055.db2.gz XRWZQQWRGKOPKQ-OFQRWUPVSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCO)C1CCOCC1)c1ccccc1[O-] ZINC000775555182 628037208 /nfs/dbraw/zinc/03/72/08/628037208.db2.gz KCYHOHOKDIOJQT-CVEARBPZSA-N 0 3 293.407 2.611 20 10 CFCDHN CC(C)[C@H]1CCN1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000775763942 628064424 /nfs/dbraw/zinc/06/44/24/628064424.db2.gz HTUUPCXZZAZXFE-MRXNPFEDSA-N 0 3 292.398 2.893 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](COC)OC ZINC000852018302 634628066 /nfs/dbraw/zinc/62/80/66/634628066.db2.gz LJQKAJIHKOQEID-HNNXBMFYSA-N 0 3 281.396 2.656 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](COC)OC ZINC000852018302 634628070 /nfs/dbraw/zinc/62/80/70/634628070.db2.gz LJQKAJIHKOQEID-HNNXBMFYSA-N 0 3 281.396 2.656 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)cc(OC)c2)c([O-])c1 ZINC000776252090 628122066 /nfs/dbraw/zinc/12/20/66/628122066.db2.gz GVULAJYESLCCDN-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@H](C)[C@@H](OC)C2(C)C)c([O-])c1 ZINC000776497659 628154130 /nfs/dbraw/zinc/15/41/30/628154130.db2.gz DVRLRKAIRMRHBE-IUIKQTSFSA-N 0 3 293.407 2.940 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@@H](C3CC3)C2)c1 ZINC000776770496 628176409 /nfs/dbraw/zinc/17/64/09/628176409.db2.gz ARYWDVKVANZSKI-OAHLLOKOSA-N 0 3 261.365 2.620 20 10 CFCDHN CO[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)C(F)(F)F ZINC000777009010 628191533 /nfs/dbraw/zinc/19/15/33/628191533.db2.gz HMKLMHFTHBCAIP-GXFFZTMASA-N 0 3 290.329 2.981 20 10 CFCDHN O=C(Nc1ccccc1)C1(NCc2ccccc2O)CC1 ZINC000778218198 628288387 /nfs/dbraw/zinc/28/83/87/628288387.db2.gz QZZAUOXCXGVBMJ-UHFFFAOYSA-N 0 3 282.343 2.653 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[O-])C[C@H](C)S1 ZINC000779003075 628344728 /nfs/dbraw/zinc/34/47/28/628344728.db2.gz ORVYDYKFVLWEEM-AOOOYVTPSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc(F)ccc2[O-])C[C@H](C)S1 ZINC000779003075 628344730 /nfs/dbraw/zinc/34/47/30/628344730.db2.gz ORVYDYKFVLWEEM-AOOOYVTPSA-N 0 3 255.358 2.857 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1cccc2c1OCCO2 ZINC000779047169 628348529 /nfs/dbraw/zinc/34/85/29/628348529.db2.gz WXRSWFRJURCUNK-UHFFFAOYSA-N 0 3 289.306 2.592 20 10 CFCDHN Oc1ccc(F)cc1CNCc1cccc2c1OCCO2 ZINC000779047169 628348532 /nfs/dbraw/zinc/34/85/32/628348532.db2.gz WXRSWFRJURCUNK-UHFFFAOYSA-N 0 3 289.306 2.592 20 10 CFCDHN COC[C@H](Cc1ccccc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779086492 628351479 /nfs/dbraw/zinc/35/14/79/628351479.db2.gz FZDQKHPEIYXIFJ-INIZCTEOSA-N 0 3 289.350 2.879 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000779117518 628353830 /nfs/dbraw/zinc/35/38/30/628353830.db2.gz XQOHNTOYJXLOSW-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000779117518 628353833 /nfs/dbraw/zinc/35/38/33/628353833.db2.gz XQOHNTOYJXLOSW-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN CC[C@@]1(O)CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000779218564 628361081 /nfs/dbraw/zinc/36/10/81/628361081.db2.gz HBKALJAZTQWNRC-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN CC[C@@]1(O)CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000779218564 628361083 /nfs/dbraw/zinc/36/10/83/628361083.db2.gz HBKALJAZTQWNRC-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)[C@H]2CCCOC2)c([O-])c1 ZINC000779987839 628425105 /nfs/dbraw/zinc/42/51/05/628425105.db2.gz HFMHFJCITCAORY-JSGCOSHPSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000783510721 628714505 /nfs/dbraw/zinc/71/45/05/628714505.db2.gz SHZFKDJVKQTBJT-OCCSQVGLSA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccccc1[O-] ZINC000783516500 628715726 /nfs/dbraw/zinc/71/57/26/628715726.db2.gz COUGWCQMDHRLNL-UONOGXRCSA-N 0 3 291.391 2.771 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000783596104 628725369 /nfs/dbraw/zinc/72/53/69/628725369.db2.gz BBJRAZMZHZEKDP-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000783596104 628725372 /nfs/dbraw/zinc/72/53/72/628725372.db2.gz BBJRAZMZHZEKDP-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](O)C[C@H]2C)cc1F ZINC000788270836 629054222 /nfs/dbraw/zinc/05/42/22/629054222.db2.gz SOGOTXMNYHCXBP-OCCSQVGLSA-N 0 3 280.387 2.627 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@]2(CC)CO)c([O-])c1 ZINC000789568070 629167492 /nfs/dbraw/zinc/16/74/92/629167492.db2.gz VZYPFGYUXIPAIO-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@]2(CC)CO)c([O-])c1 ZINC000789568070 629167493 /nfs/dbraw/zinc/16/74/93/629167493.db2.gz VZYPFGYUXIPAIO-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](O)C(C)(C)C2)cc1F ZINC000790937151 629272836 /nfs/dbraw/zinc/27/28/36/629272836.db2.gz KJPSUOJOQKTQCV-MRXNPFEDSA-N 0 3 294.414 2.875 20 10 CFCDHN CN(C)c1ccc(/C=C/CN(C)C[C@H]2CCCO2)cc1 ZINC000835025028 629320708 /nfs/dbraw/zinc/32/07/08/629320708.db2.gz FWSXUDSUBXMWET-UKINESCASA-N 0 3 274.408 2.877 20 10 CFCDHN Cc1cc(CNCC=Cc2ccc(N(C)C)cc2)[nH]n1 ZINC000835040332 629334639 /nfs/dbraw/zinc/33/46/39/629334639.db2.gz PKXOYEHYVCALIO-PLNGDYQASA-N 0 3 270.380 2.587 20 10 CFCDHN CCOCCN(C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835045523 629341807 /nfs/dbraw/zinc/34/18/07/629341807.db2.gz VXBXEFVODFRVLX-SREVYHEPSA-N 0 3 262.397 2.734 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CCOCC3(CC3)C2)cc1 ZINC000835047316 629345999 /nfs/dbraw/zinc/34/59/99/629345999.db2.gz GAKHXRYMQQYZJV-ONEGZZNKSA-N 0 3 286.419 2.878 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]Cc2ncccc2[O-])c1O ZINC000793258708 629516418 /nfs/dbraw/zinc/51/64/18/629516418.db2.gz MTQRWSHHDOOTFZ-UHFFFAOYSA-N 0 3 278.739 2.744 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c([O-])c1 ZINC000793607959 629578320 /nfs/dbraw/zinc/57/83/20/629578320.db2.gz GNUNPJFBQXEYFO-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c([O-])c1 ZINC000793607959 629578325 /nfs/dbraw/zinc/57/83/25/629578325.db2.gz GNUNPJFBQXEYFO-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1CCCc2nn(C)cc21 ZINC000794799881 629686899 /nfs/dbraw/zinc/68/68/99/629686899.db2.gz ADXONMFOINKNRD-KRWDZBQOSA-N 0 3 298.434 2.962 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCCN(C)C1)c1ccc(C)cc1[O-] ZINC000794804799 629687931 /nfs/dbraw/zinc/68/79/31/629687931.db2.gz WGGDTGIBXVXDOH-ZFWWWQNUSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)C(C)(C)O)c1ccc(C)cc1[O-] ZINC000794814622 629689285 /nfs/dbraw/zinc/68/92/85/629689285.db2.gz RSOSCZDMXLDNEF-DGCLKSJQSA-N 0 3 251.370 2.901 20 10 CFCDHN CC[C@@H]([NH2+]CCc1ccn(C)n1)c1ccc(C)cc1[O-] ZINC000794812739 629689610 /nfs/dbraw/zinc/68/96/10/629689610.db2.gz FICREYVDLQVAGR-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C[C@H](C)O)c1ccc(C)cc1[O-] ZINC000794818761 629690148 /nfs/dbraw/zinc/69/01/48/629690148.db2.gz TVMLQUWDCUBQHZ-DYEKYZERSA-N 0 3 251.370 2.901 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCO)C1CC1)c1ccc(C)cc1[O-] ZINC000794818673 629690410 /nfs/dbraw/zinc/69/04/10/629690410.db2.gz UVOCLAHKRPLFAZ-HUUCEWRRSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H](c2nccn2C)C2CC2)c1 ZINC000796465596 629921663 /nfs/dbraw/zinc/92/16/63/629921663.db2.gz KQJBFOCASWQJRZ-OAHLLOKOSA-N 0 3 271.364 2.675 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CSC[C@@H]2C)c([O-])c1 ZINC000796485755 629925420 /nfs/dbraw/zinc/92/54/20/629925420.db2.gz ZKRPHSLLDQXBER-GXFFZTMASA-N 0 3 267.394 2.632 20 10 CFCDHN Cc1ccc(O)c(CN2CCN(c3cnccc3C)CC2)c1 ZINC000798962761 630264710 /nfs/dbraw/zinc/26/47/10/630264710.db2.gz YSAHPXLRRCGTMI-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCCSC)c([O-])c1 ZINC000798963293 630265752 /nfs/dbraw/zinc/26/57/52/630265752.db2.gz CFTVWWBEOZMMTN-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCCSC)c([O-])c1 ZINC000798963293 630265754 /nfs/dbraw/zinc/26/57/54/630265754.db2.gz CFTVWWBEOZMMTN-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CC[S@@](=O)CC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808696180 630400113 /nfs/dbraw/zinc/40/01/13/630400113.db2.gz STZLPRAXTIYMSU-XTZNXHDOSA-N 0 3 289.828 2.773 20 10 CFCDHN C[C@@H]1CCC[C@](C[NH2+]Cc2ccccc2[O-])(N(C)C)C1 ZINC000040668244 649985783 /nfs/dbraw/zinc/98/57/83/649985783.db2.gz VGWRIMLRSNKILX-PBHICJAKSA-N 0 3 276.424 2.992 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCNC(=O)C2CC2)c1[O-] ZINC000808672712 631026610 /nfs/dbraw/zinc/02/66/10/631026610.db2.gz RQOQUPFAWSSYIW-JTQLQIEISA-N 0 3 296.798 2.531 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808680518 631027343 /nfs/dbraw/zinc/02/73/43/631027343.db2.gz JUMPAQLWSVUJTA-NSHDSACASA-N 0 3 298.814 2.873 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)CCO)c1[O-] ZINC000808697668 631031147 /nfs/dbraw/zinc/03/11/47/631031147.db2.gz QQXKFHNQXFNJCJ-NXEZZACHSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2ccnn2C)c1[O-] ZINC000808715909 631034189 /nfs/dbraw/zinc/03/41/89/631034189.db2.gz YRAXOKDDWOXWQE-LLVKDONJSA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)CN(C)C)c1[O-] ZINC000808717223 631034819 /nfs/dbraw/zinc/03/48/19/631034819.db2.gz CCXCYRSWXIVXPH-QWRGUYRKSA-N 0 3 270.804 2.955 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cncc(OC)c2)c1 ZINC000808743636 631041721 /nfs/dbraw/zinc/04/17/21/631041721.db2.gz KIFMVLXZRMVTKX-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@H](O)C(C)C ZINC000840882998 631249568 /nfs/dbraw/zinc/24/95/68/631249568.db2.gz RCCHNWYIVZUVHS-VZJVUDMVSA-N 0 3 269.360 2.977 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNC1(CF)CCOCC1 ZINC000840950826 631278790 /nfs/dbraw/zinc/27/87/90/631278790.db2.gz OTSUCCCOEMFZNU-UHFFFAOYSA-N 0 3 280.387 2.669 20 10 CFCDHN COCC1(C)CN(Cc2ccc(N(C)C)cc2C)C1 ZINC000840952696 631280422 /nfs/dbraw/zinc/28/04/22/631280422.db2.gz GIWQTZLEIDWNLM-UHFFFAOYSA-N 0 3 262.397 2.529 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000840977208 631293072 /nfs/dbraw/zinc/29/30/72/631293072.db2.gz IVDOGGCOPSDZIV-HNNXBMFYSA-N 0 3 286.350 2.900 20 10 CFCDHN Cc1ccc2c(c1)CCN2C(=O)c1cccc2c1CCNC2 ZINC000852885052 634854864 /nfs/dbraw/zinc/85/48/64/634854864.db2.gz RWAUSDQSGUTMAF-UHFFFAOYSA-N 0 3 292.382 2.844 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@](C)(O)C2)c2c1c(F)ccc2[O-] ZINC000841758181 631467591 /nfs/dbraw/zinc/46/75/91/631467591.db2.gz FJLUAMLJDOMWNE-QFKQNQDGSA-N 0 3 265.328 2.583 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@H]2C[C@@](C)(O)C2)c2c1c(F)ccc2[O-] ZINC000841758180 631468146 /nfs/dbraw/zinc/46/81/46/631468146.db2.gz FJLUAMLJDOMWNE-HSBLTNELSA-N 0 3 265.328 2.583 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](CC(C)C)OC)c([O-])c1 ZINC000841888827 631487821 /nfs/dbraw/zinc/48/78/21/631487821.db2.gz SGZWDRPOZYIJQV-HNNXBMFYSA-N 0 3 281.396 2.942 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)C2CCCC2)c1[O-] ZINC000811518896 631576560 /nfs/dbraw/zinc/57/65/60/631576560.db2.gz QVHKYUNYXINMHW-AWEZNQCLSA-N 0 3 283.799 2.995 20 10 CFCDHN COc1ccc(O)c(CNc2ccnc3ccccc32)c1 ZINC000811806019 631624821 /nfs/dbraw/zinc/62/48/21/631624821.db2.gz HTOWRBNGOJXASG-UHFFFAOYSA-N 0 3 280.327 2.983 20 10 CFCDHN CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](CN)C(C)(C)C)c1[O-] ZINC000842475532 631640570 /nfs/dbraw/zinc/64/05/70/631640570.db2.gz RXAZRMIFMQZDND-ZDUSSCGKSA-N 0 3 298.814 2.711 20 10 CFCDHN COc1cc(C)cc(CN2C[C@@H](C)OC3(CCC3)C2)c1O ZINC000842641676 631689816 /nfs/dbraw/zinc/68/98/16/631689816.db2.gz DPLREWFVKUEFKV-CYBMUJFWSA-N 0 3 291.391 2.853 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CO)C[C@@H](C)CC)c([O-])c1 ZINC000842753139 631728959 /nfs/dbraw/zinc/72/89/59/631728959.db2.gz CFBYUSLKARBPQA-GXTWGEPZSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)[C@]2(O)CCOC2)c1 ZINC000842917815 631782046 /nfs/dbraw/zinc/78/20/46/631782046.db2.gz BKFBEZWVUNYIRS-DYVFJYSZSA-N 0 3 293.407 2.529 20 10 CFCDHN Cc1cc([O-])c(CN(C)C2CC[NH2+]CC2)c(Cl)c1 ZINC000843046417 631814130 /nfs/dbraw/zinc/81/41/30/631814130.db2.gz VHRGSXQPPSGRFM-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419651 631950280 /nfs/dbraw/zinc/95/02/80/631950280.db2.gz NUBCJDHZBDURTL-CQSZACIVSA-N 0 3 284.359 2.785 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419651 631950281 /nfs/dbraw/zinc/95/02/81/631950281.db2.gz NUBCJDHZBDURTL-CQSZACIVSA-N 0 3 284.359 2.785 20 10 CFCDHN CCOc1ccc(CNCc2occc2C)c(O)c1 ZINC000813790084 631959976 /nfs/dbraw/zinc/95/99/76/631959976.db2.gz DRXDCLBONUZFIE-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1[O-])CN(C)C ZINC000813877174 631971064 /nfs/dbraw/zinc/97/10/64/631971064.db2.gz NIYJIVAFWFSATA-NXEZZACHSA-N 0 3 272.339 2.519 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c1 ZINC000814171685 632022172 /nfs/dbraw/zinc/02/21/72/632022172.db2.gz UOSZIHDSYQDDSW-MRXNPFEDSA-N 0 3 277.408 2.977 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000814178536 632024845 /nfs/dbraw/zinc/02/48/45/632024845.db2.gz UHEDXARZERRUMB-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000814178536 632024850 /nfs/dbraw/zinc/02/48/50/632024850.db2.gz UHEDXARZERRUMB-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc(O)c(CNCc2cc(OC)ccc2F)c1 ZINC000815126813 632208888 /nfs/dbraw/zinc/20/88/88/632208888.db2.gz RZXVCNKTAVCTPL-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])c1cc[nH]c(=O)c1 ZINC000815642519 632303528 /nfs/dbraw/zinc/30/35/28/632303528.db2.gz FBZJNNDMAXRGPZ-MNOVXSKESA-N 0 3 258.321 2.905 20 10 CFCDHN CN1CCN(Cc2ccccc2O)c2ccccc2C1 ZINC000816617543 632495645 /nfs/dbraw/zinc/49/56/45/632495645.db2.gz CJZJRXDSGYYKGO-UHFFFAOYSA-N 0 3 268.360 2.844 20 10 CFCDHN Cc1cc(C[NH2+]Cc2cc(F)ccc2[O-])cc(C)n1 ZINC000817410626 632623403 /nfs/dbraw/zinc/62/34/03/632623403.db2.gz NTOYSUJZMWDIJK-UHFFFAOYSA-N 0 3 260.312 2.833 20 10 CFCDHN CC[C@H]([NH2+]CCC1(CO)CCC1)c1ccccc1[O-] ZINC000846105188 632632597 /nfs/dbraw/zinc/63/25/97/632632597.db2.gz RBHIOLUPWYLXGA-AWEZNQCLSA-N 0 3 263.381 2.986 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](CO)CCF)c1[O-] ZINC000846209375 632661088 /nfs/dbraw/zinc/66/10/88/632661088.db2.gz QQPZEWZZGHISEY-GXSJLCMTSA-N 0 3 275.751 2.725 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H](C)c1cnccc1N ZINC000817893061 632719885 /nfs/dbraw/zinc/71/98/85/632719885.db2.gz CMMHIWPGAKNHSP-ZDUSSCGKSA-N 0 3 284.407 2.719 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCNC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940727 632744433 /nfs/dbraw/zinc/74/44/33/632744433.db2.gz KDHCSFPJHHCIIC-VHSXEESVSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@H](N[C@@H]1CCC[NH2+]C1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940727 632744435 /nfs/dbraw/zinc/74/44/35/632744435.db2.gz KDHCSFPJHHCIIC-VHSXEESVSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](N)c1ccccc1)c1ccccc1[O-] ZINC000817955018 632754918 /nfs/dbraw/zinc/75/49/18/632754918.db2.gz OSXWZPQYDRRXGX-IUODEOHRSA-N 0 3 256.349 2.743 20 10 CFCDHN C[C@H](CN)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817966843 632766451 /nfs/dbraw/zinc/76/64/51/632766451.db2.gz WXVLXGRDFFXDLO-RNFRBKRXSA-N 0 3 263.168 2.697 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCCNC1)c1ccc(F)cc1[O-] ZINC000817983577 632779678 /nfs/dbraw/zinc/77/96/78/632779678.db2.gz GSOAWVIFIADIKX-OCCSQVGLSA-N 0 3 266.360 2.714 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+](C)[C@H]3CCOC3)c2c1 ZINC000106858162 632986923 /nfs/dbraw/zinc/98/69/23/632986923.db2.gz SOPIHYBBXAIOSU-ZDUSSCGKSA-N 0 3 287.359 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+](C)[C@H]3CCOC3)c2c1 ZINC000106858162 632986926 /nfs/dbraw/zinc/98/69/26/632986926.db2.gz SOPIHYBBXAIOSU-ZDUSSCGKSA-N 0 3 287.359 2.775 20 10 CFCDHN COC[C@H](CC(C)(C)C)[NH2+]Cc1c([O-])cccc1OC ZINC000848567659 633291402 /nfs/dbraw/zinc/29/14/02/633291402.db2.gz ZDYYYKVQTAETPS-LBPRGKRZSA-N 0 3 281.396 2.942 20 10 CFCDHN CCc1cccc(CN2CCO[C@H](C3CCC3)C2)c1O ZINC000848916543 633400390 /nfs/dbraw/zinc/40/03/90/633400390.db2.gz IJPWHERNKGJGBH-INIZCTEOSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1cccc(CN2CCO[C@]3(CCSC3)C2)c1O ZINC000848919292 633401636 /nfs/dbraw/zinc/40/16/36/633401636.db2.gz JGPPJSLLDPGNHH-MRXNPFEDSA-N 0 3 293.432 2.663 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1cc(F)ccc1[O-])C(C)C ZINC000848927400 633409684 /nfs/dbraw/zinc/40/96/84/633409684.db2.gz DZLLRFKEZWDIOE-UHFFFAOYSA-N 0 3 283.343 2.695 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1cc(F)ccc1[O-])C(C)C ZINC000848927400 633409686 /nfs/dbraw/zinc/40/96/86/633409686.db2.gz DZLLRFKEZWDIOE-UHFFFAOYSA-N 0 3 283.343 2.695 20 10 CFCDHN CN(C)c1ccc(CNCc2c(C3CC3)cnn2C)cc1 ZINC000850011628 633790654 /nfs/dbraw/zinc/79/06/54/633790654.db2.gz RBTBTUVOPTXBOJ-UHFFFAOYSA-N 0 3 284.407 2.653 20 10 CFCDHN C[C@H](NCc1cnc2n1CCC2)c1ccc(N(C)C)cc1 ZINC000850251982 633913589 /nfs/dbraw/zinc/91/35/89/633913589.db2.gz JTZISCJIBJTDJA-ZDUSSCGKSA-N 0 3 284.407 2.746 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H](CO)C2CCC2)c2c1c(F)ccc2[O-] ZINC000850487383 634014498 /nfs/dbraw/zinc/01/44/98/634014498.db2.gz IDIRYXUGAUHMHS-WQAKAFBOSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@@H](O)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000850528675 634036350 /nfs/dbraw/zinc/03/63/50/634036350.db2.gz JRYUDLKZZBFYDA-MWLCHTKSSA-N 0 3 257.761 2.776 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000850555935 634052216 /nfs/dbraw/zinc/05/22/16/634052216.db2.gz KCNKYQZTOAFFEX-OLZOCXBDSA-N 0 3 290.407 2.690 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)CC2 ZINC000850565527 634054756 /nfs/dbraw/zinc/05/47/56/634054756.db2.gz DBVIMIZSDIJNCV-GFCCVEGCSA-N 0 3 297.345 2.910 20 10 CFCDHN CO[C@@]1(C)C[C@H]1[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000850570789 634056186 /nfs/dbraw/zinc/05/61/86/634056186.db2.gz IYZUFMBPXADIMK-MTOSAUPQSA-N 0 3 265.328 2.847 20 10 CFCDHN C[N@H+](CCn1cccn1)Cc1c([O-])ccc2ccccc21 ZINC000111169634 634939652 /nfs/dbraw/zinc/93/96/52/634939652.db2.gz KFIHIONRPWTUFA-UHFFFAOYSA-N 0 3 281.359 2.874 20 10 CFCDHN C[N@@H+](CCn1cccn1)Cc1c([O-])ccc2ccccc21 ZINC000111169634 634939655 /nfs/dbraw/zinc/93/96/55/634939655.db2.gz KFIHIONRPWTUFA-UHFFFAOYSA-N 0 3 281.359 2.874 20 10 CFCDHN C[NH2+]C[C@@H](C)N[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000854230890 635265893 /nfs/dbraw/zinc/26/58/93/635265893.db2.gz BGRVQPDQKBCJPZ-HTQZYQBOSA-N 0 3 277.195 2.958 20 10 CFCDHN CNC[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233080 635268285 /nfs/dbraw/zinc/26/82/85/635268285.db2.gz WQXHXQRIIPQUTE-RKDXNWHRSA-N 0 3 276.302 2.670 20 10 CFCDHN C[NH2+]C[C@@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233080 635268288 /nfs/dbraw/zinc/26/82/88/635268288.db2.gz WQXHXQRIIPQUTE-RKDXNWHRSA-N 0 3 276.302 2.670 20 10 CFCDHN O=C(N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc([O-])cs1 ZINC000855814990 635659104 /nfs/dbraw/zinc/65/91/04/635659104.db2.gz MVGRSPHNOIXGRY-LLVKDONJSA-N 0 3 294.420 2.591 20 10 CFCDHN O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc([O-])cs1 ZINC000855814990 635659109 /nfs/dbraw/zinc/65/91/09/635659109.db2.gz MVGRSPHNOIXGRY-LLVKDONJSA-N 0 3 294.420 2.591 20 10 CFCDHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)C1=CC(=O)CS1 ZINC000855814990 635659111 /nfs/dbraw/zinc/65/91/11/635659111.db2.gz MVGRSPHNOIXGRY-LLVKDONJSA-N 0 3 294.420 2.591 20 10 CFCDHN Cc1ccc(O[C@H]2CC[N@H+](Cc3ccccc3[O-])C2)nc1 ZINC000858010595 636113479 /nfs/dbraw/zinc/11/34/79/636113479.db2.gz CVUHNLZPEBUBCU-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccccc3[O-])C2)nc1 ZINC000858010595 636113485 /nfs/dbraw/zinc/11/34/85/636113485.db2.gz CVUHNLZPEBUBCU-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN C[C@@H](CC(C)(C)O)NCc1cc(F)c(N(C)C)cc1F ZINC000858172837 636147200 /nfs/dbraw/zinc/14/72/00/636147200.db2.gz IISLLQLCDMUGDV-JTQLQIEISA-N 0 3 286.366 2.670 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000858567345 636294826 /nfs/dbraw/zinc/29/48/26/636294826.db2.gz WJLUDNAROWTOHJ-GVXVVHGQSA-N 0 3 278.371 2.763 20 10 CFCDHN CCCCNC(=O)CC[N@H+](CCC)Cc1ccccc1[O-] ZINC000116275668 636324821 /nfs/dbraw/zinc/32/48/21/636324821.db2.gz QBZKGOBMLDNIHW-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN CCCCNC(=O)CC[N@@H+](CCC)Cc1ccccc1[O-] ZINC000116275668 636324837 /nfs/dbraw/zinc/32/48/37/636324837.db2.gz QBZKGOBMLDNIHW-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN CC(C)N(Cc1cc(F)c(N(C)C)cc1F)C[C@H](C)O ZINC000862241402 637296273 /nfs/dbraw/zinc/29/62/73/637296273.db2.gz UWTUALBRALPSBS-NSHDSACASA-N 0 3 286.366 2.622 20 10 CFCDHN COc1cc(Br)cc(CN2C[C@@H]3C[C@@H]3C2)c1O ZINC000862440149 637378649 /nfs/dbraw/zinc/37/86/49/637378649.db2.gz FHNBEOYSOPXJGM-DTORHVGOSA-N 0 3 298.180 2.615 20 10 CFCDHN C[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc(Br)cc1[O-] ZINC000863546931 637692955 /nfs/dbraw/zinc/69/29/55/637692955.db2.gz PAKASVJMOGCBMC-HOTUBEGUSA-N 0 3 299.212 2.556 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C(=O)NC)cc1)c1ccccc1[O-] ZINC000120180340 638066286 /nfs/dbraw/zinc/06/62/86/638066286.db2.gz MNJACJAUOYHQCH-INIZCTEOSA-N 0 3 298.386 2.993 20 10 CFCDHN Oc1ccc(CNCc2ccc3c(c2)CCO3)cc1F ZINC000120493255 638270939 /nfs/dbraw/zinc/27/09/39/638270939.db2.gz LAGNVALSDXIYEO-UHFFFAOYSA-N 0 3 273.307 2.756 20 10 CFCDHN [O-]c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1F ZINC000120493255 638270945 /nfs/dbraw/zinc/27/09/45/638270945.db2.gz LAGNVALSDXIYEO-UHFFFAOYSA-N 0 3 273.307 2.756 20 10 CFCDHN CCOc1ccc(O)c(CNCc2ccc(C)o2)c1 ZINC000865724485 638536959 /nfs/dbraw/zinc/53/69/59/638536959.db2.gz VXPFDQUWOJCSDN-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000865778530 638568166 /nfs/dbraw/zinc/56/81/66/638568166.db2.gz KZPVQJVBCYIOKR-AWEZNQCLSA-N 0 3 261.365 2.689 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@@H](CO)C2)c1[O-] ZINC000866415819 638817743 /nfs/dbraw/zinc/81/77/43/638817743.db2.gz FUBKHOKLMRJUPD-JBLDHEPKSA-N 0 3 269.772 2.776 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccnc(F)c1)CC2 ZINC000866474464 638826943 /nfs/dbraw/zinc/82/69/43/638826943.db2.gz MOWZWWXHMWMZKE-GFCCVEGCSA-N 0 3 258.296 2.703 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCn2nccc21)c1ccccc1[O-] ZINC000866631691 638857716 /nfs/dbraw/zinc/85/77/16/638857716.db2.gz CWRKZGVLHZFARO-AAEUAGOBSA-N 0 3 257.337 2.774 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H](O)C1CCCC1)c1ccccc1[O-] ZINC000866636886 638859223 /nfs/dbraw/zinc/85/92/23/638859223.db2.gz CANQWQCDLCZMRC-SWLSCSKDSA-N 0 3 263.381 2.984 20 10 CFCDHN CCN(CC)c1ccc(CNCC2(C)OCCCO2)cc1 ZINC000192248279 650552042 /nfs/dbraw/zinc/55/20/42/650552042.db2.gz NTEPZNPORDTEOW-UHFFFAOYSA-N 0 3 292.423 2.776 20 10 CFCDHN C[C@@H](NC(=O)[C@@H](N)CC1CCCCC1)c1ccccc1O ZINC000870988610 641139682 /nfs/dbraw/zinc/13/96/82/641139682.db2.gz UZBKUGNRACGAAR-DOMZBBRYSA-N 0 3 290.407 2.867 20 10 CFCDHN CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cnc(N)cn1 ZINC000873202894 642064399 /nfs/dbraw/zinc/06/43/99/642064399.db2.gz HQJIKWXNHFAXNO-UHFFFAOYSA-N 0 3 299.422 2.535 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1Cc3ccccc3CN1)CC2 ZINC000873296510 642127768 /nfs/dbraw/zinc/12/77/68/642127768.db2.gz HGZOTBQZBQTHMN-IAGOWNOFSA-N 0 3 294.398 2.684 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCCN1CCc2ccccc21 ZINC000020202315 642323559 /nfs/dbraw/zinc/32/35/59/642323559.db2.gz WCKYZVQBQACFBQ-UHFFFAOYSA-N 0 3 282.387 2.935 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000876591503 642937201 /nfs/dbraw/zinc/93/72/01/642937201.db2.gz IZHIUTQETYCFKB-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN CCC[N@H+](Cc1c(C)cccc1[O-])CC(C)(C)O ZINC000876691159 642975420 /nfs/dbraw/zinc/97/54/20/642975420.db2.gz CKJGXOBSLCBMMG-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC[N@@H+](Cc1c(C)cccc1[O-])CC(C)(C)O ZINC000876691159 642975421 /nfs/dbraw/zinc/97/54/21/642975421.db2.gz CKJGXOBSLCBMMG-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](CCO)CC(C)(C)C ZINC000876695937 642978012 /nfs/dbraw/zinc/97/80/12/642978012.db2.gz LTIQMPUGEMTOTE-UHFFFAOYSA-N 0 3 251.370 2.541 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](CCO)CC(C)(C)C ZINC000876695937 642978014 /nfs/dbraw/zinc/97/80/14/642978014.db2.gz LTIQMPUGEMTOTE-UHFFFAOYSA-N 0 3 251.370 2.541 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876783362 643007424 /nfs/dbraw/zinc/00/74/24/643007424.db2.gz ZYEOCLGYENAMMZ-HIFRSBDPSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876783362 643007427 /nfs/dbraw/zinc/00/74/27/643007427.db2.gz ZYEOCLGYENAMMZ-HIFRSBDPSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876812226 643019756 /nfs/dbraw/zinc/01/97/56/643019756.db2.gz SJEKHVAZRNUNNE-GDBMZVCRSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876812226 643019763 /nfs/dbraw/zinc/01/97/63/643019763.db2.gz SJEKHVAZRNUNNE-GDBMZVCRSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](c1ccco1)N(C)C ZINC000876890935 643054327 /nfs/dbraw/zinc/05/43/27/643054327.db2.gz LZZAQAZSYOWGMC-AWEZNQCLSA-N 0 3 274.364 2.686 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)c([O-])c1 ZINC000876909519 643061422 /nfs/dbraw/zinc/06/14/22/643061422.db2.gz AHSSIQJRWSZZJL-CQSZACIVSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCN1CCc2ccccc2C1 ZINC000876912720 643061770 /nfs/dbraw/zinc/06/17/70/643061770.db2.gz IXGSQHGIPQZKOE-UHFFFAOYSA-N 0 3 296.414 2.849 20 10 CFCDHN Cc1csc(CC[NH2+]Cc2c(C)cccc2[O-])n1 ZINC000876929630 643068078 /nfs/dbraw/zinc/06/80/78/643068078.db2.gz LCYQVMMEGZVUKQ-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000876959678 643082347 /nfs/dbraw/zinc/08/23/47/643082347.db2.gz MZRSJIFLGDDJAO-MRXNPFEDSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2ccccc2C)c([O-])c1 ZINC000877026940 643108908 /nfs/dbraw/zinc/10/89/08/643108908.db2.gz JCVLXARSVFYFCJ-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877029535 643110344 /nfs/dbraw/zinc/11/03/44/643110344.db2.gz GLDXDKNAVNWALL-SWLSCSKDSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c([O-])c1 ZINC000877059023 643126035 /nfs/dbraw/zinc/12/60/35/643126035.db2.gz IZESNWZEOYCMFX-NWANDNLSSA-N 0 3 261.365 2.604 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)C2CCCCC2)c([O-])c1 ZINC000877068049 643132457 /nfs/dbraw/zinc/13/24/57/643132457.db2.gz PJLZQCTZAGFUSE-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1COC2(CCCCC2)O1 ZINC000877137227 643171466 /nfs/dbraw/zinc/17/14/66/643171466.db2.gz STINSZOFADZSIO-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1ccc(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000877316699 643234440 /nfs/dbraw/zinc/23/44/40/643234440.db2.gz LFHPFWIJSMPMQJ-CVEARBPZSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877465778 643285452 /nfs/dbraw/zinc/28/54/52/643285452.db2.gz WWLHPPDBDAQGBX-INIZCTEOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2[C@H](C)O)c([O-])c1 ZINC000877465240 643286214 /nfs/dbraw/zinc/28/62/14/643286214.db2.gz RSJHGPHKRNCKCD-YDHLFZDLSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2[C@H](C)O)c([O-])c1 ZINC000877465240 643286217 /nfs/dbraw/zinc/28/62/17/643286217.db2.gz RSJHGPHKRNCKCD-YDHLFZDLSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(CN2C[C@@H](C)O[C@@H](C3CC3)C2)c(O)c1 ZINC000877486095 643301630 /nfs/dbraw/zinc/30/16/30/643301630.db2.gz DRICSJPTDKZNBS-MLGOLLRUSA-N 0 3 261.365 2.700 20 10 CFCDHN CCC(CC)(CCO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877503507 643314640 /nfs/dbraw/zinc/31/46/40/643314640.db2.gz OGTQQJAJTLWJHO-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN Cc1cccc(O)c1CN1CCOc2cc(O)ccc2C1 ZINC000877516668 643320987 /nfs/dbraw/zinc/32/09/87/643320987.db2.gz COYZIZCCFCVHJG-UHFFFAOYSA-N 0 3 285.343 2.801 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000877524017 643327936 /nfs/dbraw/zinc/32/79/36/643327936.db2.gz PQFUBQDRWSHEGV-AWEZNQCLSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@]1(C)CCCO ZINC000877529282 643332762 /nfs/dbraw/zinc/33/27/62/643332762.db2.gz YFALRHDLGPOMLW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@]1(C)CCCO ZINC000877529282 643332769 /nfs/dbraw/zinc/33/27/69/643332769.db2.gz YFALRHDLGPOMLW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530728 643334432 /nfs/dbraw/zinc/33/44/32/643334432.db2.gz GSURZGRJJGQLTI-FZMZJTMJSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530728 643334436 /nfs/dbraw/zinc/33/44/36/643334436.db2.gz GSURZGRJJGQLTI-FZMZJTMJSA-N 0 3 296.361 2.587 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@H+](Cc3c(C)cccc3[O-])C2)c1 ZINC000877543181 643345651 /nfs/dbraw/zinc/34/56/51/643345651.db2.gz ZOUSKMMRIMPUJR-CQSZACIVSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@@H+](Cc3c(C)cccc3[O-])C2)c1 ZINC000877543181 643345654 /nfs/dbraw/zinc/34/56/54/643345654.db2.gz ZOUSKMMRIMPUJR-CQSZACIVSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c([O-])c1 ZINC000877545553 643347825 /nfs/dbraw/zinc/34/78/25/643347825.db2.gz IFXDOYJGABZJBI-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c([O-])c1 ZINC000877545553 643347830 /nfs/dbraw/zinc/34/78/30/643347830.db2.gz IFXDOYJGABZJBI-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)c2cc[nH]c(=O)c2)c([O-])c1 ZINC000877550997 643351446 /nfs/dbraw/zinc/35/14/46/643351446.db2.gz QBRCIYYQADFZNI-LLVKDONJSA-N 0 3 258.321 2.652 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c([O-])c1 ZINC000877553632 643354575 /nfs/dbraw/zinc/35/45/75/643354575.db2.gz WOGIUPQZVUGJRI-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)c([O-])c1 ZINC000877553632 643354580 /nfs/dbraw/zinc/35/45/80/643354580.db2.gz WOGIUPQZVUGJRI-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000877554604 643355070 /nfs/dbraw/zinc/35/50/70/643355070.db2.gz LWZXCAPJSHWQGY-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000877554604 643355073 /nfs/dbraw/zinc/35/50/73/643355073.db2.gz LWZXCAPJSHWQGY-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000877577685 643375541 /nfs/dbraw/zinc/37/55/41/643375541.db2.gz YXPCPLLBZRVSMK-KGLIPLIRSA-N 0 3 261.365 2.557 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000877577685 643375542 /nfs/dbraw/zinc/37/55/42/643375542.db2.gz YXPCPLLBZRVSMK-KGLIPLIRSA-N 0 3 261.365 2.557 20 10 CFCDHN CO[C@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2[O-])C12CCC2 ZINC000877583731 643379065 /nfs/dbraw/zinc/37/90/65/643379065.db2.gz AIXILXFJKDEEOT-CABCVRRESA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc(O)c1CN1CCO[C@@H](C2CCC2)C1 ZINC000877587627 643382947 /nfs/dbraw/zinc/38/29/47/643382947.db2.gz PAMUUKLXPUNJBX-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN CO[C@](C)([C@H](C)[NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877587938 643383127 /nfs/dbraw/zinc/38/31/27/643383127.db2.gz JWKOGZBTVXMSTH-BLLLJJGKSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](C)c1ccccn1 ZINC000877621291 643408167 /nfs/dbraw/zinc/40/81/67/643408167.db2.gz UCFQPVDKLALVFN-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCOC(C)(C)C ZINC000877628711 643412777 /nfs/dbraw/zinc/41/27/77/643412777.db2.gz JAJCSZQZPSDUKC-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN COC(=O)C[C@](C)([NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877705246 643472255 /nfs/dbraw/zinc/47/22/55/643472255.db2.gz XPOZRYIJKYRVOL-INIZCTEOSA-N 0 3 277.364 2.522 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000877719296 643483354 /nfs/dbraw/zinc/48/33/54/643483354.db2.gz UYOWCSSAYUPJMM-BETUJISGSA-N 0 3 259.349 2.799 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000877719296 643483359 /nfs/dbraw/zinc/48/33/59/643483359.db2.gz UYOWCSSAYUPJMM-BETUJISGSA-N 0 3 259.349 2.799 20 10 CFCDHN CN1CC[C@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000877740172 643508608 /nfs/dbraw/zinc/50/86/08/643508608.db2.gz IVVOZZJZSZPXOE-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000877740172 643508615 /nfs/dbraw/zinc/50/86/15/643508615.db2.gz IVVOZZJZSZPXOE-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877741571 643511440 /nfs/dbraw/zinc/51/14/40/643511440.db2.gz WENRECLKUWVKEP-UONOGXRCSA-N 0 3 293.432 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877741571 643511444 /nfs/dbraw/zinc/51/14/44/643511444.db2.gz WENRECLKUWVKEP-UONOGXRCSA-N 0 3 293.432 2.976 20 10 CFCDHN C[C@@H](NCc1cnc([C@H](C)O)s1)c1ccccc1O ZINC000877755639 643535150 /nfs/dbraw/zinc/53/51/50/643535150.db2.gz JBXOEFZTYKZCES-ZJUUUORDSA-N 0 3 278.377 2.753 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc([C@H](C)O)s1)c1ccccc1[O-] ZINC000877755639 643535157 /nfs/dbraw/zinc/53/51/57/643535157.db2.gz JBXOEFZTYKZCES-ZJUUUORDSA-N 0 3 278.377 2.753 20 10 CFCDHN COC(=O)C1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000877758211 643538932 /nfs/dbraw/zinc/53/89/32/643538932.db2.gz NEOVJNPQOURJLK-HIFPTAJRSA-N 0 3 277.364 2.775 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](C(C)(C)O)C1 ZINC000877795632 643561514 /nfs/dbraw/zinc/56/15/14/643561514.db2.gz QLZGVHJPOPWEEF-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](C(C)(C)O)C1 ZINC000877795632 643561518 /nfs/dbraw/zinc/56/15/18/643561518.db2.gz QLZGVHJPOPWEEF-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCC2(CCOCC2)O1)c1ccccc1[O-] ZINC000878355044 643857405 /nfs/dbraw/zinc/85/74/05/643857405.db2.gz UUIOHJJGKQCBLR-UONOGXRCSA-N 0 3 291.391 2.771 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[O-])CCN1C ZINC000090721337 650880597 /nfs/dbraw/zinc/88/05/97/650880597.db2.gz CBBLCKFJKAFMDF-GXFFZTMASA-N 0 3 268.788 2.618 20 10 CFCDHN CCn1cc(CC[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000879649620 644362458 /nfs/dbraw/zinc/36/24/58/644362458.db2.gz ZDRZBLVXZDOMHA-GFCCVEGCSA-N 0 3 259.353 2.502 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CC2(CCC2)C(=O)O1)c1ccccc1[O-] ZINC000879649504 644363114 /nfs/dbraw/zinc/36/31/14/644363114.db2.gz VGWFQHUKXMCJOF-NEPJUHHUSA-N 0 3 275.348 2.529 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CC2(CCC2)C(=O)O1)c1ccccc1[O-] ZINC000879650879 644364529 /nfs/dbraw/zinc/36/45/29/644364529.db2.gz VGWFQHUKXMCJOF-RYUDHWBXSA-N 0 3 275.348 2.529 20 10 CFCDHN C[C@H]([NH2+]CC[S@](=O)c1ccccc1)c1ccccc1[O-] ZINC000879652030 644365700 /nfs/dbraw/zinc/36/57/00/644365700.db2.gz UPIBUCBOTDLSRZ-RBZFPXEDSA-N 0 3 289.400 2.851 20 10 CFCDHN Cc1ccc(O)c(CN2CCOC[C@@H]2CC(C)C)c1 ZINC000093340275 650938612 /nfs/dbraw/zinc/93/86/12/650938612.db2.gz NVXRSAQEYMDTNX-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CCOc1cccc(C[N@H+](CCCCO)C2CC2)c1[O-] ZINC000093383139 650939209 /nfs/dbraw/zinc/93/92/09/650939209.db2.gz HINWSFDVFKUGHJ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCCCO)C2CC2)c1[O-] ZINC000093383139 650939211 /nfs/dbraw/zinc/93/92/11/650939211.db2.gz HINWSFDVFKUGHJ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618028 650959859 /nfs/dbraw/zinc/95/98/59/650959859.db2.gz YFJIWNZXTJSDDR-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2[O-])cn1 ZINC000094616970 650960348 /nfs/dbraw/zinc/96/03/48/650960348.db2.gz KEZLJNSYZPKZIC-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN CCC[C@@H]1C(=O)NCCN1Cc1c(O)ccc2ccccc21 ZINC000128880730 644937273 /nfs/dbraw/zinc/93/72/73/644937273.db2.gz YDVHSAOMFJSSKI-MRXNPFEDSA-N 0 3 298.386 2.646 20 10 CFCDHN CN(CCCC[NH+]1CCCCC1)C(=O)c1cc([O-])cs1 ZINC000882624735 645393472 /nfs/dbraw/zinc/39/34/72/645393472.db2.gz KWFJDBRHZDWHOJ-UHFFFAOYSA-N 0 3 296.436 2.792 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)Cc2ccoc2)c([O-])c1 ZINC000883276556 645718137 /nfs/dbraw/zinc/71/81/37/645718137.db2.gz MJLPTDBVGHAGOJ-ZFWWWQNUSA-N 0 3 289.375 2.795 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(N(C)C)CCC2)c1[O-] ZINC000097927938 651049626 /nfs/dbraw/zinc/04/96/26/651049626.db2.gz FVIHGXSTJFBGMI-UHFFFAOYSA-N 0 3 298.814 2.628 20 10 CFCDHN CC(C)[C@@H]([NH3+])CCN(C)Cc1c([O-])cccc1Cl ZINC000133356159 646074909 /nfs/dbraw/zinc/07/49/09/646074909.db2.gz XAOPTVDSQQMTOK-ZDUSSCGKSA-N 0 3 270.804 2.851 20 10 CFCDHN CC[C@H]([NH2+]CC1(CO)CCCC1)c1ccccc1[O-] ZINC000135073019 646455019 /nfs/dbraw/zinc/45/50/19/646455019.db2.gz GLACSYMLIOEPCP-AWEZNQCLSA-N 0 3 263.381 2.986 20 10 CFCDHN COc1ccc(CNCc2ccccc2O)c(F)c1OC ZINC000885960681 646784984 /nfs/dbraw/zinc/78/49/84/646784984.db2.gz OXKPWMPUHLQCAE-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886507329 647022932 /nfs/dbraw/zinc/02/29/32/647022932.db2.gz FNNXPDNEQTXKAC-LLVKDONJSA-N 0 3 277.343 2.777 20 10 CFCDHN CC(C)[C@@H](NCc1ccc2c(c1)CCO2)c1cnn(C)c1 ZINC000886520492 647026873 /nfs/dbraw/zinc/02/68/73/647026873.db2.gz GEBLVHXVKPZGNG-QGZVFWFLSA-N 0 3 285.391 2.842 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H]2CCC2(OC)OC)cc1 ZINC000924710202 648032824 /nfs/dbraw/zinc/03/28/24/648032824.db2.gz HQNDESVKZFVBCF-INIZCTEOSA-N 0 3 292.423 2.774 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(C)cc1[O-] ZINC000926949801 648668419 /nfs/dbraw/zinc/66/84/19/648668419.db2.gz QISPXDMHQJBZKH-CXUGXGMPSA-N 0 3 291.391 2.545 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000927017805 648684551 /nfs/dbraw/zinc/68/45/51/648684551.db2.gz MVEHENVCJUKYJQ-STQMWFEESA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCC2(COC2)O1 ZINC000929753082 649112027 /nfs/dbraw/zinc/11/20/27/649112027.db2.gz KGLBKXNJHHLFAO-OAHLLOKOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCC2(COC2)O1 ZINC000929753082 649112029 /nfs/dbraw/zinc/11/20/29/649112029.db2.gz KGLBKXNJHHLFAO-OAHLLOKOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H](CC)CO ZINC000930350697 649235480 /nfs/dbraw/zinc/23/54/80/649235480.db2.gz JDPMVZXXXDOIBX-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H](CC)CO ZINC000930350697 649235485 /nfs/dbraw/zinc/23/54/85/649235485.db2.gz JDPMVZXXXDOIBX-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN C[C@@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000305759931 651075607 /nfs/dbraw/zinc/07/56/07/651075607.db2.gz YBKLECAPRWOMJJ-FZMZJTMJSA-N 0 3 261.321 2.587 20 10 CFCDHN COc1ccc(C[NH2+]C[C@H](OC)C2CCCC2)c([O-])c1 ZINC000692973098 769943980 /nfs/dbraw/zinc/94/39/80/769943980.db2.gz HHLDBMCJKWOUAI-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN CN1CCC[C@H]2C[N@H+](Cc3c([O-])cccc3Cl)C[C@@H]21 ZINC001140341970 770530423 /nfs/dbraw/zinc/53/04/23/770530423.db2.gz NMFIMSCVEAGYLE-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CCC[C@H]2C[N@@H+](Cc3c([O-])cccc3Cl)C[C@@H]21 ZINC001140341970 770530429 /nfs/dbraw/zinc/53/04/29/770530429.db2.gz NMFIMSCVEAGYLE-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccns2)c1 ZINC000404377404 773227759 /nfs/dbraw/zinc/22/77/59/773227759.db2.gz KGKUOJPCIQEPML-VIFPVBQESA-N 0 3 264.350 2.708 20 10 CFCDHN CCN(Cc1ccccn1)Cc1ccc(O)c(C)c1O ZINC001140747675 775395809 /nfs/dbraw/zinc/39/58/09/775395809.db2.gz FHMUXGRNERMNAD-UHFFFAOYSA-N 0 3 272.348 2.823 20 10 CFCDHN CC(=O)N1CC[C@@H]([N@@H+](Cc2ccc(C)cc2[O-])C(C)C)C1 ZINC001140957650 775710146 /nfs/dbraw/zinc/71/01/46/775710146.db2.gz HDSIOSMTAISMFA-MRXNPFEDSA-N 0 3 290.407 2.532 20 10 CFCDHN CC(=O)N1CC[C@@H]([N@H+](Cc2ccc(C)cc2[O-])C(C)C)C1 ZINC001140957650 775710152 /nfs/dbraw/zinc/71/01/52/775710152.db2.gz HDSIOSMTAISMFA-MRXNPFEDSA-N 0 3 290.407 2.532 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2COC(C)(C)C2)c1[O-] ZINC000396571351 775943612 /nfs/dbraw/zinc/94/36/12/775943612.db2.gz CWBGYBIFKLKMMU-NSHDSACASA-N 0 3 285.771 2.711 20 10 CFCDHN COC(=O)C[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589745 777268254 /nfs/dbraw/zinc/26/82/54/777268254.db2.gz PIEVOZJPUDICPM-CYBMUJFWSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)C[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589745 777268258 /nfs/dbraw/zinc/26/82/58/777268258.db2.gz PIEVOZJPUDICPM-CYBMUJFWSA-N 0 3 299.370 2.930 20 10 CFCDHN Cc1cccc(CN2CC3(C2)C[C@H](F)CS3)c1O ZINC001231593885 777273569 /nfs/dbraw/zinc/27/35/69/777273569.db2.gz NESGVVVAYQLVLT-LBPRGKRZSA-N 0 3 267.369 2.730 20 10 CFCDHN CC[N@H+]1C[C@H]2CN(Cc3cc(Cl)c(C)cc3[O-])C[C@H]2C1 ZINC001231870913 777358593 /nfs/dbraw/zinc/35/85/93/777358593.db2.gz DGVAOPHWJVNCGW-OKILXGFUSA-N 0 3 294.826 2.738 20 10 CFCDHN CC[N@@H+]1C[C@H]2CN(Cc3cc(Cl)c(C)cc3[O-])C[C@H]2C1 ZINC001231870913 777358595 /nfs/dbraw/zinc/35/85/95/777358595.db2.gz DGVAOPHWJVNCGW-OKILXGFUSA-N 0 3 294.826 2.738 20 10 CFCDHN CCN(CC)CC[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC001231909261 777377952 /nfs/dbraw/zinc/37/79/52/777377952.db2.gz FBASLLHYCWGHFL-UHFFFAOYSA-N 0 3 270.804 2.819 20 10 CFCDHN CCN(CC)CC[N@@H+](C)Cc1cccc(Cl)c1[O-] ZINC001231909261 777377960 /nfs/dbraw/zinc/37/79/60/777377960.db2.gz FBASLLHYCWGHFL-UHFFFAOYSA-N 0 3 270.804 2.819 20 10 CFCDHN COC(=O)c1c(CN2CCC[C@H]2C)c2ccccc2n1C ZINC001232402599 777549540 /nfs/dbraw/zinc/54/95/40/777549540.db2.gz YRYJNXIIXSBFAW-GFCCVEGCSA-N 0 3 286.375 2.949 20 10 CFCDHN C[N@H+](Cc1ccc(CCO)cc1)Cc1ccccc1[O-] ZINC001232779064 777663760 /nfs/dbraw/zinc/66/37/60/777663760.db2.gz DTSPEOCUYGKSPM-UHFFFAOYSA-N 0 3 271.360 2.559 20 10 CFCDHN C[N@@H+](Cc1ccc(CCO)cc1)Cc1ccccc1[O-] ZINC001232779064 777663765 /nfs/dbraw/zinc/66/37/65/777663765.db2.gz DTSPEOCUYGKSPM-UHFFFAOYSA-N 0 3 271.360 2.559 20 10 CFCDHN CN(C)c1ccc(CN2CC3(C2)CC(F)(F)C3)c(O)c1 ZINC001232834674 777687677 /nfs/dbraw/zinc/68/76/77/777687677.db2.gz JFWZRDJQDCAOIK-UHFFFAOYSA-N 0 3 282.334 2.689 20 10 CFCDHN CC[C@H]1CCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233016259 777766536 /nfs/dbraw/zinc/76/65/36/777766536.db2.gz QSMCHNMGXXZEID-NSHDSACASA-N 0 3 251.326 2.568 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@@](C)(O)C3)c2c1 ZINC001234526373 778243246 /nfs/dbraw/zinc/24/32/46/778243246.db2.gz UXNKHFAUSIPZJC-QGZVFWFLSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@@](C)(O)C3)c2c1 ZINC001234526373 778243253 /nfs/dbraw/zinc/24/32/53/778243253.db2.gz UXNKHFAUSIPZJC-QGZVFWFLSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc(O)c(CN(C)CCF)c2c1 ZINC001234578374 778256227 /nfs/dbraw/zinc/25/62/27/778256227.db2.gz NDWIBBONMOLJRK-UHFFFAOYSA-N 0 3 263.312 2.955 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+](C)CCF)c2c1 ZINC001234578374 778256229 /nfs/dbraw/zinc/25/62/29/778256229.db2.gz NDWIBBONMOLJRK-UHFFFAOYSA-N 0 3 263.312 2.955 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+](C)CCF)c2c1 ZINC001234578374 778256234 /nfs/dbraw/zinc/25/62/34/778256234.db2.gz NDWIBBONMOLJRK-UHFFFAOYSA-N 0 3 263.312 2.955 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCCC[C@]12CC[NH2+]C2 ZINC001235125974 778392864 /nfs/dbraw/zinc/39/28/64/778392864.db2.gz QFIBEZZGWDAHIS-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN COCC[N@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235673877 778531522 /nfs/dbraw/zinc/53/15/22/778531522.db2.gz ASTVZJOJYTXDNL-UHFFFAOYSA-N 0 3 251.370 2.768 20 10 CFCDHN COCC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235673877 778531524 /nfs/dbraw/zinc/53/15/24/778531524.db2.gz ASTVZJOJYTXDNL-UHFFFAOYSA-N 0 3 251.370 2.768 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](F)[C@@H](O)C2)c([O-])c1 ZINC001235674963 778532469 /nfs/dbraw/zinc/53/24/69/778532469.db2.gz JTTJYTPPLQNCGZ-ZFWWWQNUSA-N 0 3 281.371 2.594 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@H](F)[C@@H](O)C2)c([O-])c1 ZINC001235674963 778532471 /nfs/dbraw/zinc/53/24/71/778532471.db2.gz JTTJYTPPLQNCGZ-ZFWWWQNUSA-N 0 3 281.371 2.594 20 10 CFCDHN COC(=O)CC1CN(Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235685577 778536740 /nfs/dbraw/zinc/53/67/40/778536740.db2.gz RCVBQGCFNGHTCN-UHFFFAOYSA-N 0 3 291.391 2.685 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](CO)C2)c([O-])c1 ZINC001235685949 778537528 /nfs/dbraw/zinc/53/75/28/778537528.db2.gz VVAKDGDJTCVZJH-GFCCVEGCSA-N 0 3 263.381 2.504 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](CO)C2)c([O-])c1 ZINC001235685949 778537531 /nfs/dbraw/zinc/53/75/31/778537531.db2.gz VVAKDGDJTCVZJH-GFCCVEGCSA-N 0 3 263.381 2.504 20 10 CFCDHN Nc1ccc(CN2CCN(CCc3ccccc3)CC2)cc1 ZINC001235691471 778539021 /nfs/dbraw/zinc/53/90/21/778539021.db2.gz LVQGYPAMZKWKLL-UHFFFAOYSA-N 0 3 295.430 2.629 20 10 CFCDHN COc1cc(O)c(CN(C)C2CC(F)(F)C2)cc1OC ZINC001236751145 778928985 /nfs/dbraw/zinc/92/89/85/778928985.db2.gz QAMXQVCOJUSFNR-UHFFFAOYSA-N 0 3 287.306 2.639 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236782374 778933141 /nfs/dbraw/zinc/93/31/41/778933141.db2.gz ATZDCZZGTQSGJL-DOTOQJQBSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236782374 778933147 /nfs/dbraw/zinc/93/31/47/778933147.db2.gz ATZDCZZGTQSGJL-DOTOQJQBSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+](CCO)Cc2ccccc2)c([O-])c1 ZINC001236781502 778933484 /nfs/dbraw/zinc/93/34/84/778933484.db2.gz FBEYURVWXXZOJC-UHFFFAOYSA-N 0 3 285.387 2.949 20 10 CFCDHN CCc1ccc(C[N@@H+](CCO)Cc2ccccc2)c([O-])c1 ZINC001236781502 778933486 /nfs/dbraw/zinc/93/34/86/778933486.db2.gz FBEYURVWXXZOJC-UHFFFAOYSA-N 0 3 285.387 2.949 20 10 CFCDHN CCC[N@H+](CCOC)Cc1ccc(CC)cc1[O-] ZINC001236782804 778933948 /nfs/dbraw/zinc/93/39/48/778933948.db2.gz FIJNLEWJVBMSIY-UHFFFAOYSA-N 0 3 251.370 2.813 20 10 CFCDHN CCC[N@@H+](CCOC)Cc1ccc(CC)cc1[O-] ZINC001236782804 778933953 /nfs/dbraw/zinc/93/39/53/778933953.db2.gz FIJNLEWJVBMSIY-UHFFFAOYSA-N 0 3 251.370 2.813 20 10 CFCDHN CCc1ccc(C[N@H+](CC)CCCC(=O)OC)c([O-])c1 ZINC001236782860 778934193 /nfs/dbraw/zinc/93/41/93/778934193.db2.gz FZOIJLFEPOWTFM-UHFFFAOYSA-N 0 3 279.380 2.730 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)CCCC(=O)OC)c([O-])c1 ZINC001236782860 778934195 /nfs/dbraw/zinc/93/41/95/778934195.db2.gz FZOIJLFEPOWTFM-UHFFFAOYSA-N 0 3 279.380 2.730 20 10 CFCDHN CCc1ccc(C[N@H+](C)[C@H]2CCC3(C2)OCCO3)c([O-])c1 ZINC001236786706 778934889 /nfs/dbraw/zinc/93/48/89/778934889.db2.gz DSSSGRBWBVBFGK-HNNXBMFYSA-N 0 3 291.391 2.682 20 10 CFCDHN CCc1ccc(C[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c([O-])c1 ZINC001236786706 778934894 /nfs/dbraw/zinc/93/48/94/778934894.db2.gz DSSSGRBWBVBFGK-HNNXBMFYSA-N 0 3 291.391 2.682 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC001236790283 778937022 /nfs/dbraw/zinc/93/70/22/778937022.db2.gz UYPFEOBVVKGFDS-UHFFFAOYSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC001236790283 778937028 /nfs/dbraw/zinc/93/70/28/778937028.db2.gz UYPFEOBVVKGFDS-UHFFFAOYSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(O)(CC)CC2)c([O-])c1 ZINC001236787169 778937169 /nfs/dbraw/zinc/93/71/69/778937169.db2.gz AJSFOKRNIZBOER-UHFFFAOYSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@H+]2CCc3ccc(=O)[nH]c3CC2)c([O-])c1 ZINC001236793496 778938591 /nfs/dbraw/zinc/93/85/91/778938591.db2.gz XBZXCPCDHYKANG-UHFFFAOYSA-N 0 3 298.386 2.656 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCc3ccc(=O)[nH]c3CC2)c([O-])c1 ZINC001236793496 778938594 /nfs/dbraw/zinc/93/85/94/778938594.db2.gz XBZXCPCDHYKANG-UHFFFAOYSA-N 0 3 298.386 2.656 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001236793827 778938891 /nfs/dbraw/zinc/93/88/91/778938891.db2.gz FPMMXQXXVOQFJX-AWEZNQCLSA-N 0 3 261.365 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001236793827 778938898 /nfs/dbraw/zinc/93/88/98/778938898.db2.gz FPMMXQXXVOQFJX-AWEZNQCLSA-N 0 3 261.365 2.756 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c([O-])c1 ZINC001236809230 778948276 /nfs/dbraw/zinc/94/82/76/778948276.db2.gz UVQUQJLTVIDIPZ-MFKMUULPSA-N 0 3 283.318 2.796 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c([O-])c1 ZINC001236809230 778948279 /nfs/dbraw/zinc/94/82/79/778948279.db2.gz UVQUQJLTVIDIPZ-MFKMUULPSA-N 0 3 283.318 2.796 20 10 CFCDHN COCC1C[NH+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236825642 778955380 /nfs/dbraw/zinc/95/53/80/778955380.db2.gz AQUFMKMWUWTKFS-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN CC[C@H]([NH3+])CN(C)Cc1cc(Cl)c(C)cc1[O-] ZINC001236871243 778970441 /nfs/dbraw/zinc/97/04/41/778970441.db2.gz YXOBCAUVIWBWBN-NSHDSACASA-N 0 3 256.777 2.523 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)CCn2ccnc2)c([O-])c1 ZINC001237045261 778997873 /nfs/dbraw/zinc/99/78/73/778997873.db2.gz GEGOSPJQKMZNNR-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)CCn2ccnc2)c([O-])c1 ZINC001237045261 778997878 /nfs/dbraw/zinc/99/78/78/778997878.db2.gz GEGOSPJQKMZNNR-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@](C)(O)C2)c([O-])c1 ZINC001237049425 778999918 /nfs/dbraw/zinc/99/99/18/778999918.db2.gz OTPISCZVDBOYFE-INIZCTEOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@](C)(O)C2)c([O-])c1 ZINC001237049425 778999922 /nfs/dbraw/zinc/99/99/22/778999922.db2.gz OTPISCZVDBOYFE-INIZCTEOSA-N 0 3 263.381 2.862 20 10 CFCDHN [O-]c1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001237124392 779018815 /nfs/dbraw/zinc/01/88/15/779018815.db2.gz PAIRWTYZGTYOGI-RNCFNFMXSA-N 0 3 285.746 2.796 20 10 CFCDHN [O-]c1ccc(F)c(Cl)c1C[N@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001237124392 779018821 /nfs/dbraw/zinc/01/88/21/779018821.db2.gz PAIRWTYZGTYOGI-RNCFNFMXSA-N 0 3 285.746 2.796 20 10 CFCDHN C[C@@H]1CCN(Cc2cc(C(F)(F)F)ccc2O)C[C@H]1O ZINC001237135660 779023408 /nfs/dbraw/zinc/02/34/08/779023408.db2.gz KJPQKRPVVPCXCR-NOZJJQNGSA-N 0 3 289.297 2.614 20 10 CFCDHN Cc1cc(F)cc(CN2CCNC3=CCCC[C@H]32)c1O ZINC001237229945 779056932 /nfs/dbraw/zinc/05/69/32/779056932.db2.gz QZABFSCNDCYUBS-OAHLLOKOSA-N 0 3 276.355 2.681 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(c2ncccn2)CC1 ZINC001237488098 779118740 /nfs/dbraw/zinc/11/87/40/779118740.db2.gz QWEDHYAJRGNRTM-UHFFFAOYSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001237682063 779161380 /nfs/dbraw/zinc/16/13/80/779161380.db2.gz WKDAYVDWCXVMOT-ABAIWWIYSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001237682063 779161383 /nfs/dbraw/zinc/16/13/83/779161383.db2.gz WKDAYVDWCXVMOT-ABAIWWIYSA-N 0 3 283.799 2.947 20 10 CFCDHN CCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237690695 779162935 /nfs/dbraw/zinc/16/29/35/779162935.db2.gz ZQVNQHKIRBHRMO-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237690695 779162939 /nfs/dbraw/zinc/16/29/39/779162939.db2.gz ZQVNQHKIRBHRMO-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CC(=O)[C@H]1CCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237950602 779214183 /nfs/dbraw/zinc/21/41/83/779214183.db2.gz XJQUSRZRYGBQHB-JTQLQIEISA-N 0 3 285.746 2.986 20 10 CFCDHN CC(=O)[C@@H]1CCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237950603 779214304 /nfs/dbraw/zinc/21/43/04/779214304.db2.gz XJQUSRZRYGBQHB-SNVBAGLBSA-N 0 3 285.746 2.986 20 10 CFCDHN CC(=O)c1cc(F)cc(CN2CC[C@H]3C[C@H]3C2)c1O ZINC000699248772 779228235 /nfs/dbraw/zinc/22/82/35/779228235.db2.gz XGGXOHOUGQCCDH-QWRGUYRKSA-N 0 3 263.312 2.576 20 10 CFCDHN CCO[C@@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238063290 779242606 /nfs/dbraw/zinc/24/26/06/779242606.db2.gz VDYYCXFZWLEZDB-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN CCO[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238063290 779242611 /nfs/dbraw/zinc/24/26/11/779242611.db2.gz VDYYCXFZWLEZDB-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN CC[C@H]1C[NH2+]CCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001235775321 779376219 /nfs/dbraw/zinc/37/62/19/779376219.db2.gz VZDUITQWPCOROV-LBPRGKRZSA-N 0 3 268.788 2.538 20 10 CFCDHN CCO[C@H]1CCC[N@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814192 779643463 /nfs/dbraw/zinc/64/34/63/779643463.db2.gz QHTSJSPLTLHMDP-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN CCO[C@H]1CCC[N@@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814192 779643466 /nfs/dbraw/zinc/64/34/66/779643466.db2.gz QHTSJSPLTLHMDP-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001237045225 779661200 /nfs/dbraw/zinc/66/12/00/779661200.db2.gz ZCJOGYWQAPVEKX-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001237045225 779661202 /nfs/dbraw/zinc/66/12/02/779661202.db2.gz ZCJOGYWQAPVEKX-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](O)C2)c1[O-] ZINC001237680622 779706100 /nfs/dbraw/zinc/70/61/00/779706100.db2.gz DYBKXXVDZKVJCM-NOZJJQNGSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](O)C2)c1[O-] ZINC001237680622 779706105 /nfs/dbraw/zinc/70/61/05/779706105.db2.gz DYBKXXVDZKVJCM-NOZJJQNGSA-N 0 3 269.772 2.557 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CO[C@@H](C3CC3)C1)CC2 ZINC000700989364 780744841 /nfs/dbraw/zinc/74/48/41/780744841.db2.gz DLBBCGIKTRWDRQ-GZBFAFLISA-N 0 3 259.349 2.537 20 10 CFCDHN [NH3+][C@@H]1CCCCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000709009613 781286321 /nfs/dbraw/zinc/28/63/21/781286321.db2.gz VUOKAGAEHLXLAR-CYBMUJFWSA-N 0 3 268.788 2.749 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2COC3(CCC3)C2)c1[O-] ZINC000711147700 781391097 /nfs/dbraw/zinc/39/10/97/781391097.db2.gz XOSOJTDCWYTAHN-LBPRGKRZSA-N 0 3 297.782 2.855 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CCC1)[C@H]1CCOC1 ZINC000711832341 781474450 /nfs/dbraw/zinc/47/44/50/781474450.db2.gz GQNGGHKLXLPGKS-GOEBONIOSA-N 0 3 261.365 2.687 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])C(C)(C)O ZINC000295001358 199293550 /nfs/dbraw/zinc/29/35/50/199293550.db2.gz MAOQJBXQQKVQKI-BXUZGUMPSA-N 0 3 251.370 2.901 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H](O)[C@@H]2C)c([O-])c1 ZINC000295029954 199309114 /nfs/dbraw/zinc/30/91/14/199309114.db2.gz NWKXTVOZMBPBEM-SWLSCSKDSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H](O)[C@@H]2C)c([O-])c1 ZINC000295029954 199309116 /nfs/dbraw/zinc/30/91/16/199309116.db2.gz NWKXTVOZMBPBEM-SWLSCSKDSA-N 0 3 279.380 2.526 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CC)C(C)(C)O)c1ccccc1[O-] ZINC000295063151 199325603 /nfs/dbraw/zinc/32/56/03/199325603.db2.gz RKAJNZKSQVTYRA-TZMCWYRMSA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](C)CC(C)(C)O)cc1C ZINC000295064489 199326116 /nfs/dbraw/zinc/32/61/16/199326116.db2.gz OSMLLTKEPYVJEW-LBPRGKRZSA-N 0 3 251.370 2.648 20 10 CFCDHN Cc1noc(C)c1CN[C@H]1CCc2cccc(O)c21 ZINC000295952431 282387982 /nfs/dbraw/zinc/38/79/82/282387982.db2.gz LPPNNKPWNNZEBJ-ZDUSSCGKSA-N 0 3 258.321 2.774 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@H](CO)C(C)(C)C)c1 ZINC000093837423 347684606 /nfs/dbraw/zinc/68/46/06/347684606.db2.gz LEACFJKVMNCTMB-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@H](CO)C(C)(C)C)c1 ZINC000093837423 347684609 /nfs/dbraw/zinc/68/46/09/347684609.db2.gz LEACFJKVMNCTMB-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN CN1CCC[C@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178357 539881515 /nfs/dbraw/zinc/88/15/15/539881515.db2.gz VQIBVAMSZMEKKQ-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CCC[C@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178357 539881517 /nfs/dbraw/zinc/88/15/17/539881517.db2.gz VQIBVAMSZMEKKQ-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178357 539881518 /nfs/dbraw/zinc/88/15/18/539881518.db2.gz VQIBVAMSZMEKKQ-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178357 539881520 /nfs/dbraw/zinc/88/15/20/539881520.db2.gz VQIBVAMSZMEKKQ-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CC[C@@H]([NH2+]CCC(C)(C)CO)c1ccccc1[O-] ZINC000294727355 199154900 /nfs/dbraw/zinc/15/49/00/199154900.db2.gz FZSNKAOQYCQBIF-CYBMUJFWSA-N 0 3 251.370 2.842 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000294861679 199218549 /nfs/dbraw/zinc/21/85/49/199218549.db2.gz CAWWPJOZRXKRQM-RNCFNFMXSA-N 0 3 255.333 2.731 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H](C)CCCO)cc1C ZINC000294895515 199236316 /nfs/dbraw/zinc/23/63/16/199236316.db2.gz WVNVQPYFVNAADC-LLVKDONJSA-N 0 3 251.370 2.507 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CCCCO)c1 ZINC000294925289 199252578 /nfs/dbraw/zinc/25/25/78/199252578.db2.gz BEVJGQHTUGXIRJ-NWDGAFQWSA-N 0 3 267.369 2.603 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CCCCO)c1ccccc1[O-] ZINC000294933661 199257576 /nfs/dbraw/zinc/25/75/76/199257576.db2.gz BSVVLRGNKPOVBE-OCCSQVGLSA-N 0 3 251.370 2.984 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC[C@@H](C)CCO)c1 ZINC000297350426 200157893 /nfs/dbraw/zinc/15/78/93/200157893.db2.gz PCLAXZDCHRYLPQ-DGCLKSJQSA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000185653692 299302403 /nfs/dbraw/zinc/30/24/03/299302403.db2.gz CWFYVPFQJJGCJT-JSGCOSHPSA-N 0 3 289.350 2.958 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)o1 ZINC000297970302 200310739 /nfs/dbraw/zinc/31/07/39/200310739.db2.gz ZUQMXXRNUDLNDZ-TZMCWYRMSA-N 0 3 273.332 2.604 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)o1 ZINC000297970300 200310859 /nfs/dbraw/zinc/31/08/59/200310859.db2.gz ZUQMXXRNUDLNDZ-OCCSQVGLSA-N 0 3 273.332 2.604 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CN(C)C)c1cc2c(cc1[O-])CCCC2 ZINC000287047445 296146030 /nfs/dbraw/zinc/14/60/30/296146030.db2.gz MRFSKNZFPQRABJ-QWHCGFSZSA-N 0 3 276.424 2.872 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2C[C@@](C)(OC)C2(C)C)c1 ZINC000089726197 374943126 /nfs/dbraw/zinc/94/31/26/374943126.db2.gz AAZWRXRVWCBXMG-GDBMZVCRSA-N 0 3 279.380 2.694 20 10 CFCDHN CS[C@@H]1CCCC[N@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000092064255 375085010 /nfs/dbraw/zinc/08/50/10/375085010.db2.gz REXVEKQQNGOULE-GFCCVEGCSA-N 0 3 295.404 2.838 20 10 CFCDHN CS[C@@H]1CCCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000092064255 375085018 /nfs/dbraw/zinc/08/50/18/375085018.db2.gz REXVEKQQNGOULE-GFCCVEGCSA-N 0 3 295.404 2.838 20 10 CFCDHN Cc1nn(C)c(C)c1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000092324401 375102130 /nfs/dbraw/zinc/10/21/30/375102130.db2.gz QVKTUBFEXCFQLE-LBPRGKRZSA-N 0 3 286.423 2.954 20 10 CFCDHN CC[C@@H]([NH2+]Cc1c(C)nn(C)c1C)c1ccccc1[O-] ZINC000092325924 375102371 /nfs/dbraw/zinc/10/23/71/375102371.db2.gz JLVFGUSLQWVQPA-OAHLLOKOSA-N 0 3 273.380 2.983 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(C)ccc1[O-] ZINC000091892875 375068684 /nfs/dbraw/zinc/06/86/84/375068684.db2.gz SOSQOEAVWHBRDO-CVEARBPZSA-N 0 3 274.408 2.759 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(C)ccc1[O-] ZINC000091892875 375068689 /nfs/dbraw/zinc/06/86/89/375068689.db2.gz SOSQOEAVWHBRDO-CVEARBPZSA-N 0 3 274.408 2.759 20 10 CFCDHN CCCC[N@H+](CCOC)Cc1cccc(OC)c1[O-] ZINC000093323056 375212161 /nfs/dbraw/zinc/21/21/61/375212161.db2.gz OLHJKZQXOVQWGN-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCC[N@@H+](CCOC)Cc1cccc(OC)c1[O-] ZINC000093323056 375212166 /nfs/dbraw/zinc/21/21/66/375212166.db2.gz OLHJKZQXOVQWGN-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCN1CC[C@H]([N@H+](C)Cc2cc(C)ccc2[O-])[C@H](C)C1 ZINC000093639520 375278081 /nfs/dbraw/zinc/27/80/81/375278081.db2.gz ATWSRSQQUSQXQL-ZBFHGGJFSA-N 0 3 276.424 2.863 20 10 CFCDHN CCN1CC[C@H]([N@@H+](C)Cc2cc(C)ccc2[O-])[C@H](C)C1 ZINC000093639520 375278087 /nfs/dbraw/zinc/27/80/87/375278087.db2.gz ATWSRSQQUSQXQL-ZBFHGGJFSA-N 0 3 276.424 2.863 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644789 375284512 /nfs/dbraw/zinc/28/45/12/375284512.db2.gz ISHJWEBTAKQPNJ-UKRRQHHQSA-N 0 3 262.397 2.615 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644789 375284517 /nfs/dbraw/zinc/28/45/17/375284517.db2.gz ISHJWEBTAKQPNJ-UKRRQHHQSA-N 0 3 262.397 2.615 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@H](C(C)C)C2)c1[O-] ZINC000093869255 375326620 /nfs/dbraw/zinc/32/66/20/375326620.db2.gz KKPIAUYFVOMTPB-AWEZNQCLSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@H](C(C)C)C2)c1[O-] ZINC000093869255 375326621 /nfs/dbraw/zinc/32/66/21/375326621.db2.gz KKPIAUYFVOMTPB-AWEZNQCLSA-N 0 3 281.421 2.974 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@H]2CCOC2)c([O-])c1 ZINC000093840187 375320529 /nfs/dbraw/zinc/32/05/29/375320529.db2.gz QCUYGDGWESAFPA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@H]2CCOC2)c([O-])c1 ZINC000093840187 375320537 /nfs/dbraw/zinc/32/05/37/375320537.db2.gz QCUYGDGWESAFPA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(CC)(CO)CC2)c1 ZINC000093592402 375269878 /nfs/dbraw/zinc/26/98/78/375269878.db2.gz ACPVUZNMWGSBEH-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CC(C)C[C@@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094617831 375370288 /nfs/dbraw/zinc/37/02/88/375370288.db2.gz FDWGJIBHCIXGNC-JQWIXIFHSA-N 0 3 255.333 2.589 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(N(C)C)CCC2)c([O-])c1 ZINC000097928439 375587137 /nfs/dbraw/zinc/58/71/37/375587137.db2.gz HLIOWPWQPBTILH-CYBMUJFWSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+]Cc1c([O-])cccc1Cl ZINC000113335809 376011311 /nfs/dbraw/zinc/01/13/11/376011311.db2.gz NVSGZDGKNHVGTL-LLVKDONJSA-N 0 3 293.798 2.976 20 10 CFCDHN CCCOc1ccc(C[NH2+]C(CC)(CC)CO)c([O-])c1 ZINC000116347620 376181222 /nfs/dbraw/zinc/18/12/22/376181222.db2.gz BVTHZQWOGDNIBV-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)[C@H]1CCCCNC1=O ZINC000123867741 376989700 /nfs/dbraw/zinc/98/97/00/376989700.db2.gz NUMKHLOCOGYPFP-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)[C@H]1CCCCNC1=O ZINC000123867741 376989705 /nfs/dbraw/zinc/98/97/05/376989705.db2.gz NUMKHLOCOGYPFP-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN Cc1cccc(C[NH2+]CC2(O)CCCCCC2)c1[O-] ZINC000124831255 377091528 /nfs/dbraw/zinc/09/15/28/377091528.db2.gz KWWHJHKXHFMAHR-UHFFFAOYSA-N 0 3 263.381 2.876 20 10 CFCDHN OCC1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000127052081 377262098 /nfs/dbraw/zinc/26/20/98/377262098.db2.gz VCMKSWNDYPEDTE-UHFFFAOYSA-N 0 3 288.435 2.881 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2cc(C)ccc2[O-])C1 ZINC000125950922 377204188 /nfs/dbraw/zinc/20/41/88/377204188.db2.gz VZEXRWMVAAHMMB-OCCSQVGLSA-N 0 3 277.364 2.522 20 10 CFCDHN CN(C)c1ccc(CN(C)C[C@@H]2CCCO2)cc1F ZINC000128029222 377311875 /nfs/dbraw/zinc/31/18/75/377311875.db2.gz HVUSWPVFANJHCV-ZDUSSCGKSA-N 0 3 266.360 2.503 20 10 CFCDHN CN1CCC[C@@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036409 378663173 /nfs/dbraw/zinc/66/31/73/378663173.db2.gz VQIBVAMSZMEKKQ-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CCC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036409 378663182 /nfs/dbraw/zinc/66/31/82/378663182.db2.gz VQIBVAMSZMEKKQ-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036409 378663186 /nfs/dbraw/zinc/66/31/86/378663186.db2.gz VQIBVAMSZMEKKQ-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036409 378663191 /nfs/dbraw/zinc/66/31/91/378663191.db2.gz VQIBVAMSZMEKKQ-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCC[C@H]2CSC)cc1OC ZINC000160449689 378774252 /nfs/dbraw/zinc/77/42/52/378774252.db2.gz FJXFFJYWIADLFN-LBPRGKRZSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCC[C@H]2CSC)cc1OC ZINC000160449689 378774256 /nfs/dbraw/zinc/77/42/56/378774256.db2.gz FJXFFJYWIADLFN-LBPRGKRZSA-N 0 3 297.420 2.737 20 10 CFCDHN COCCC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000529638286 383739397 /nfs/dbraw/zinc/73/93/97/383739397.db2.gz OVOUQMJTPLNDCO-UHFFFAOYSA-N 0 3 267.344 2.780 20 10 CFCDHN CCN(CC)c1ccc(CNC(=O)[C@@H](N)CC(C)C)cc1 ZINC000178712732 380480613 /nfs/dbraw/zinc/48/06/13/380480613.db2.gz XERJRJWNPWESGR-INIZCTEOSA-N 0 3 291.439 2.522 20 10 CFCDHN CC[C@H]1CN(Cc2ccccc2O)CCN1CC(F)F ZINC000179582055 380560661 /nfs/dbraw/zinc/56/06/61/380560661.db2.gz NDWIAVXPSLXINO-ZDUSSCGKSA-N 0 3 284.350 2.554 20 10 CFCDHN C[C@@H](O)CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000179584801 380560764 /nfs/dbraw/zinc/56/07/64/380560764.db2.gz KENZEGXCAMIDMR-OLZOCXBDSA-N 0 3 280.387 2.847 20 10 CFCDHN C[C@H](c1cccnc1)N1CCN(Cc2ccccc2O)CC1 ZINC000179575228 380561307 /nfs/dbraw/zinc/56/13/07/380561307.db2.gz JEDKIJGRNKTGIL-OAHLLOKOSA-N 0 3 297.402 2.666 20 10 CFCDHN Cc1noc([C@H]2CCC[N@H+](Cc3cccc(C)c3[O-])C2)n1 ZINC000179755534 380578599 /nfs/dbraw/zinc/57/85/99/380578599.db2.gz DBAPZVAOPUJPOG-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@H]2CCC[N@@H+](Cc3cccc(C)c3[O-])C2)n1 ZINC000179755534 380578602 /nfs/dbraw/zinc/57/86/02/380578602.db2.gz DBAPZVAOPUJPOG-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1cnc(CC[N@@H+](C)Cc2cc(F)ccc2[O-])s1 ZINC000180227011 380636820 /nfs/dbraw/zinc/63/68/20/380636820.db2.gz QGADSHQRIFUBMY-UHFFFAOYSA-N 0 3 280.368 2.971 20 10 CFCDHN Cc1cnc(CC[N@H+](C)Cc2cc(F)ccc2[O-])s1 ZINC000180227011 380636830 /nfs/dbraw/zinc/63/68/30/380636830.db2.gz QGADSHQRIFUBMY-UHFFFAOYSA-N 0 3 280.368 2.971 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(c2ccccc2)C1=O)c1ccccc1[O-] ZINC000179875066 380589764 /nfs/dbraw/zinc/58/97/64/380589764.db2.gz OOAQJIFXKZTODD-XJKSGUPXSA-N 0 3 296.370 2.848 20 10 CFCDHN C[C@H]([NH2+]CCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000179877689 380592141 /nfs/dbraw/zinc/59/21/41/380592141.db2.gz GPGQWLQWPHXKEN-NSHDSACASA-N 0 3 280.368 2.568 20 10 CFCDHN Cc1noc(C)c1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000179882164 380592423 /nfs/dbraw/zinc/59/24/23/380592423.db2.gz NVQIEYIHBNWSAA-SNVBAGLBSA-N 0 3 260.337 2.890 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000180423236 380656375 /nfs/dbraw/zinc/65/63/75/380656375.db2.gz GFORIRVLNBRJDL-HIFRSBDPSA-N 0 3 262.397 2.615 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000180423236 380656376 /nfs/dbraw/zinc/65/63/76/380656376.db2.gz GFORIRVLNBRJDL-HIFRSBDPSA-N 0 3 262.397 2.615 20 10 CFCDHN C[C@H]1Oc2ccccc2[C@@H]1NCc1cc2c(cc1O)OCO2 ZINC000288623866 381017334 /nfs/dbraw/zinc/01/73/34/381017334.db2.gz RYJMJUPBSAVYCO-BMLIUANNSA-N 0 3 299.326 2.733 20 10 CFCDHN CN1CCCc2cc(CN[C@@H]3CCCc4n[nH]cc43)ccc21 ZINC000368609516 381083841 /nfs/dbraw/zinc/08/38/41/381083841.db2.gz YUVAUMBRDGHEPT-MRXNPFEDSA-N 0 3 296.418 2.959 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCCCCO)c1 ZINC000182466956 381093571 /nfs/dbraw/zinc/09/35/71/381093571.db2.gz VEEGVKFWIOIYAG-GFCCVEGCSA-N 0 3 267.369 2.604 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCC2=CCCC2)cc1OC ZINC000182664223 381134171 /nfs/dbraw/zinc/13/41/71/381134171.db2.gz NNCZJTBFCIAZFA-UHFFFAOYSA-N 0 3 277.364 2.999 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295996543 381202445 /nfs/dbraw/zinc/20/24/45/381202445.db2.gz OABOZSRBBLDNDF-GOEBONIOSA-N 0 3 299.370 2.711 20 10 CFCDHN C[C@H](N[C@H]1C[C@@H](O)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000296008037 381208532 /nfs/dbraw/zinc/20/85/32/381208532.db2.gz QVSZALZJRBEFPY-AEGPPILISA-N 0 3 292.398 2.990 20 10 CFCDHN C[C@H]([NH2+]CCCN1C[C@@H](C)O[C@H](C)C1)c1ccccc1[O-] ZINC000183394601 381266728 /nfs/dbraw/zinc/26/67/28/381266728.db2.gz FSYYUFAKCVNTIN-KFWWJZLASA-N 0 3 292.423 2.542 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCN1CCCCC1)CC2 ZINC000296086540 381249344 /nfs/dbraw/zinc/24/93/44/381249344.db2.gz SVUDZGGBWKRDTP-OAHLLOKOSA-N 0 3 274.408 2.845 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CC(C)(C)O)c([O-])c1 ZINC000296281719 381331551 /nfs/dbraw/zinc/33/15/51/381331551.db2.gz FCHZQJUFUPGKHK-NEPJUHHUSA-N 0 3 251.370 2.901 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CO)CC1CCC1)CC2 ZINC000296294452 381336623 /nfs/dbraw/zinc/33/66/23/381336623.db2.gz DFKDAJUAELIDJZ-KGLIPLIRSA-N 0 3 261.365 2.520 20 10 CFCDHN CC(C)[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)C(C)(C)O ZINC000296302955 381339668 /nfs/dbraw/zinc/33/96/68/381339668.db2.gz DRZYVCDVRXJRKH-WFASDCNBSA-N 0 3 263.381 2.765 20 10 CFCDHN CCC(CC)(C[NH2+][C@@H]1CCc2cccc([O-])c21)C(=O)OC ZINC000296557753 381447971 /nfs/dbraw/zinc/44/79/71/381447971.db2.gz UCHHMVKVYAXDMS-CYBMUJFWSA-N 0 3 291.391 2.949 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CO)Cc1ccccc1)CC2 ZINC000296490808 381418854 /nfs/dbraw/zinc/41/88/54/381418854.db2.gz PPSXHMBLWOZYRK-HOTGVXAUSA-N 0 3 283.371 2.573 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@H]3C13CCC3)CC2 ZINC000297129147 381551841 /nfs/dbraw/zinc/55/18/41/381551841.db2.gz YWTYHYYBRUYLOC-NSNWQYSKSA-N 0 3 285.387 2.927 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCNc1ccccn1)CC2 ZINC000297853765 381573599 /nfs/dbraw/zinc/57/35/99/381573599.db2.gz SZEDNWFMMUEIKH-CQSZACIVSA-N 0 3 283.375 2.866 20 10 CFCDHN C[C@H]([NH2+]CCCc1cnn(C)c1)c1cc(F)ccc1[O-] ZINC000185313488 381595453 /nfs/dbraw/zinc/59/54/53/381595453.db2.gz MIXZPGHSQQYPDN-NSHDSACASA-N 0 3 277.343 2.548 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H](c3ccncn3)C2)cc1 ZINC000371412334 381619315 /nfs/dbraw/zinc/61/93/15/381619315.db2.gz UPUPKDSPYIDETE-INIZCTEOSA-N 0 3 296.418 2.922 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000371469082 381633612 /nfs/dbraw/zinc/63/36/12/381633612.db2.gz CYEXEZWVCCBBIA-IMJJTQAJSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000371469082 381633617 /nfs/dbraw/zinc/63/36/17/381633617.db2.gz CYEXEZWVCCBBIA-IMJJTQAJSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)C[C@@H](C)O)c([O-])c1 ZINC000185521752 381656934 /nfs/dbraw/zinc/65/69/34/381656934.db2.gz PCEFRUCAGHUJDQ-UPJWGTAASA-N 0 3 251.370 2.758 20 10 CFCDHN CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)[C@H]1SC ZINC000298538346 381666228 /nfs/dbraw/zinc/66/62/28/381666228.db2.gz SUKDUZPRZMJDLG-ARFHVFGLSA-N 0 3 294.464 2.751 20 10 CFCDHN CC(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000185579575 381670805 /nfs/dbraw/zinc/67/08/05/381670805.db2.gz IXKCBEDRPXLRKJ-AWEZNQCLSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000185579575 381670812 /nfs/dbraw/zinc/67/08/12/381670812.db2.gz IXKCBEDRPXLRKJ-AWEZNQCLSA-N 0 3 291.391 2.946 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1Cn1cccn1 ZINC000371533854 381652680 /nfs/dbraw/zinc/65/26/80/381652680.db2.gz KEGKASWHGPHGBJ-OAHLLOKOSA-N 0 3 289.354 2.783 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCC[C@@H]1Cn1cccn1 ZINC000371533854 381652682 /nfs/dbraw/zinc/65/26/82/381652682.db2.gz KEGKASWHGPHGBJ-OAHLLOKOSA-N 0 3 289.354 2.783 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCO[C@@H]2CCOC2)c1 ZINC000185702229 381710475 /nfs/dbraw/zinc/71/04/75/381710475.db2.gz AWJXEIGQPGRVKN-UONOGXRCSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CO[C@@H]2CCOC2)c1 ZINC000185673108 381701787 /nfs/dbraw/zinc/70/17/87/381701787.db2.gz DFLXCRARZAXSIW-BFHYXJOUSA-N 0 3 279.380 2.545 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c([O-])c1 ZINC000185736479 381719342 /nfs/dbraw/zinc/71/93/42/381719342.db2.gz JYXKQIPHPAOSJM-MELADBBJSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)C[C@@H](C)O)c1 ZINC000186075248 381817370 /nfs/dbraw/zinc/81/73/70/381817370.db2.gz XGJHCKMTARAZAD-VXGBXAGGSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCOC2CCOCC2)c1 ZINC000186074151 381818538 /nfs/dbraw/zinc/81/85/38/381818538.db2.gz KQHWKJIXNQRYNB-CQSZACIVSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)CCO)c1ccccc1[O-] ZINC000186225120 381857199 /nfs/dbraw/zinc/85/71/99/381857199.db2.gz FSYCVKHRGZHWFP-ZDUSSCGKSA-N 0 3 251.370 2.842 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000373223649 381953098 /nfs/dbraw/zinc/95/30/98/381953098.db2.gz KDJZABBNQBPOJP-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000373223649 381953108 /nfs/dbraw/zinc/95/31/08/381953108.db2.gz KDJZABBNQBPOJP-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC([C@@H]3CCOC3)CC2)c1 ZINC000374931886 382061760 /nfs/dbraw/zinc/06/17/60/382061760.db2.gz PLRNLXDQHUOFQK-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374122295 382036049 /nfs/dbraw/zinc/03/60/49/382036049.db2.gz VGMFNYGWAOILLG-HUUCEWRRSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374122295 382036054 /nfs/dbraw/zinc/03/60/54/382036054.db2.gz VGMFNYGWAOILLG-HUUCEWRRSA-N 0 3 291.391 2.934 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968640 382113728 /nfs/dbraw/zinc/11/37/28/382113728.db2.gz NGZVINRBWHRKHQ-SDDRHHMPSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968640 382113732 /nfs/dbraw/zinc/11/37/32/382113732.db2.gz NGZVINRBWHRKHQ-SDDRHHMPSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968640 382113739 /nfs/dbraw/zinc/11/37/39/382113739.db2.gz NGZVINRBWHRKHQ-SDDRHHMPSA-N 0 3 296.361 2.948 20 10 CFCDHN CCOc1ccc(O)c(CN2CC=C(COC)CC2)c1 ZINC000187617504 382226479 /nfs/dbraw/zinc/22/64/79/382226479.db2.gz YQQZCVUANLDGBX-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN Cc1cc(CN2CCC(F)(F)[C@H](CO)C2)ccc1N(C)C ZINC000293597829 382189117 /nfs/dbraw/zinc/18/91/17/382189117.db2.gz OQUPIZYPTAZIQX-AWEZNQCLSA-N 0 3 298.377 2.511 20 10 CFCDHN CCc1noc(C)c1CNCc1cccc(C)c1O ZINC000293737413 382258289 /nfs/dbraw/zinc/25/82/89/382258289.db2.gz VKMAZEUZRDSAHP-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN CCC[C@H](C[NH2+][C@H](C)c1cc(OC)ccc1[O-])OC ZINC000293749245 382263200 /nfs/dbraw/zinc/26/32/00/382263200.db2.gz TWPNDWVLZJAUGO-DGCLKSJQSA-N 0 3 267.369 2.867 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000377633980 382307862 /nfs/dbraw/zinc/30/78/62/382307862.db2.gz WESRWBMANAPYOP-CXAGYDPISA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000377633980 382307869 /nfs/dbraw/zinc/30/78/69/382307869.db2.gz WESRWBMANAPYOP-CXAGYDPISA-N 0 3 291.391 2.964 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1[O-] ZINC000293859368 382309025 /nfs/dbraw/zinc/30/90/25/382309025.db2.gz BZIFMUNXBCCVGM-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@H](C(C)C)C2)c1[O-] ZINC000293859368 382309031 /nfs/dbraw/zinc/30/90/31/382309031.db2.gz BZIFMUNXBCCVGM-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@]23CCOC3)c1 ZINC000377685327 382319485 /nfs/dbraw/zinc/31/94/85/382319485.db2.gz ZTMCOQXZCUIRMV-BLLLJJGKSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@]23CCOC3)c1 ZINC000377685327 382319494 /nfs/dbraw/zinc/31/94/94/382319494.db2.gz ZTMCOQXZCUIRMV-BLLLJJGKSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364540411 382325437 /nfs/dbraw/zinc/32/54/37/382325437.db2.gz CVMBGASOLCTHSD-CXAGYDPISA-N 0 3 299.370 2.711 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364540411 382325444 /nfs/dbraw/zinc/32/54/44/382325444.db2.gz CVMBGASOLCTHSD-CXAGYDPISA-N 0 3 299.370 2.711 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1C[C@@H]3CCCCC[C@@H]31)OCO2 ZINC000378345172 382440750 /nfs/dbraw/zinc/44/07/50/382440750.db2.gz HWMUSBRSGOYVHS-AAEUAGOBSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1C[C@@H]3CCCCC[C@@H]31)OCO2 ZINC000378345172 382440757 /nfs/dbraw/zinc/44/07/57/382440757.db2.gz HWMUSBRSGOYVHS-AAEUAGOBSA-N 0 3 275.348 2.885 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000378371897 382449314 /nfs/dbraw/zinc/44/93/14/382449314.db2.gz AIBBFVNHBRACCI-YUELXQCFSA-N 0 3 261.365 2.638 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000378371897 382449316 /nfs/dbraw/zinc/44/93/16/382449316.db2.gz AIBBFVNHBRACCI-YUELXQCFSA-N 0 3 261.365 2.638 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H](CO)C2)c1[O-] ZINC000378436674 382459311 /nfs/dbraw/zinc/45/93/11/382459311.db2.gz CRDOOYPNXRNLGK-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H](CO)C2)c1[O-] ZINC000378436674 382459317 /nfs/dbraw/zinc/45/93/17/382459317.db2.gz CRDOOYPNXRNLGK-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cccc(OCC)c1[O-])C(C)C ZINC000188868443 382495958 /nfs/dbraw/zinc/49/59/58/382495958.db2.gz NCMNWTHNWQEHKH-AWEZNQCLSA-N 0 3 281.396 2.942 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(n2cccn2)CC1 ZINC000378500638 382473969 /nfs/dbraw/zinc/47/39/69/382473969.db2.gz UOCOBHJTDPYSAS-UHFFFAOYSA-N 0 3 275.327 2.565 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cccc(OC)c1[O-])OC ZINC000294241777 382475040 /nfs/dbraw/zinc/47/50/40/382475040.db2.gz PGEJEHKGYVDSEP-RISCZKNCSA-N 0 3 267.369 2.552 20 10 CFCDHN Cc1cc(CN2CC[C@@H](O)C(C)(C)C2)ccc1N(C)C ZINC000294649899 382519473 /nfs/dbraw/zinc/51/94/73/382519473.db2.gz QNXRVELROMRTTH-MRXNPFEDSA-N 0 3 276.424 2.654 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCc2ncccc2C)c1 ZINC000295034484 382563958 /nfs/dbraw/zinc/56/39/58/382563958.db2.gz OFGDXHFOSXMKBD-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cc(OC)c(OC)cc1[O-])OC ZINC000294818288 382530872 /nfs/dbraw/zinc/53/08/72/382530872.db2.gz OPYIFWHFJMWJSU-MEDUHNTESA-N 0 3 297.395 2.560 20 10 CFCDHN CC[C@@H](c1ccccc1O)N1CC(n2cccn2)C1 ZINC000366626221 382534006 /nfs/dbraw/zinc/53/40/06/382534006.db2.gz AYZJUAURDOXZRD-AWEZNQCLSA-N 0 3 257.337 2.597 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)cc1C ZINC000295211782 382586115 /nfs/dbraw/zinc/58/61/15/382586115.db2.gz LSUUUGHOQIPDKY-HNNXBMFYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](O)CC(C)(C)C2)cc1C ZINC000295211782 382586120 /nfs/dbraw/zinc/58/61/20/382586120.db2.gz LSUUUGHOQIPDKY-HNNXBMFYSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c1[O-] ZINC000249205991 383333888 /nfs/dbraw/zinc/33/38/88/383333888.db2.gz RVPCKYHLKVRDFC-YNEHKIRRSA-N 0 3 297.782 2.711 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1cccc(OC)c1[O-] ZINC000267262680 384339982 /nfs/dbraw/zinc/33/99/82/384339982.db2.gz KRIOTOANVDQBCI-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN CC[C@](C)(CCO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000268536873 384629452 /nfs/dbraw/zinc/62/94/52/384629452.db2.gz JRDIUOIPBYXNPG-OAHLLOKOSA-N 0 3 251.370 2.650 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NC[C@H](O)C(F)(F)F)cc1 ZINC000268859547 384679765 /nfs/dbraw/zinc/67/97/65/384679765.db2.gz RPOJTFAIYRBOAV-MFKMUULPSA-N 0 3 290.329 2.717 20 10 CFCDHN Cn1cc2c(n1)CCC[C@@H]2NCc1ccc2c(c1)CCO2 ZINC000280247642 384944269 /nfs/dbraw/zinc/94/42/69/384944269.db2.gz WKYSZWFLOPTYOJ-HNNXBMFYSA-N 0 3 283.375 2.522 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)CC2CCC2)c1 ZINC000281203124 385186699 /nfs/dbraw/zinc/18/66/99/385186699.db2.gz SENXCGIUQKWOSS-WCQYABFASA-N 0 3 279.380 2.603 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)c(O)c1C ZINC000281646451 385200072 /nfs/dbraw/zinc/20/00/72/385200072.db2.gz PIDPQFXXRQGQPK-KGLIPLIRSA-N 0 3 290.407 2.671 20 10 CFCDHN COC[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271760705 385391285 /nfs/dbraw/zinc/39/12/85/385391285.db2.gz YLWPQUAUVNLNAG-NSHDSACASA-N 0 3 269.772 2.822 20 10 CFCDHN COCC1(C[NH2+][C@H](C)c2cc(OC)ccc2[O-])CCC1 ZINC000282665091 385365155 /nfs/dbraw/zinc/36/51/55/385365155.db2.gz IUVCVSQMPWICIE-GFCCVEGCSA-N 0 3 279.380 2.868 20 10 CFCDHN CC[C@@H]([NH2+]CCCc1nc(C)no1)c1ccccc1[O-] ZINC000271723728 385390230 /nfs/dbraw/zinc/39/02/30/385390230.db2.gz QTOOZYPNMROZQW-CYBMUJFWSA-N 0 3 275.352 2.757 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H]2CCOC2)c1[O-] ZINC000271766335 385390727 /nfs/dbraw/zinc/39/07/27/385390727.db2.gz AIISFYMJLBDMAT-QWRGUYRKSA-N 0 3 269.772 2.869 20 10 CFCDHN COC[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271760705 385391291 /nfs/dbraw/zinc/39/12/91/385391291.db2.gz YLWPQUAUVNLNAG-NSHDSACASA-N 0 3 269.772 2.822 20 10 CFCDHN CO[C@H](C)CC[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000271891632 385395066 /nfs/dbraw/zinc/39/50/66/385395066.db2.gz SBLKCPDPZBMCTF-SNVBAGLBSA-N 0 3 257.761 2.869 20 10 CFCDHN CO[C@@H](C)CC[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000271891626 385395280 /nfs/dbraw/zinc/39/52/80/385395280.db2.gz SBLKCPDPZBMCTF-JTQLQIEISA-N 0 3 257.761 2.869 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CC[C@H](CO)CC2)c1[O-] ZINC000271872199 385395730 /nfs/dbraw/zinc/39/57/30/385395730.db2.gz YEFDCIRODFZXJV-YEORSEQZSA-N 0 3 283.799 2.995 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCCc3[nH]c(=O)ccc32)c1[O-] ZINC000271925285 385402906 /nfs/dbraw/zinc/40/29/06/385402906.db2.gz OKXDHOSKHHISCT-AWEZNQCLSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2(C(N)=O)CCCC2)c([O-])c1 ZINC000283887587 385510235 /nfs/dbraw/zinc/51/02/35/385510235.db2.gz CJGZFYHZFKDIMN-ZDUSSCGKSA-N 0 3 290.407 2.705 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(C(N)=O)c2)c([O-])c1 ZINC000284242634 385547463 /nfs/dbraw/zinc/54/74/63/385547463.db2.gz VDUKOLHJCDBGHV-ZDUSSCGKSA-N 0 3 298.386 2.959 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)N(C)C)c([O-])c1 ZINC000283967234 385519455 /nfs/dbraw/zinc/51/94/55/385519455.db2.gz GJACGNXKHXSGPZ-STQMWFEESA-N 0 3 250.386 2.610 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285336360 385554586 /nfs/dbraw/zinc/55/45/86/385554586.db2.gz UOAAORYMAOBZMG-KGLIPLIRSA-N 0 3 290.407 2.671 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000285406309 385555109 /nfs/dbraw/zinc/55/51/09/385555109.db2.gz FMCNETRVDPFKPZ-UONOGXRCSA-N 0 3 293.407 2.943 20 10 CFCDHN Cc1cccc(CN2CCC(O)(C(F)(F)F)CC2)c1O ZINC000272881483 385640293 /nfs/dbraw/zinc/64/02/93/385640293.db2.gz XWUHARGDIUQQAS-UHFFFAOYSA-N 0 3 289.297 2.590 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](O)CCc2ccccc2)c1[O-] ZINC000273245725 385674934 /nfs/dbraw/zinc/67/49/34/385674934.db2.gz ZMRQCRQZRXNOJJ-QGZVFWFLSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1ccc([C@@H](C)NC[C@H](O)C(F)(F)F)c(O)c1C ZINC000273306106 385677439 /nfs/dbraw/zinc/67/74/39/385677439.db2.gz CWMKCMMHPHBHAC-KOLCDFICSA-N 0 3 277.286 2.583 20 10 CFCDHN COC[C@@H](C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2)OC ZINC000273381570 385680511 /nfs/dbraw/zinc/68/05/11/385680511.db2.gz CEFHRTGHWADCRG-SWLSCSKDSA-N 0 3 293.407 2.583 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CC[S@@](C)=O)c([O-])c1C ZINC000273513153 385685965 /nfs/dbraw/zinc/68/59/65/385685965.db2.gz SDRVLKYKRQUONF-RGIROJJOSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC(=O)N(C(C)C)C2)c([O-])c1C ZINC000273497406 385686632 /nfs/dbraw/zinc/68/66/32/385686632.db2.gz PMAHDTMTKLJNDA-KBPBESRZSA-N 0 3 290.407 2.669 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273554506 385687260 /nfs/dbraw/zinc/68/72/60/385687260.db2.gz GQKBVYUUSKPIPM-SGMGOOAPSA-N 0 3 283.437 2.772 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273554504 385687508 /nfs/dbraw/zinc/68/75/08/385687508.db2.gz GQKBVYUUSKPIPM-MBNYWOFBSA-N 0 3 283.437 2.772 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)C(C)C)c([O-])c1C ZINC000273557800 385687657 /nfs/dbraw/zinc/68/76/57/385687657.db2.gz HHYXEVJWMKUGEE-GXTWGEPZSA-N 0 3 251.370 2.677 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCN(C)C)c([O-])c1C ZINC000273562986 385688092 /nfs/dbraw/zinc/68/80/92/385688092.db2.gz IRANUBBEIBKAAB-GXTWGEPZSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCO[C@@H]2CCOC2)c([O-])c1C ZINC000273563893 385689081 /nfs/dbraw/zinc/68/90/81/385689081.db2.gz IZBYYPOYZUQWEI-LSDHHAIUSA-N 0 3 293.407 2.855 20 10 CFCDHN C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)c1cc(F)ccc1[O-] ZINC000273590362 385689803 /nfs/dbraw/zinc/68/98/03/385689803.db2.gz OYPFDPQOKPDAOD-ZETOZRRWSA-N 0 3 278.371 2.665 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1cc(F)ccc1[O-] ZINC000273596450 385690652 /nfs/dbraw/zinc/69/06/52/385690652.db2.gz QVEXHFBTISRPSY-NHYWBVRUSA-N 0 3 298.427 2.619 20 10 CFCDHN CC(=O)NC1CCC([NH2+][C@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273609601 385690787 /nfs/dbraw/zinc/69/07/87/385690787.db2.gz VIHIGZUBKNFONP-LRVUVFPRSA-N 0 3 290.407 2.799 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cc(C)ccc2[O-])o1 ZINC000273612087 385691664 /nfs/dbraw/zinc/69/16/64/385691664.db2.gz WFIUXZBNHPXIKH-SWLSCSKDSA-N 0 3 275.348 2.986 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(C(N)=O)CCCC2)c([O-])c1C ZINC000273610826 385691735 /nfs/dbraw/zinc/69/17/35/385691735.db2.gz VTFXCSUEGKAVJJ-ZDUSSCGKSA-N 0 3 290.407 2.705 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]Cc2ccn(C)c2)c1[O-] ZINC000273746336 385694088 /nfs/dbraw/zinc/69/40/88/385694088.db2.gz MQIAZIAHDGTTTF-UHFFFAOYSA-N 0 3 280.755 2.683 20 10 CFCDHN CN(C)c1ccc(CN[C@@]2(C)CCO[C@@H]2C2CC2)cc1F ZINC000273044982 385669943 /nfs/dbraw/zinc/66/99/43/385669943.db2.gz BIOFSGWQARAFEM-SJORKVTESA-N 0 3 292.398 2.939 20 10 CFCDHN O[C@H](CCc1ccccc1)CNCc1ccc2c(c1)CCO2 ZINC000273064865 385670269 /nfs/dbraw/zinc/67/02/69/385670269.db2.gz FXPMFSIXBIACHW-GOSISDBHSA-N 0 3 297.398 2.705 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273047717 385670411 /nfs/dbraw/zinc/67/04/11/385670411.db2.gz JTVITDZCSLTZAQ-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCO[C@H]2C2CC2)cc1C ZINC000372864407 393458120 /nfs/dbraw/zinc/45/81/20/393458120.db2.gz VVZGYHAQWSJTBU-ZBFHGGJFSA-N 0 3 261.365 2.666 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C)CSC)c1[O-] ZINC000076769394 393692518 /nfs/dbraw/zinc/69/25/18/393692518.db2.gz ILIGKMKZELSBOW-SNVBAGLBSA-N 0 3 255.383 2.632 20 10 CFCDHN Oc1cccc2c1CC[C@@H]2NCc1cc2c(cc1O)OCO2 ZINC000105486554 393863973 /nfs/dbraw/zinc/86/39/73/393863973.db2.gz VNBWTVOSMMKCCB-ZDUSSCGKSA-N 0 3 299.326 2.604 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)[C@H]1CCOC1 ZINC000106857956 393868015 /nfs/dbraw/zinc/86/80/15/393868015.db2.gz HMFQXAQMAVSYHH-ZDUSSCGKSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)[C@H]1CCOC1 ZINC000106857956 393868021 /nfs/dbraw/zinc/86/80/21/393868021.db2.gz HMFQXAQMAVSYHH-ZDUSSCGKSA-N 0 3 257.333 2.766 20 10 CFCDHN CCCCOC(=O)CC[N@H+](C)Cc1ccccc1[O-] ZINC000121150242 393949306 /nfs/dbraw/zinc/94/93/06/393949306.db2.gz ZGDRZTQJWNBBHH-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCCCOC(=O)CC[N@@H+](C)Cc1ccccc1[O-] ZINC000121150242 393949312 /nfs/dbraw/zinc/94/93/12/393949312.db2.gz ZGDRZTQJWNBBHH-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])CC1(O)CCOCC1 ZINC000282370610 394124157 /nfs/dbraw/zinc/12/41/57/394124157.db2.gz FCQDPJHSDZGHIN-UHFFFAOYSA-N 0 3 293.407 2.536 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])CC1(O)CCOCC1 ZINC000282370610 394124159 /nfs/dbraw/zinc/12/41/59/394124159.db2.gz FCQDPJHSDZGHIN-UHFFFAOYSA-N 0 3 293.407 2.536 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1[C@H]2COC[C@H]21)c1ccc(C)cc1[O-] ZINC000367688964 394260482 /nfs/dbraw/zinc/26/04/82/394260482.db2.gz OEXBEWYHNMKUGE-XQLPTFJDSA-N 0 3 261.365 2.634 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])[C@@H](O)C(F)F ZINC000296444709 394309212 /nfs/dbraw/zinc/30/92/12/394309212.db2.gz MNDUTKQRSGXBAZ-SUZMYJTESA-N 0 3 273.323 2.756 20 10 CFCDHN Cc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1 ZINC000006416173 170199572 /nfs/dbraw/zinc/19/95/72/170199572.db2.gz JZDRNFQYSFXLMK-UHFFFAOYSA-N 0 3 263.318 2.501 20 10 CFCDHN CN(C)c1ccc(CNC[C@@H](c2ccco2)N(C)C)cc1 ZINC000020122047 171001740 /nfs/dbraw/zinc/00/17/40/171001740.db2.gz IOWDXEIYYBAPJF-INIZCTEOSA-N 0 3 287.407 2.738 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2ccccn2)c1O ZINC000020123377 171004067 /nfs/dbraw/zinc/00/40/67/171004067.db2.gz QIOKPCINKXPEMO-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H](C(C)C)N2CCCC2)c1[O-] ZINC000020200753 171064508 /nfs/dbraw/zinc/06/45/08/171064508.db2.gz DAVJZXJPHRLBST-OAHLLOKOSA-N 0 3 292.423 2.611 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)[C@@H]2CCCO2)c1 ZINC000020207108 171071409 /nfs/dbraw/zinc/07/14/09/171071409.db2.gz JSWAZCLCWIIPLE-RWSFTLGLSA-N 0 3 265.353 2.619 20 10 CFCDHN O=C(c1cccc2c1CCNC2)N1CCc2cccc(F)c21 ZINC000662800863 414612121 /nfs/dbraw/zinc/61/21/21/414612121.db2.gz UKVMYZCYSMQHOL-UHFFFAOYSA-N 0 3 296.345 2.674 20 10 CFCDHN Cc1cccc2c1CCN2C(=O)c1cccc2c1CCNC2 ZINC000662544942 414563519 /nfs/dbraw/zinc/56/35/19/414563519.db2.gz IFTLETIOYJBLCT-UHFFFAOYSA-N 0 3 292.382 2.844 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1ccccc1[O-] ZINC000367436074 262010455 /nfs/dbraw/zinc/01/04/55/262010455.db2.gz DNOLMOHFZJNFRP-LBPRGKRZSA-N 0 3 271.364 2.776 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@]3(C2)CCCOC3)cc1F ZINC000367436840 262020610 /nfs/dbraw/zinc/02/06/10/262020610.db2.gz HIXGCLLHTUZGAY-QGZVFWFLSA-N 0 3 292.398 2.894 20 10 CFCDHN CN1C[C@@H](C[NH2+]Cc2ccccc2[O-])Cc2ccccc21 ZINC000363989039 262079457 /nfs/dbraw/zinc/07/94/57/262079457.db2.gz ZAOTULJDDDRPJC-CQSZACIVSA-N 0 3 282.387 2.791 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c1 ZINC000367472736 267092730 /nfs/dbraw/zinc/09/27/30/267092730.db2.gz UPDRZZUQAQFUGV-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)c1 ZINC000367472736 267092732 /nfs/dbraw/zinc/09/27/32/267092732.db2.gz UPDRZZUQAQFUGV-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN CC(C)[C@]1(CO)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000367958050 267129970 /nfs/dbraw/zinc/12/99/70/267129970.db2.gz DJPNPNGGVKZLFT-QGZVFWFLSA-N 0 3 294.414 2.732 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[NH+]1CC([C@H]2CCOC2)C1 ZINC000368038752 267139950 /nfs/dbraw/zinc/13/99/50/267139950.db2.gz CZHUQNWSIUCAJI-WFASDCNBSA-N 0 3 261.365 2.812 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C2 ZINC000368316269 267161369 /nfs/dbraw/zinc/16/13/69/267161369.db2.gz ORBUIJHMDOTLEC-WCQYABFASA-N 0 3 289.354 2.702 20 10 CFCDHN O[C@H]1CN(Cc2ccc(N3CCCCC3)cc2)CC12CC2 ZINC000368800194 267206614 /nfs/dbraw/zinc/20/66/14/267206614.db2.gz LZTCJIXADGQKLQ-KRWDZBQOSA-N 0 3 286.419 2.634 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)c([O-])c1 ZINC000369677894 267259675 /nfs/dbraw/zinc/25/96/75/267259675.db2.gz ZPZZBTPTKCMEPI-KRWDZBQOSA-N 0 3 291.391 2.528 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([O-])c1 ZINC000369677894 267259678 /nfs/dbraw/zinc/25/96/78/267259678.db2.gz ZPZZBTPTKCMEPI-KRWDZBQOSA-N 0 3 291.391 2.528 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)c([O-])c1 ZINC000369684546 267259704 /nfs/dbraw/zinc/25/97/04/267259704.db2.gz VRTRIENWRWUICT-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c([O-])c1 ZINC000369684546 267259707 /nfs/dbraw/zinc/25/97/07/267259707.db2.gz VRTRIENWRWUICT-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H]3OCC[C@H]3C2)cc1F ZINC000369683976 267259923 /nfs/dbraw/zinc/25/99/23/267259923.db2.gz QWSDNQHMLYTOOM-XJKSGUPXSA-N 0 3 278.371 2.503 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000369930662 267277333 /nfs/dbraw/zinc/27/73/33/267277333.db2.gz NUXZRSTVBBGRQI-HOCLYGCPSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCO[C@H](C2CC2)C1 ZINC000369930662 267277334 /nfs/dbraw/zinc/27/73/34/267277334.db2.gz NUXZRSTVBBGRQI-HOCLYGCPSA-N 0 3 261.365 2.954 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c1 ZINC000370394027 267315776 /nfs/dbraw/zinc/31/57/76/267315776.db2.gz DHJLBBGYTKNAGQ-WCQYABFASA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2CN(C)Cc3ccccc32)c1 ZINC000371091525 267350336 /nfs/dbraw/zinc/35/03/36/267350336.db2.gz ZMICNRVERLBGHV-KRWDZBQOSA-N 0 3 282.387 2.977 20 10 CFCDHN CC1(C)C[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CCO1 ZINC000296979708 275868977 /nfs/dbraw/zinc/86/89/77/275868977.db2.gz RWNZFOBKFUQUQQ-CHWSQXEVSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1cccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1[O-] ZINC000292747794 278010813 /nfs/dbraw/zinc/01/08/13/278010813.db2.gz IEKTWOAZKOSHQV-OAHLLOKOSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1[O-] ZINC000292747794 278010815 /nfs/dbraw/zinc/01/08/15/278010815.db2.gz IEKTWOAZKOSHQV-OAHLLOKOSA-N 0 3 291.391 2.649 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CC)[C@@H](O)C(F)F)c1ccccc1[O-] ZINC000295131853 288062785 /nfs/dbraw/zinc/06/27/85/288062785.db2.gz YDBVQLQAQDOMQQ-GMXVVIOVSA-N 0 3 273.323 2.838 20 10 CFCDHN C[C@H](CN1CCCCC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295767352 279303806 /nfs/dbraw/zinc/30/38/06/279303806.db2.gz ACSOFCLIYJWAEP-HIFRSBDPSA-N 0 3 274.408 2.844 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@](=O)CC[C@H]1C ZINC000377698939 288167564 /nfs/dbraw/zinc/16/75/64/288167564.db2.gz NBVMQYDREUNYON-BBEGDGIKSA-N 0 3 281.421 2.686 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185656955 279863257 /nfs/dbraw/zinc/86/32/57/279863257.db2.gz RXVGGHWLHBYJCG-MLGOLLRUSA-N 0 3 277.408 2.939 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)c1[O-] ZINC000529567171 281405520 /nfs/dbraw/zinc/40/55/20/281405520.db2.gz IYZMGODUFAJCOK-BPNCWPANSA-N 0 3 261.365 2.925 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@@H]3OCC[C@@H]31)CC2 ZINC000296264470 328289829 /nfs/dbraw/zinc/28/98/29/328289829.db2.gz BQIUMECKZBIXOS-KQTLUZQSSA-N 0 3 273.376 2.927 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2cccc(OC)c2[O-])C1 ZINC000375096189 329000239 /nfs/dbraw/zinc/00/02/39/329000239.db2.gz CNZXYUPDFXTYSB-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2cccc(OC)c2[O-])C1 ZINC000375096189 329000241 /nfs/dbraw/zinc/00/02/41/329000241.db2.gz CNZXYUPDFXTYSB-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@H]2CCCOC2)c([O-])c1 ZINC000527739905 330282674 /nfs/dbraw/zinc/28/26/74/330282674.db2.gz QAXSSHLZMIHTDM-CYBMUJFWSA-N 0 3 279.380 2.697 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H]2CCN2C2CCCC2)c1 ZINC000527808927 330284752 /nfs/dbraw/zinc/28/47/52/330284752.db2.gz RBGSYGBSGHSWNS-MRXNPFEDSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ncccc1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000527983579 330298395 /nfs/dbraw/zinc/29/83/95/330298395.db2.gz AVSWUCDRKYZDBN-AWEZNQCLSA-N 0 3 254.333 2.873 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1c2ccccc2C(=O)N1C)c1ccccc1[O-] ZINC000528008718 330303787 /nfs/dbraw/zinc/30/37/87/330303787.db2.gz XBLKSHCIMUMRLS-LRDDRELGSA-N 0 3 296.370 2.870 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000087014145 521657340 /nfs/dbraw/zinc/65/73/40/521657340.db2.gz RAVGLYGDIRBYGV-GFCCVEGCSA-N 0 3 251.370 2.902 20 10 CFCDHN CCSCCC[NH2+]Cc1cc(OC)ccc1[O-] ZINC000272955173 521703765 /nfs/dbraw/zinc/70/37/65/521703765.db2.gz ZCFVVJLPFHSFCE-UHFFFAOYSA-N 0 3 255.383 2.634 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000094617601 521717818 /nfs/dbraw/zinc/71/78/18/521717818.db2.gz YKSOLVQLMLLCKU-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN CN(C)c1ccc(CNC[C@@H](O)c2ccsc2)cc1 ZINC000219094628 522209995 /nfs/dbraw/zinc/20/99/95/522209995.db2.gz OLKGQRGWVXJARB-OAHLLOKOSA-N 0 3 276.405 2.637 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@](C)(OC)C2CC2)c1[O-] ZINC000291062370 522539134 /nfs/dbraw/zinc/53/91/34/522539134.db2.gz PQJPLMDNJOKPBO-HNNXBMFYSA-N 0 3 299.798 2.959 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2(CN(C)C)CCC2)c1[O-] ZINC000281301811 522539709 /nfs/dbraw/zinc/53/97/09/522539709.db2.gz PTAXONVCMYEQNJ-UHFFFAOYSA-N 0 3 298.814 2.628 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)CSC)c1[O-] ZINC000169088577 522541341 /nfs/dbraw/zinc/54/13/41/522541341.db2.gz NDICDPQPYYALKX-QMMMGPOBSA-N 0 3 275.801 2.895 20 10 CFCDHN CC(C)[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1CCOC1 ZINC000291309105 519653830 /nfs/dbraw/zinc/65/38/30/519653830.db2.gz RKGKBAITDNPWOU-CYBMUJFWSA-N 0 3 253.317 2.531 20 10 CFCDHN CC(C)[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1CCOC1 ZINC000291309105 519653832 /nfs/dbraw/zinc/65/38/32/519653832.db2.gz RKGKBAITDNPWOU-CYBMUJFWSA-N 0 3 253.317 2.531 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])[C@@H]1[C@@H]1CCCO1 ZINC000291658518 520481364 /nfs/dbraw/zinc/48/13/64/520481364.db2.gz VFHJTQBMSDAFOP-LSDHHAIUSA-N 0 3 261.365 2.782 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])[C@@H]1[C@@H]1CCCO1 ZINC000291658518 520481374 /nfs/dbraw/zinc/48/13/74/520481374.db2.gz VFHJTQBMSDAFOP-LSDHHAIUSA-N 0 3 261.365 2.782 20 10 CFCDHN CCCC[N@H+](CCOC)Cc1cc(OC)c(OC)cc1[O-] ZINC000160169774 520536020 /nfs/dbraw/zinc/53/60/20/520536020.db2.gz OEEOBIYVUTVVOG-UHFFFAOYSA-N 0 3 297.395 2.658 20 10 CFCDHN CCCC[N@@H+](CCOC)Cc1cc(OC)c(OC)cc1[O-] ZINC000160169774 520536026 /nfs/dbraw/zinc/53/60/26/520536026.db2.gz OEEOBIYVUTVVOG-UHFFFAOYSA-N 0 3 297.395 2.658 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000289688295 520963236 /nfs/dbraw/zinc/96/32/36/520963236.db2.gz BLLWUZDJGLQMCD-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000289688295 520963240 /nfs/dbraw/zinc/96/32/40/520963240.db2.gz BLLWUZDJGLQMCD-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(OC)ccc1[O-] ZINC000278813082 521316348 /nfs/dbraw/zinc/31/63/48/521316348.db2.gz YULKRSXUCIFCRU-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cc(OC)ccc1[O-] ZINC000278813082 521316358 /nfs/dbraw/zinc/31/63/58/521316358.db2.gz YULKRSXUCIFCRU-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CCCSC)c1[O-] ZINC000281111535 521331190 /nfs/dbraw/zinc/33/11/90/521331190.db2.gz BGGNXVQQKIUVJD-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CCCSC)c1[O-] ZINC000281111535 521331200 /nfs/dbraw/zinc/33/12/00/521331200.db2.gz BGGNXVQQKIUVJD-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@@H](C)OC)c1[O-] ZINC000291151949 521332238 /nfs/dbraw/zinc/33/22/38/521332238.db2.gz ZREMRVKWZUKXHR-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@@H](C)OC)c1[O-] ZINC000291151949 521332246 /nfs/dbraw/zinc/33/22/46/521332246.db2.gz ZREMRVKWZUKXHR-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000280565630 521338667 /nfs/dbraw/zinc/33/86/67/521338667.db2.gz VHUYUEGTOIHTKW-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000280565630 521338671 /nfs/dbraw/zinc/33/86/71/521338671.db2.gz VHUYUEGTOIHTKW-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[NH2+]CC(C)(C)COC)c1[O-] ZINC000291669303 521361361 /nfs/dbraw/zinc/36/13/61/521361361.db2.gz GDVHMOBOLGHODF-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN CCOc1cccc(C[NH2+]CCN(C)[C@H](C)CC)c1[O-] ZINC000217390896 521362247 /nfs/dbraw/zinc/36/22/47/521362247.db2.gz ISBCBRFJYVXJLB-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN CCN(Cc1ccncc1)Cc1cccc(OC)c1O ZINC000023171122 521421956 /nfs/dbraw/zinc/42/19/56/521421956.db2.gz UHVZIRLMQDVNPW-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN CCC(O)(CC)CC[NH2+]Cc1cccc(C)c1[O-] ZINC000276341016 521651619 /nfs/dbraw/zinc/65/16/19/521651619.db2.gz GZQDVKNCWDDTFP-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000276736360 521652423 /nfs/dbraw/zinc/65/24/23/521652423.db2.gz YOGHJLDGNILKPW-LBPRGKRZSA-N 0 3 251.370 2.984 20 10 CFCDHN CN(C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1cccs1 ZINC000226619018 522028817 /nfs/dbraw/zinc/02/88/17/522028817.db2.gz NLHZZTMIZQTTIO-ZDUSSCGKSA-N 0 3 294.395 2.985 20 10 CFCDHN CC[C@H](CCO)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000094949419 522145865 /nfs/dbraw/zinc/14/58/65/522145865.db2.gz SBVALKVSFPENMC-CHWSQXEVSA-N 0 3 251.370 2.760 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@@H](CO)c2ccccc2)cc1 ZINC000278332688 522172338 /nfs/dbraw/zinc/17/23/38/522172338.db2.gz DSCMETJUPUCOMZ-SFHVURJKSA-N 0 3 284.403 2.918 20 10 CFCDHN CCc1nc([C@H]2CCC[N@H+](Cc3ccccc3[O-])C2)no1 ZINC000361053751 522461584 /nfs/dbraw/zinc/46/15/84/522461584.db2.gz SPHGLBBZAYJECG-ZDUSSCGKSA-N 0 3 287.363 2.717 20 10 CFCDHN CCc1nc([C@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)no1 ZINC000361053751 522461590 /nfs/dbraw/zinc/46/15/90/522461590.db2.gz SPHGLBBZAYJECG-ZDUSSCGKSA-N 0 3 287.363 2.717 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H](C)N(C)[C@@H](C)C2)c1O ZINC000141902165 522535858 /nfs/dbraw/zinc/53/58/58/522535858.db2.gz IGFHQNUVBYCGJV-PHIMTYICSA-N 0 3 298.814 2.579 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)CCCCCO)c1[O-] ZINC000279520881 522537886 /nfs/dbraw/zinc/53/78/86/522537886.db2.gz YINBOKOGHPYMCV-UHFFFAOYSA-N 0 3 287.787 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)CCCCCO)c1[O-] ZINC000279520881 522537895 /nfs/dbraw/zinc/53/78/95/522537895.db2.gz YINBOKOGHPYMCV-UHFFFAOYSA-N 0 3 287.787 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCSC2)c1[O-] ZINC000228551572 522541853 /nfs/dbraw/zinc/54/18/53/522541853.db2.gz GBCXHZAHHXYYLQ-SECBINFHSA-N 0 3 287.812 2.897 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@@H](C)CO)c1ccccc1[O-] ZINC000229565057 522586790 /nfs/dbraw/zinc/58/67/90/522586790.db2.gz UYPSVIKKMZLJJE-OCCSQVGLSA-N 0 3 251.370 2.842 20 10 CFCDHN CC[C@H]([NH2+]CCNc1ccccn1)c1ccccc1[O-] ZINC000274966346 522594920 /nfs/dbraw/zinc/59/49/20/522594920.db2.gz XLWHSAOZWMAYAZ-AWEZNQCLSA-N 0 3 271.364 2.940 20 10 CFCDHN CC[C@@H](CSC)[NH2+]Cc1cccc(OC)c1[O-] ZINC000163878369 522615434 /nfs/dbraw/zinc/61/54/34/522615434.db2.gz RTULTFGJTOTVCH-NSHDSACASA-N 0 3 255.383 2.632 20 10 CFCDHN CC[C@H](NCc1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000160529646 522649521 /nfs/dbraw/zinc/64/95/21/522649521.db2.gz GMDVCIGAQKNJAN-INIZCTEOSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C(C)C)c1ccc(C)cc1[O-] ZINC000280182576 522747390 /nfs/dbraw/zinc/74/73/90/522747390.db2.gz RSQYRGIVTKNLDE-UONOGXRCSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cnn(C)c1C)c1ccc(C)cc1[O-] ZINC000280146909 522891735 /nfs/dbraw/zinc/89/17/35/522891735.db2.gz PYAGAQJVXUJZIH-OAHLLOKOSA-N 0 3 273.380 2.983 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2cc(C)ccc2[O-])CCCC1 ZINC000279691710 522933034 /nfs/dbraw/zinc/93/30/34/522933034.db2.gz PWJDTXAECUZEAI-UHFFFAOYSA-N 0 3 277.364 2.666 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000364762081 523104810 /nfs/dbraw/zinc/10/48/10/523104810.db2.gz XTSOHFFSHROQKG-AWEZNQCLSA-N 0 3 286.379 2.841 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1cc(F)ccc1F ZINC000264700242 523383306 /nfs/dbraw/zinc/38/33/06/523383306.db2.gz JVJTYMMBRVYPDQ-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1cc(F)ccc1F ZINC000264700242 523383316 /nfs/dbraw/zinc/38/33/16/523383316.db2.gz JVJTYMMBRVYPDQ-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C1Cc2ccccc2C1 ZINC000264686123 523383416 /nfs/dbraw/zinc/38/34/16/523383416.db2.gz FOIAPZKFOPTWLV-UHFFFAOYSA-N 0 3 253.345 2.991 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C1Cc2ccccc2C1 ZINC000264686123 523383422 /nfs/dbraw/zinc/38/34/22/523383422.db2.gz FOIAPZKFOPTWLV-UHFFFAOYSA-N 0 3 253.345 2.991 20 10 CFCDHN CO[C@@H](C)C[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000191204633 523418644 /nfs/dbraw/zinc/41/86/44/523418644.db2.gz BRFRDNVYXYZRSH-VIFPVBQESA-N 0 3 288.185 2.588 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000191956796 523618840 /nfs/dbraw/zinc/61/88/40/523618840.db2.gz RGJRAKDIFSMWMF-MRXNPFEDSA-N 0 3 263.381 2.746 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000191956796 523618851 /nfs/dbraw/zinc/61/88/51/523618851.db2.gz RGJRAKDIFSMWMF-MRXNPFEDSA-N 0 3 263.381 2.746 20 10 CFCDHN CO[C@@]1(C)CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000280148956 523806701 /nfs/dbraw/zinc/80/67/01/523806701.db2.gz DOKJKEOZSUFBED-HNNXBMFYSA-N 0 3 267.344 2.922 20 10 CFCDHN CO[C@@]1(C)CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000280148956 523806708 /nfs/dbraw/zinc/80/67/08/523806708.db2.gz DOKJKEOZSUFBED-HNNXBMFYSA-N 0 3 267.344 2.922 20 10 CFCDHN CN1CCCc2cc(CNCc3ccncc3)ccc21 ZINC000050266793 523862572 /nfs/dbraw/zinc/86/25/72/523862572.db2.gz FPTYPCZWJGZVBL-UHFFFAOYSA-N 0 3 267.376 2.754 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2cc(C)ccc2[O-])C1 ZINC000193889741 523966269 /nfs/dbraw/zinc/96/62/69/523966269.db2.gz RNQIFROPGADBKJ-FRRDWIJNSA-N 0 3 277.364 2.693 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2[O-])C1 ZINC000193889754 523966443 /nfs/dbraw/zinc/96/64/43/523966443.db2.gz RNQIFROPGADBKJ-RWMBFGLXSA-N 0 3 277.364 2.693 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370480 523991630 /nfs/dbraw/zinc/99/16/30/523991630.db2.gz HKZFWXOYLHTCKT-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370480 523991633 /nfs/dbraw/zinc/99/16/33/523991633.db2.gz HKZFWXOYLHTCKT-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370480 523991635 /nfs/dbraw/zinc/99/16/35/523991635.db2.gz HKZFWXOYLHTCKT-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370480 523991639 /nfs/dbraw/zinc/99/16/39/523991639.db2.gz HKZFWXOYLHTCKT-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN COc1ccc(CNC[C@@H](O)c2ccc(C)o2)cc1C ZINC000265942014 524071496 /nfs/dbraw/zinc/07/14/96/524071496.db2.gz FZUFZLDLBGNGMX-CQSZACIVSA-N 0 3 275.348 2.728 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)N1[C@H](C)CC[C@H]1C ZINC000101645586 524086383 /nfs/dbraw/zinc/08/63/83/524086383.db2.gz DZYLRYJGDCAAQJ-MCIONIFRSA-N 0 3 290.407 2.612 20 10 CFCDHN COc1ccc(CN[C@H](C)c2ccccc2O)c(OC)n1 ZINC000289597683 524090671 /nfs/dbraw/zinc/09/06/71/524090671.db2.gz BJWIFIKJOWAVOZ-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCOCC(F)F)c([O-])c1 ZINC000285045552 524334495 /nfs/dbraw/zinc/33/44/95/524334495.db2.gz IEVQXTPJXBELAL-NSHDSACASA-N 0 3 273.323 2.941 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](O)c2ccsc2)c1[O-] ZINC000224858085 524431662 /nfs/dbraw/zinc/43/16/62/524431662.db2.gz KNEVMOJEOSWDSN-CYBMUJFWSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+][C@H](C)c2ccccc2[O-])n1 ZINC000167432028 524523542 /nfs/dbraw/zinc/52/35/42/524523542.db2.gz JPXPZJLWWGHFPP-CQSZACIVSA-N 0 3 273.380 2.946 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H](C)c2nccs2)c1 ZINC000230694070 524752366 /nfs/dbraw/zinc/75/23/66/524752366.db2.gz YURFNQJMHUWKMH-JTQLQIEISA-N 0 3 278.377 2.751 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2ccncc2)c1 ZINC000048261372 524768725 /nfs/dbraw/zinc/76/87/25/524768725.db2.gz NURGHSJULIDHLA-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@@H]2C2CC2)c1 ZINC000230669860 524773708 /nfs/dbraw/zinc/77/37/08/524773708.db2.gz UVYZMPABNHVEHJ-JMPLFQLZSA-N 0 3 277.364 2.619 20 10 CFCDHN COc1ncccc1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000290126778 525044292 /nfs/dbraw/zinc/04/42/92/525044292.db2.gz JTAKFQDHSITXJL-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN C[C@@H]1CN2CCCC[C@@H]2C[N@@H+]1Cc1cccc(F)c1[O-] ZINC000166378166 525080262 /nfs/dbraw/zinc/08/02/62/525080262.db2.gz SRYYGSGQIAFOEU-TZMCWYRMSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@@H]1CN2CCCC[C@@H]2C[N@H+]1Cc1cccc(F)c1[O-] ZINC000166378166 525080276 /nfs/dbraw/zinc/08/02/76/525080276.db2.gz SRYYGSGQIAFOEU-TZMCWYRMSA-N 0 3 278.371 2.590 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H](O)c2ccc(F)cc2)cc1C ZINC000277635357 525322707 /nfs/dbraw/zinc/32/27/07/525322707.db2.gz CROQKKDJWQARJS-KRWDZBQOSA-N 0 3 289.350 2.971 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@]2(O)CCC[C@@H]2C)cc1C ZINC000292903008 525322757 /nfs/dbraw/zinc/32/27/57/525322757.db2.gz DWYLGBKPDFLUNY-BBRMVZONSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H]2CCSC2)cc1C ZINC000279823997 525323429 /nfs/dbraw/zinc/32/34/29/525323429.db2.gz BRLSBRWVLWUPBF-LBPRGKRZSA-N 0 3 251.395 2.852 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H]2CCSC2)cc1C ZINC000279823987 525323635 /nfs/dbraw/zinc/32/36/35/525323635.db2.gz BRLSBRWVLWUPBF-GFCCVEGCSA-N 0 3 251.395 2.852 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](O)c2ccccc2)c1 ZINC000071407046 525350008 /nfs/dbraw/zinc/35/00/08/525350008.db2.gz IYFSRYWHZNUCBO-INIZCTEOSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](O)c2ccsc2)c1 ZINC000219094336 525350724 /nfs/dbraw/zinc/35/07/24/525350724.db2.gz PEHJMSCJFBYRTB-AWEZNQCLSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCCc3c2cnn3C)c1 ZINC000071407687 525352274 /nfs/dbraw/zinc/35/22/74/525352274.db2.gz MZZOGAOMOMTCJH-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H]2CCCc3c2cnn3C)c1 ZINC000071407687 525352288 /nfs/dbraw/zinc/35/22/88/525352288.db2.gz MZZOGAOMOMTCJH-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN C[C@H](NCCOCC(F)F)c1ccc(N(C)C)cc1 ZINC000276246171 525357997 /nfs/dbraw/zinc/35/79/97/525357997.db2.gz OVIFPTVEERDYKC-NSHDSACASA-N 0 3 272.339 2.685 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CC=CCC2)c1 ZINC000280869352 525363587 /nfs/dbraw/zinc/36/35/87/525363587.db2.gz CSDDEOFNMSCVQO-AWEZNQCLSA-N 0 3 260.381 2.613 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CCO)C(C)C)c1 ZINC000230664135 525365046 /nfs/dbraw/zinc/36/50/46/525365046.db2.gz DWMVYDPZGUSVEL-GXTWGEPZSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CCN(C)C)c1 ZINC000049553875 525365830 /nfs/dbraw/zinc/36/58/30/525365830.db2.gz GKQBPAZUCDEVNY-STQMWFEESA-N 0 3 250.386 2.691 20 10 CFCDHN C[C@@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000183517667 525460063 /nfs/dbraw/zinc/46/00/63/525460063.db2.gz YEESKXJUEDLBCP-ADLMAVQZSA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000094617770 525479604 /nfs/dbraw/zinc/47/96/04/525479604.db2.gz HXMJDDXJKLUAGI-MNOVXSKESA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000094617610 525483702 /nfs/dbraw/zinc/48/37/02/525483702.db2.gz ABRPQGHDDUTMEP-NEPJUHHUSA-N 0 3 278.371 2.666 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2cc(C)ccc2[O-])c(C)o1 ZINC000266167096 525501189 /nfs/dbraw/zinc/50/11/89/525501189.db2.gz PXICBLALBWDLTH-KRWDZBQOSA-N 0 3 289.375 2.908 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2ccccc2[O-])c(C)o1 ZINC000266157182 525552061 /nfs/dbraw/zinc/55/20/61/525552061.db2.gz MMUYHHNIENTBEX-MRXNPFEDSA-N 0 3 275.348 2.599 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000094618179 525596267 /nfs/dbraw/zinc/59/62/67/525596267.db2.gz DFEPYPNVFOZGIB-WFASDCNBSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCOC[C@@H]1C)c1cc(F)ccc1[O-] ZINC000278456363 525621788 /nfs/dbraw/zinc/62/17/88/525621788.db2.gz ITQWNUBWRWGFSZ-KWBADKCTSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1cc(F)ccc1[O-] ZINC000289753915 525666577 /nfs/dbraw/zinc/66/65/77/525666577.db2.gz JILKAPUBDSBNHK-DOMZBBRYSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000094618180 525667443 /nfs/dbraw/zinc/66/74/43/525667443.db2.gz DFEPYPNVFOZGIB-DOMZBBRYSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOCC(F)F)c([O-])c1 ZINC000188743384 525725112 /nfs/dbraw/zinc/72/51/12/525725112.db2.gz HBUJEHLVMCMXTH-SNVBAGLBSA-N 0 3 259.296 2.633 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cccnc2)c([O-])c1 ZINC000037717937 525727431 /nfs/dbraw/zinc/72/74/31/525727431.db2.gz NPEVYUPUHQVTLZ-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)CC2CCC2)c([O-])c1 ZINC000280886060 525749175 /nfs/dbraw/zinc/74/91/75/525749175.db2.gz DSJYHARSQGNSCO-OCCSQVGLSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2cccc(C)c2[O-])cc1 ZINC000278680882 525781372 /nfs/dbraw/zinc/78/13/72/525781372.db2.gz MBVOSGWAWOQWDN-INIZCTEOSA-N 0 3 271.360 2.832 20 10 CFCDHN COc1cccc(CN2CCC(F)(F)[C@@H](C)C2)c1O ZINC000291707798 525932287 /nfs/dbraw/zinc/93/22/87/525932287.db2.gz ZPIXCCWXQLQPFS-JTQLQIEISA-N 0 3 271.307 2.878 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN3CCCC[C@@H]23)c([O-])c1 ZINC000217626326 525946065 /nfs/dbraw/zinc/94/60/65/525946065.db2.gz VOWNHQMHNHFUGO-BPUTZDHNSA-N 0 3 274.408 2.978 20 10 CFCDHN Cc1ccc(C(=O)NCC[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000193911636 526168423 /nfs/dbraw/zinc/16/84/23/526168423.db2.gz XQFQWBOZSXOUPH-AWEZNQCLSA-N 0 3 298.386 2.781 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@H](c3ccco3)C1)OCO2 ZINC000360942517 526336408 /nfs/dbraw/zinc/33/64/08/526336408.db2.gz WCEMBPZVINFWPK-NSHDSACASA-N 0 3 287.315 2.703 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@H](c3ccco3)C1)OCO2 ZINC000360942517 526336409 /nfs/dbraw/zinc/33/64/09/526336409.db2.gz WCEMBPZVINFWPK-NSHDSACASA-N 0 3 287.315 2.703 20 10 CFCDHN Oc1cc2c(cc1CN[C@@H]1CCOc3ccccc31)OCO2 ZINC000238137672 526336512 /nfs/dbraw/zinc/33/65/12/526336512.db2.gz ZFLCKXOOZHYCKJ-CYBMUJFWSA-N 0 3 299.326 2.734 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCOCC1 ZINC000052084579 526354228 /nfs/dbraw/zinc/35/42/28/526354228.db2.gz VETDSZQCRGQYAO-UHFFFAOYSA-N 0 3 257.333 2.768 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCOCC1 ZINC000052084579 526354234 /nfs/dbraw/zinc/35/42/34/526354234.db2.gz VETDSZQCRGQYAO-UHFFFAOYSA-N 0 3 257.333 2.768 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000290828445 526371482 /nfs/dbraw/zinc/37/14/82/526371482.db2.gz HIKWKMOFTDTTPQ-HZPDHXFCSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000290828445 526371488 /nfs/dbraw/zinc/37/14/88/526371488.db2.gz HIKWKMOFTDTTPQ-HZPDHXFCSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1COC2(CCCCCC2)O1 ZINC000181096361 526374845 /nfs/dbraw/zinc/37/48/45/526374845.db2.gz POKLPHNYGNIXBC-OAHLLOKOSA-N 0 3 291.391 2.948 20 10 CFCDHN Cc1nccn1CCC[NH2+]Cc1c([O-])cccc1Cl ZINC000264939905 527421257 /nfs/dbraw/zinc/42/12/57/527421257.db2.gz FVPXBAHPVOEHPS-UHFFFAOYSA-N 0 3 279.771 2.730 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC1(CO)CC2(CCC2)C1 ZINC000279415400 527524339 /nfs/dbraw/zinc/52/43/39/527524339.db2.gz OKYXHJLHORRXJF-UHFFFAOYSA-N 0 3 279.355 2.564 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC2(C)OCCCO2)c2c1c(F)ccc2[O-] ZINC000754123913 574075391 /nfs/dbraw/zinc/07/53/91/574075391.db2.gz RHXLAPSBQOJPNF-CMPLNLGQSA-N 0 3 295.354 2.822 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756369763 574097851 /nfs/dbraw/zinc/09/78/51/574097851.db2.gz CYGJAKJSNYJTNC-JQWIXIFHSA-N 0 3 275.327 2.566 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN(C)C(C)C)c([O-])c1C ZINC000756523146 574122088 /nfs/dbraw/zinc/12/20/88/574122088.db2.gz ARZOKGWVKPYWJT-CQSZACIVSA-N 0 3 264.413 3.000 20 10 CFCDHN CC[N@@H+](Cc1cc2c(cc1[O-])CCC2)C[C@@H]1CCOC1 ZINC000738081525 574156884 /nfs/dbraw/zinc/15/68/84/574156884.db2.gz LUVSKQDGMMLLQR-ZDUSSCGKSA-N 0 3 275.392 2.739 20 10 CFCDHN CC[N@H+](Cc1cc2c(cc1[O-])CCC2)C[C@@H]1CCOC1 ZINC000738081525 574156885 /nfs/dbraw/zinc/15/68/85/574156885.db2.gz LUVSKQDGMMLLQR-ZDUSSCGKSA-N 0 3 275.392 2.739 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C(C)(C)CCOC)c1 ZINC000747100225 574179578 /nfs/dbraw/zinc/17/95/78/574179578.db2.gz DUDQQKNQICZDAD-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2ccccc2[O-])CCCCC1 ZINC000756130670 574211783 /nfs/dbraw/zinc/21/17/83/574211783.db2.gz FCWBYUITVBEVPT-UHFFFAOYSA-N 0 3 277.364 2.748 20 10 CFCDHN [O-]c1ccc2ccncc2c1C[NH+]1CCN(C2CCC2)CC1 ZINC000733296326 574218849 /nfs/dbraw/zinc/21/88/49/574218849.db2.gz LEYFDPFFCCDOBX-UHFFFAOYSA-N 0 3 297.402 2.611 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCCN(C)C)c2c1c(F)ccc2[O-] ZINC000756342544 574227036 /nfs/dbraw/zinc/22/70/36/574227036.db2.gz KOXPZVASGJFXGB-JQWIXIFHSA-N 0 3 266.360 2.621 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCN2CCCC2)c2c1c(F)ccc2[O-] ZINC000756355514 574228890 /nfs/dbraw/zinc/22/88/90/574228890.db2.gz PLMVQGLYHLFRIR-DGCLKSJQSA-N 0 3 278.371 2.765 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2ccco2)c2c1c(F)ccc2[O-] ZINC000756386710 574232311 /nfs/dbraw/zinc/23/23/11/574232311.db2.gz YTKKRNCRGOIVQM-IRUJWGPZSA-N 0 3 291.322 2.996 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H](O)c2ccco2)c2c1c(F)ccc2[O-] ZINC000756386726 574232339 /nfs/dbraw/zinc/23/23/39/574232339.db2.gz YTKKRNCRGOIVQM-SUZMYJTESA-N 0 3 291.322 2.996 20 10 CFCDHN CCOc1cccc(C[NH2+][C@](C)(CC)CC(=O)OC)c1[O-] ZINC000748246892 574243334 /nfs/dbraw/zinc/24/33/34/574243334.db2.gz QXMNJINLVIYBSR-MRXNPFEDSA-N 0 3 295.379 2.612 20 10 CFCDHN COC(=O)N1CCC[C@H]([NH2+][C@H](C)c2cc(C)ccc2[O-])C1 ZINC000756528670 574243823 /nfs/dbraw/zinc/24/38/23/574243823.db2.gz OPGNVCHIFMKJDX-OLZOCXBDSA-N 0 3 292.379 2.582 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c1 ZINC000756548591 574245902 /nfs/dbraw/zinc/24/59/02/574245902.db2.gz AJZJZZGGBPQANH-GXTWGEPZSA-N 0 3 290.407 2.536 20 10 CFCDHN CN(C)Cc1cccc(NC(=O)NCc2ccccc2O)c1 ZINC000748325744 574247377 /nfs/dbraw/zinc/24/73/77/574247377.db2.gz VBZUPTDPBHRQMD-UHFFFAOYSA-N 0 3 299.374 2.776 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)C2CC2)c([O-])c1C ZINC000756576301 574249421 /nfs/dbraw/zinc/24/94/21/574249421.db2.gz MDFYSUSZEXCMOA-LRDDRELGSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)C(C)C)c([O-])c1C ZINC000756586410 574250497 /nfs/dbraw/zinc/25/04/97/574250497.db2.gz RNSYSRBTHXBLNL-JSGCOSHPSA-N 0 3 251.370 2.677 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)c2ccc(C)o2)c1 ZINC000756606011 574251703 /nfs/dbraw/zinc/25/17/03/574251703.db2.gz KOZLUDZQBUXRJU-ABAIWWIYSA-N 0 3 291.347 2.686 20 10 CFCDHN CC[C@@H](CCO)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756602822 574251721 /nfs/dbraw/zinc/25/17/21/574251721.db2.gz FPTCBKSVSHKZHC-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CCC[C@H]2C)c([O-])c1 ZINC000756616103 574252438 /nfs/dbraw/zinc/25/24/38/574252438.db2.gz IAPANBPVDJTSSR-ZIAGYGMSSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@@H]([NH2+]CC1(CO)CC1)c1cc2c(cc1[O-])CCCC2 ZINC000756639128 574254436 /nfs/dbraw/zinc/25/44/36/574254436.db2.gz YFWGISJXEJQTFK-GFCCVEGCSA-N 0 3 275.392 2.694 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2C=C[C@H](CO)C2)c2c1c(F)ccc2[O-] ZINC000756661217 574256172 /nfs/dbraw/zinc/25/61/72/574256172.db2.gz QEJZOQKMLNZIIY-MEWQQHAOSA-N 0 3 277.339 2.606 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756732001 574259508 /nfs/dbraw/zinc/25/95/08/574259508.db2.gz FIVBLNXVSJJLOY-JSGCOSHPSA-N 0 3 281.396 2.711 20 10 CFCDHN CNC(=O)[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756773860 574261864 /nfs/dbraw/zinc/26/18/64/574261864.db2.gz CUPCCMBRBXXXOR-NWANDNLSSA-N 0 3 290.407 2.574 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)C(C)(C)O)c([O-])c1C ZINC000756819124 574265055 /nfs/dbraw/zinc/26/50/55/574265055.db2.gz QLCLAUMTAAWHRP-NWDGAFQWSA-N 0 3 251.370 2.819 20 10 CFCDHN CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C(F)(F)F ZINC000756834294 574266106 /nfs/dbraw/zinc/26/61/06/574266106.db2.gz DTLMWUNPIFKFFY-HQJQHLMTSA-N 0 3 281.249 2.759 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCC(=O)Nc2ccccn2)cc1C ZINC000742369299 574325083 /nfs/dbraw/zinc/32/50/83/574325083.db2.gz SITKZSPAPOCRJD-UHFFFAOYSA-N 0 3 299.374 2.522 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccc(O)cc2)c([O-])c1 ZINC000725848497 574328857 /nfs/dbraw/zinc/32/88/57/574328857.db2.gz USMGSAFSCPEXBO-UHFFFAOYSA-N 0 3 287.359 2.829 20 10 CFCDHN Cc1ccsc1[C@@H](CO)NCc1ccc(N(C)C)cc1 ZINC000751991094 574386405 /nfs/dbraw/zinc/38/64/05/574386405.db2.gz MUGTYEQVIYTMGT-OAHLLOKOSA-N 0 3 290.432 2.946 20 10 CFCDHN C[C@@H](O)C[C@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811011 574395475 /nfs/dbraw/zinc/39/54/75/574395475.db2.gz KITHDHSXYNNHAT-MLGOLLRUSA-N 0 3 275.392 2.616 20 10 CFCDHN C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811011 574395476 /nfs/dbraw/zinc/39/54/76/574395476.db2.gz KITHDHSXYNNHAT-MLGOLLRUSA-N 0 3 275.392 2.616 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2C[C@@H](OC)C2(C)C)c1 ZINC000753374224 574401932 /nfs/dbraw/zinc/40/19/32/574401932.db2.gz QVFHWFGPFSLMEB-HUUCEWRRSA-N 0 3 279.380 2.694 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)C(OC)OC)cc1 ZINC000079607607 617999377 /nfs/dbraw/zinc/99/93/77/617999377.db2.gz SDXRUNTXMQLGIZ-ZDUSSCGKSA-N 0 3 280.412 2.630 20 10 CFCDHN CCOc1cccc(CNCc2cccc(C)n2)c1O ZINC000051574095 618021191 /nfs/dbraw/zinc/02/11/91/618021191.db2.gz SSHVDCLGSUWHAY-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN COc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)c([O-])c1OC ZINC000891449186 618213889 /nfs/dbraw/zinc/21/38/89/618213889.db2.gz NUFXXLVVPHQMQU-RYUDHWBXSA-N 0 3 279.380 2.887 20 10 CFCDHN Cc1cc(F)ncc1CNCc1ccc(N(C)C)cc1 ZINC000892476731 618338117 /nfs/dbraw/zinc/33/81/17/618338117.db2.gz WBIPWAZWJKIWRS-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000840879712 618364645 /nfs/dbraw/zinc/36/46/45/618364645.db2.gz HFASSFMIMYTRDU-TZMCWYRMSA-N 0 3 289.350 2.958 20 10 CFCDHN COc1cc(C)cc(CN[C@@H](C)c2ccccn2)c1O ZINC000894146441 618396691 /nfs/dbraw/zinc/39/66/91/618396691.db2.gz RBGNLDPIEZDFIN-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnn(C3CCC3)c2)c([O-])c1 ZINC000894186414 618433466 /nfs/dbraw/zinc/43/34/66/618433466.db2.gz WLLUHXMFPLXVFU-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN COc1cc(C)cc(CNCc2ccc(C)o2)c1O ZINC000895446536 618590651 /nfs/dbraw/zinc/59/06/51/618590651.db2.gz CEBBJSFUTVQDRE-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN CO[C@H](CN[C@H](C)c1ccc(N(C)C)cc1)C(F)(F)F ZINC000777009013 618940586 /nfs/dbraw/zinc/94/05/86/618940586.db2.gz HMKLMHFTHBCAIP-ZWNOBZJWSA-N 0 3 290.329 2.981 20 10 CFCDHN C[C@H](NCc1cc(N)ccn1)c1ccc(N(C)C)cc1 ZINC000925770391 619082834 /nfs/dbraw/zinc/08/28/34/619082834.db2.gz HGODJTWYNLHLDN-LBPRGKRZSA-N 0 3 270.380 2.581 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000060358322 619157225 /nfs/dbraw/zinc/15/72/25/619157225.db2.gz QFVLSUPEIWYJJC-OAHLLOKOSA-N 0 3 277.751 2.869 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)CC1([NH+](C)C)CCC1 ZINC000097934152 619193602 /nfs/dbraw/zinc/19/36/02/619193602.db2.gz BOELVTGHKJPPCT-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN Cc1ccnc(N)c1CNCc1ccc(N(C)C)cc1C ZINC000894255855 619286996 /nfs/dbraw/zinc/28/69/96/619286996.db2.gz KIWPQTGEJLIKSM-UHFFFAOYSA-N 0 3 284.407 2.636 20 10 CFCDHN COc1cccc(CNCc2cnc3onc(C)c3c2)c1O ZINC000894767322 619462743 /nfs/dbraw/zinc/46/27/43/619462743.db2.gz ZXBFVPHTIGIDOE-UHFFFAOYSA-N 0 3 299.330 2.535 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)cc1[O-])[C@@H]1CCCOC1 ZINC000895662296 619578642 /nfs/dbraw/zinc/57/86/42/619578642.db2.gz DIFDWGTYAUQVDI-CABCVRRESA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)Cc2ccc(F)cc2)c([O-])c1 ZINC000895753709 619599721 /nfs/dbraw/zinc/59/97/21/619599721.db2.gz UHGMBIAJXIWVDP-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H]2CC(C)(C)CO2)c([O-])c1 ZINC000895802012 619611311 /nfs/dbraw/zinc/61/13/11/619611311.db2.gz DHKBDHHREZUHFM-AWEZNQCLSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@@]3(CO[C@H](C)C3)O2)c([O-])c1 ZINC000895817200 619614194 /nfs/dbraw/zinc/61/41/94/619614194.db2.gz HAJZANDGEJGBPV-UKPHBRMFSA-N 0 3 291.391 2.517 20 10 CFCDHN CCc1nc(CNCCc2ccc(N)cc2)cs1 ZINC000262259564 619691832 /nfs/dbraw/zinc/69/18/32/619691832.db2.gz QYQUNPFXRPGDEP-UHFFFAOYSA-N 0 3 261.394 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(c2ccccc2)C[C@@H](O)C1 ZINC000896452904 619737633 /nfs/dbraw/zinc/73/76/33/619737633.db2.gz UVHGPBZVUZNCGT-RUCARUNLSA-N 0 3 297.398 2.883 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2nc3c(s2)CCC3)c([O-])c1 ZINC000896842402 619839687 /nfs/dbraw/zinc/83/96/87/619839687.db2.gz RUFOQEPPBOHTAM-UHFFFAOYSA-N 0 3 288.416 2.978 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(CO)(C(F)(F)F)CC1 ZINC000897033165 619915339 /nfs/dbraw/zinc/91/53/39/619915339.db2.gz CXRSVPUVVGXHNS-UHFFFAOYSA-N 0 3 289.297 2.529 20 10 CFCDHN COC[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])C(C)C ZINC000897220994 619952873 /nfs/dbraw/zinc/95/28/73/619952873.db2.gz FSJLITIFRSIXRR-CQSZACIVSA-N 0 3 251.370 2.709 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC(C)(C)C1CCOCC1 ZINC000897451462 620174061 /nfs/dbraw/zinc/17/40/61/620174061.db2.gz NDDZYYCHUBKKDW-UHFFFAOYSA-N 0 3 293.407 2.943 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CCO)C2CCCC2)c([O-])c1 ZINC000897884984 620297819 /nfs/dbraw/zinc/29/78/19/620297819.db2.gz BNRIAYWDHREYDF-INIZCTEOSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1cc(O)c(CN[C@H](C)c2cncs2)cc1OC ZINC000897932562 620302597 /nfs/dbraw/zinc/30/25/97/620302597.db2.gz NDSJGQIRMLAMGP-SECBINFHSA-N 0 3 294.376 2.717 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccc2nonc2c1 ZINC000897991339 620319648 /nfs/dbraw/zinc/31/96/48/620319648.db2.gz NMZKGIVGSZQWFU-UHFFFAOYSA-N 0 3 296.374 2.887 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCOC23CCCC3)c([O-])c1 ZINC000898113280 620335871 /nfs/dbraw/zinc/33/58/71/620335871.db2.gz WOBLXKFDQMNVJA-MRXNPFEDSA-N 0 3 291.391 2.982 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCOC12CCOCC2)c1ccccc1[O-] ZINC000898116645 620336734 /nfs/dbraw/zinc/33/67/34/620336734.db2.gz TZFGAQDNGYLZPM-ZBFHGGJFSA-N 0 3 291.391 2.771 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@@H](Cc2ccccc2)[C@H](O)C1 ZINC000898141713 620339134 /nfs/dbraw/zinc/33/91/34/620339134.db2.gz ABAQCHFLIBLNSN-VQIMIIECSA-N 0 3 297.398 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@@H](Cc2ccccc2)[C@H](O)C1 ZINC000898141713 620339137 /nfs/dbraw/zinc/33/91/37/620339137.db2.gz ABAQCHFLIBLNSN-VQIMIIECSA-N 0 3 297.398 2.736 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3CSC[C@]3(C)C2)c([O-])c1 ZINC000898422931 620462537 /nfs/dbraw/zinc/46/25/37/620462537.db2.gz OICASBDVEGZCMX-CJNGLKHVSA-N 0 3 293.432 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3CSC[C@]3(C)C2)c([O-])c1 ZINC000898422931 620462538 /nfs/dbraw/zinc/46/25/38/620462538.db2.gz OICASBDVEGZCMX-CJNGLKHVSA-N 0 3 293.432 2.976 20 10 CFCDHN Fc1cc(CNC/C=C\Cl)ccc1N1CCOCC1 ZINC000898435304 620463976 /nfs/dbraw/zinc/46/39/76/620463976.db2.gz GQLHQJWPMBUZTR-RJRFIUFISA-N 0 3 284.762 2.504 20 10 CFCDHN C[C@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902470644 621100922 /nfs/dbraw/zinc/10/09/22/621100922.db2.gz ZECQONUXBCDLNK-LOHPEHISSA-N 0 3 266.772 2.589 20 10 CFCDHN C[C@@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902470645 621101403 /nfs/dbraw/zinc/10/14/03/621101403.db2.gz ZECQONUXBCDLNK-MWKLQFHZSA-N 0 3 266.772 2.589 20 10 CFCDHN C[C@@H]([NH2+]CC1(C2(O)CCC2)CC1)c1ccccc1[O-] ZINC000903258219 621301626 /nfs/dbraw/zinc/30/16/26/621301626.db2.gz SJDCCLFKHFBYJS-GFCCVEGCSA-N 0 3 261.365 2.738 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc3nonc3c1)CC2 ZINC000903329203 621340698 /nfs/dbraw/zinc/34/06/98/621340698.db2.gz QDUULPDNBZBKMI-ZDUSSCGKSA-N 0 3 281.315 2.706 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000903451963 621386924 /nfs/dbraw/zinc/38/69/24/621386924.db2.gz YPDSPPCINJOVCS-UPJWGTAASA-N 0 3 277.364 2.775 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccsc1)c1ccccc1[O-] ZINC000183523806 625513757 /nfs/dbraw/zinc/51/37/57/625513757.db2.gz FJHRDAFHYMLSOF-HZMBPMFUSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1ccccc1[O-] ZINC000183615276 625521104 /nfs/dbraw/zinc/52/11/04/625521104.db2.gz UJVGNIAUWGMMDR-MPBGBICISA-N 0 3 289.400 2.980 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC2(C)OCCO2)c([O-])c1 ZINC000183889675 625555098 /nfs/dbraw/zinc/55/50/98/625555098.db2.gz BUAXSTFNHJDWOZ-LBPRGKRZSA-N 0 3 265.353 2.504 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCN1CCOC)c1ccccc1[O-] ZINC000155604718 622307257 /nfs/dbraw/zinc/30/72/57/622307257.db2.gz OBBHRMKQARYHDN-HOCLYGCPSA-N 0 3 292.423 2.544 20 10 CFCDHN [NH3+]CC1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000044511713 622917025 /nfs/dbraw/zinc/91/70/25/622917025.db2.gz VQDHGKIHLUPARN-UHFFFAOYSA-N 0 3 289.206 2.870 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000156685453 622954325 /nfs/dbraw/zinc/95/43/25/622954325.db2.gz BYQVBPUXVAHOTN-JSGCOSHPSA-N 0 3 290.407 2.832 20 10 CFCDHN CCCC[C@H](COC)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877049907 623023288 /nfs/dbraw/zinc/02/32/88/623023288.db2.gz IOPZYZNDSDIUOB-CQSZACIVSA-N 0 3 251.370 2.995 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000062748331 623296242 /nfs/dbraw/zinc/29/62/42/623296242.db2.gz GUVPYCYVGAKTHA-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@@H]2CCOC2)c1[O-] ZINC000230935821 623312639 /nfs/dbraw/zinc/31/26/39/623312639.db2.gz LBLWKZITTGCCJA-SNVBAGLBSA-N 0 3 285.771 2.570 20 10 CFCDHN C[C@H]([NH3+])[C@@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000063191320 623329833 /nfs/dbraw/zinc/32/98/33/623329833.db2.gz VIGBSIBIUVWHCP-GWCFXTLKSA-N 0 3 268.788 2.747 20 10 CFCDHN Fc1cnccc1CNCCCSc1nccs1 ZINC000823938298 623421817 /nfs/dbraw/zinc/42/18/17/623421817.db2.gz WTNONUAWIYAUNC-UHFFFAOYSA-N 0 3 283.397 2.949 20 10 CFCDHN CC(C)N1CCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O ZINC000823987166 623429957 /nfs/dbraw/zinc/42/99/57/623429957.db2.gz QRDKJBTXOLHMKS-CYBMUJFWSA-N 0 3 296.798 2.535 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCC[C@H](O)C1)CC2 ZINC000311948732 623485622 /nfs/dbraw/zinc/48/56/22/623485622.db2.gz XKVGIYQJCPHAAR-KWCYVHTRSA-N 0 3 261.365 2.520 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H](CO)C2)c1[O-] ZINC000312448492 623519231 /nfs/dbraw/zinc/51/92/31/623519231.db2.gz OCFNUMHJUYHRME-MFKMUULPSA-N 0 3 299.798 2.695 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1ccc(OCC)cc1[O-])OC ZINC000824543616 623520881 /nfs/dbraw/zinc/52/08/81/623520881.db2.gz MEGIAVIBWDQAAT-AWEZNQCLSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1c([O-])cccc1OC)OC ZINC000824597704 623529805 /nfs/dbraw/zinc/52/98/05/623529805.db2.gz WVMZFLARQDFPMU-XHDPSFHLSA-N 0 3 267.369 2.552 20 10 CFCDHN Cc1cc(CNCc2ccc(N(C)C)c(F)c2)ccn1 ZINC000824596817 623530127 /nfs/dbraw/zinc/53/01/27/623530127.db2.gz LZQXBOOGXPRHJQ-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CC[C@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637705 623537962 /nfs/dbraw/zinc/53/79/62/623537962.db2.gz ZGWYEVADXONRMC-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637705 623537967 /nfs/dbraw/zinc/53/79/67/623537967.db2.gz ZGWYEVADXONRMC-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@](O)(C(F)F)C2)cc1 ZINC000824726382 623552708 /nfs/dbraw/zinc/55/27/08/623552708.db2.gz LAEZTEHMSGKASO-MRXNPFEDSA-N 0 3 298.377 2.735 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@](O)(C(F)F)C1 ZINC000824726832 623553640 /nfs/dbraw/zinc/55/36/40/623553640.db2.gz WKSNTIDZBREMTO-MRXNPFEDSA-N 0 3 293.313 2.747 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@](O)(C(F)F)C1 ZINC000824726832 623553645 /nfs/dbraw/zinc/55/36/45/623553645.db2.gz WKSNTIDZBREMTO-MRXNPFEDSA-N 0 3 293.313 2.747 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](OC)[C@H](C)C2)c([O-])c1 ZINC000824814867 623571151 /nfs/dbraw/zinc/57/11/51/623571151.db2.gz GBCYMQIBSSYPPN-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](OC)[C@H](C)C2)c([O-])c1 ZINC000824814867 623571156 /nfs/dbraw/zinc/57/11/56/623571156.db2.gz GBCYMQIBSSYPPN-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC)[C@@H](C)C2)c([O-])c1 ZINC000824814865 623571482 /nfs/dbraw/zinc/57/14/82/623571482.db2.gz GBCYMQIBSSYPPN-LRDDRELGSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC)[C@@H](C)C2)c([O-])c1 ZINC000824814865 623571483 /nfs/dbraw/zinc/57/14/83/623571483.db2.gz GBCYMQIBSSYPPN-LRDDRELGSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1[O-] ZINC000824861761 623580244 /nfs/dbraw/zinc/58/02/44/623580244.db2.gz PTORSBNAAPJFAQ-KGLIPLIRSA-N 0 3 277.364 2.604 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2cnccc2C)c([O-])c1 ZINC000824910401 623586070 /nfs/dbraw/zinc/58/60/70/623586070.db2.gz VTOLGMXBAHFWQW-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccnc1N(C)C)c1cc(F)ccc1[O-] ZINC000185015895 625675454 /nfs/dbraw/zinc/67/54/54/625675454.db2.gz ZHSGHFRIBCDAQP-LLVKDONJSA-N 0 3 289.354 2.843 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H](O)C23CCC3)c1[O-] ZINC000827365059 623993794 /nfs/dbraw/zinc/99/37/94/623993794.db2.gz JIZMUEJABXHQEF-CHWSQXEVSA-N 0 3 281.783 2.747 20 10 CFCDHN CCN(CC)c1ccc(CN(CCO)C2CC2)cc1F ZINC000153604101 624041810 /nfs/dbraw/zinc/04/18/10/624041810.db2.gz APWGDURLLGISBT-UHFFFAOYSA-N 0 3 280.387 2.629 20 10 CFCDHN C[C@H](O)[C@H]([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000827855360 624111944 /nfs/dbraw/zinc/11/19/44/624111944.db2.gz BJHMQKXRQSXUET-ZBEGNZNMSA-N 0 3 275.323 2.743 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCN1Cc3ccccc3C1)CC2 ZINC000834540718 625706600 /nfs/dbraw/zinc/70/66/00/625706600.db2.gz GSDLCLOEUKNCKC-QGZVFWFLSA-N 0 3 294.398 2.985 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000929977464 624340853 /nfs/dbraw/zinc/34/08/53/624340853.db2.gz UVSMBHDELREMHO-AAEUAGOBSA-N 0 3 289.297 2.934 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000929977464 624340857 /nfs/dbraw/zinc/34/08/57/624340857.db2.gz UVSMBHDELREMHO-AAEUAGOBSA-N 0 3 289.297 2.934 20 10 CFCDHN Cc1cccc(CN2CCOC[C@@H]2CC(C)C)c1O ZINC000180202201 625003743 /nfs/dbraw/zinc/00/37/43/625003743.db2.gz IWWSQAVPKUIBEQ-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834581855 625724935 /nfs/dbraw/zinc/72/49/35/625724935.db2.gz NXCSOXBKJONUIR-NORZTCDRSA-N 0 3 263.381 2.766 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834612837 625735009 /nfs/dbraw/zinc/73/50/09/625735009.db2.gz VKVODWPIXSNJOP-BNOWGMLFSA-N 0 3 263.381 2.766 20 10 CFCDHN COc1ccccc1[C@H](CO)N[C@H]1CCc2cccc(O)c21 ZINC000834654533 625759446 /nfs/dbraw/zinc/75/94/46/625759446.db2.gz OTXRXTXTHCHQIG-GJZGRUSLSA-N 0 3 299.370 2.711 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@@H]1CCCO1 ZINC000834694503 625787537 /nfs/dbraw/zinc/78/75/37/625787537.db2.gz VULQBVUWTORQGL-YDHLFZDLSA-N 0 3 261.365 2.927 20 10 CFCDHN Cc1ccc(C[NH2+]CCOc2ccccc2)c([O-])c1 ZINC000083422133 625845962 /nfs/dbraw/zinc/84/59/62/625845962.db2.gz KEMCREBVWWEYQK-UHFFFAOYSA-N 0 3 257.333 2.869 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834778807 625852888 /nfs/dbraw/zinc/85/28/88/625852888.db2.gz GLDOHGWVSIEKRN-DLBZAZTESA-N 0 3 297.398 2.881 20 10 CFCDHN CC1([NH+]2CCC2)CCC(NC(=O)c2cc([O-])cs2)CC1 ZINC000834780658 625854022 /nfs/dbraw/zinc/85/40/22/625854022.db2.gz SLHVQUSJHHGRNS-UHFFFAOYSA-N 0 3 294.420 2.591 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CCO)Cc1ccccc1)CC2 ZINC000834794013 625863333 /nfs/dbraw/zinc/86/33/33/625863333.db2.gz MAOSCUODHXDISA-SJORKVTESA-N 0 3 297.398 2.963 20 10 CFCDHN C[C@@H]1COCC[C@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834798897 625866373 /nfs/dbraw/zinc/86/63/73/625866373.db2.gz RCCVGLMDMCXYNV-KWCYVHTRSA-N 0 3 261.365 2.642 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000834879640 625907426 /nfs/dbraw/zinc/90/74/26/625907426.db2.gz ZZODYIJGOLAOBZ-HOSYDEDBSA-N 0 3 265.328 2.848 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)[C@H](C)O ZINC000834886620 625909734 /nfs/dbraw/zinc/90/97/34/625909734.db2.gz DYFUFYNSZWKIFO-LLHIFLOGSA-N 0 3 267.344 2.829 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1[O-])[C@H](C)O ZINC000834888480 625910602 /nfs/dbraw/zinc/91/06/02/625910602.db2.gz PPJLUSIWYWZFDN-YUTCNCBUSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2cnn(C)c2)c([O-])c1 ZINC000834896845 625913571 /nfs/dbraw/zinc/91/35/71/625913571.db2.gz OJRNGFPMVGPIEJ-OLZOCXBDSA-N 0 3 273.380 2.716 20 10 CFCDHN CNC(=O)C[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834900179 625915184 /nfs/dbraw/zinc/91/51/84/625915184.db2.gz NCHRCEULVYOVAU-NXEZZACHSA-N 0 3 284.787 2.529 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCCC1(C)C)c1ccccc1[O-] ZINC000834911535 625919854 /nfs/dbraw/zinc/91/98/54/625919854.db2.gz UKJWGIVGFRSBAL-CYBMUJFWSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1ncccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000834909642 625920255 /nfs/dbraw/zinc/92/02/55/625920255.db2.gz CDYLQXLKMIRZCQ-AAEUAGOBSA-N 0 3 299.374 2.773 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)C1CCC(OC)CC1 ZINC000769424871 625923585 /nfs/dbraw/zinc/92/35/85/625923585.db2.gz IXPQWSINLVEQNJ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)C1CCC(OC)CC1 ZINC000769424871 625923588 /nfs/dbraw/zinc/92/35/88/625923588.db2.gz IXPQWSINLVEQNJ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cnn(CC2CCC2)c1 ZINC000921652029 626047505 /nfs/dbraw/zinc/04/75/05/626047505.db2.gz OODWDALCGPPQOI-UHFFFAOYSA-N 0 3 271.364 2.679 20 10 CFCDHN Cc1cc(CO)cc(C)c1C[NH2+]Cc1ccccc1[O-] ZINC000922559659 626308255 /nfs/dbraw/zinc/30/82/55/626308255.db2.gz DRFGMNLIBYQMIS-UHFFFAOYSA-N 0 3 271.360 2.791 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000922677909 626339880 /nfs/dbraw/zinc/33/98/80/626339880.db2.gz IEBBTPKFROOMDV-DGCLKSJQSA-N 0 3 289.297 2.982 20 10 CFCDHN COc1cccc(CN[C@H]2CCCc3cccnc32)c1O ZINC000922881444 626386861 /nfs/dbraw/zinc/38/68/61/626386861.db2.gz PPFCFLYZWJTDPU-AWEZNQCLSA-N 0 3 284.359 2.963 20 10 CFCDHN COc1cccc(CNCc2cccc3c2OCC3)c1O ZINC000922944537 626429626 /nfs/dbraw/zinc/42/96/26/626429626.db2.gz OGSSYMXKVHUOLX-UHFFFAOYSA-N 0 3 285.343 2.626 20 10 CFCDHN COc1cccc(O)c1CN[C@H]1CN(C)Cc2ccccc21 ZINC000756995762 626543200 /nfs/dbraw/zinc/54/32/00/626543200.db2.gz PITWRBZTXRMMQK-INIZCTEOSA-N 0 3 298.386 2.677 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000757867812 626566139 /nfs/dbraw/zinc/56/61/39/626566139.db2.gz WFSSVNKTDRIAKK-ZFWWWQNUSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000757867812 626566141 /nfs/dbraw/zinc/56/61/41/626566141.db2.gz WFSSVNKTDRIAKK-ZFWWWQNUSA-N 0 3 293.407 2.630 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1(C)C ZINC000758998487 626623408 /nfs/dbraw/zinc/62/34/08/626623408.db2.gz CKNRTZUMLAMLBJ-NHYWBVRUSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1(C)C ZINC000758998487 626623410 /nfs/dbraw/zinc/62/34/10/626623410.db2.gz CKNRTZUMLAMLBJ-NHYWBVRUSA-N 0 3 291.391 2.686 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CCO)C2CCOCC2)c([O-])c1 ZINC000763559051 626997860 /nfs/dbraw/zinc/99/78/60/626997860.db2.gz QJCIKRMXKFNCCD-CZUORRHYSA-N 0 3 293.407 2.529 20 10 CFCDHN CCOc1ccc(C[N@H+](C[C@H]2CCOC2)C2CC2)c([O-])c1 ZINC000768258811 627328956 /nfs/dbraw/zinc/32/89/56/627328956.db2.gz XHWBMYPNOCWSBC-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c([O-])c1 ZINC000768258811 627328962 /nfs/dbraw/zinc/32/89/62/627328962.db2.gz XHWBMYPNOCWSBC-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768463616 627345289 /nfs/dbraw/zinc/34/52/89/627345289.db2.gz KKUJATQHRAEDPS-WBMJQRKESA-N 0 3 291.391 2.830 20 10 CFCDHN CCC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768463616 627345293 /nfs/dbraw/zinc/34/52/93/627345293.db2.gz KKUJATQHRAEDPS-WBMJQRKESA-N 0 3 291.391 2.830 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@H]2CCOC2)c1[O-] ZINC000768521747 627349328 /nfs/dbraw/zinc/34/93/28/627349328.db2.gz UUDDPAGWJWDJJI-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@H]2CCOC2)c1[O-] ZINC000768521747 627349330 /nfs/dbraw/zinc/34/93/30/627349330.db2.gz UUDDPAGWJWDJJI-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccc(O)c(CN2CCc3ccc(O)cc3C2)c1 ZINC000768867920 627381196 /nfs/dbraw/zinc/38/11/96/627381196.db2.gz LKQJWIYQNBOFNC-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000769325918 627424436 /nfs/dbraw/zinc/42/44/36/627424436.db2.gz DFHJMRZFNDDQPG-GFCCVEGCSA-N 0 3 280.799 2.714 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000769325918 627424439 /nfs/dbraw/zinc/42/44/39/627424439.db2.gz DFHJMRZFNDDQPG-GFCCVEGCSA-N 0 3 280.799 2.714 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCC(=O)OC(C)(C)C ZINC000769499250 627448154 /nfs/dbraw/zinc/44/81/54/627448154.db2.gz QBSSQSPEBZOIJU-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000769499250 627448155 /nfs/dbraw/zinc/44/81/55/627448155.db2.gz QBSSQSPEBZOIJU-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1cccc(O)c1CN(C)CCC(=O)OC(C)(C)C ZINC000769499250 627448157 /nfs/dbraw/zinc/44/81/57/627448157.db2.gz QBSSQSPEBZOIJU-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CC[N@H+](CCc1nccs1)Cc1c([O-])cccc1OC ZINC000769516474 627450546 /nfs/dbraw/zinc/45/05/46/627450546.db2.gz KNPIJTSPHZGYNC-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CC[N@@H+](CCc1nccs1)Cc1c([O-])cccc1OC ZINC000769516474 627450548 /nfs/dbraw/zinc/45/05/48/627450548.db2.gz KNPIJTSPHZGYNC-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1ccc(O)c(CN[C@@H](CO)c2ccsc2)c1 ZINC000769935489 627488715 /nfs/dbraw/zinc/48/87/15/627488715.db2.gz UDFXPUXOPNTTTN-AWEZNQCLSA-N 0 3 293.388 2.676 20 10 CFCDHN Cc1cc(O)c(CN[C@H](CO)c2ccsc2)cc1C ZINC000769936851 627489761 /nfs/dbraw/zinc/48/97/61/627489761.db2.gz YXZIIYPNEHTNNI-CQSZACIVSA-N 0 3 277.389 2.894 20 10 CFCDHN C[C@@H](N[C@H](CO)c1ccsc1)c1ccccc1O ZINC000769987945 627494754 /nfs/dbraw/zinc/49/47/54/627494754.db2.gz WKFOJYIKXPKUQH-ZWNOBZJWSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1ccsc1)c1ccccc1[O-] ZINC000769987945 627494756 /nfs/dbraw/zinc/49/47/56/627494756.db2.gz WKFOJYIKXPKUQH-ZWNOBZJWSA-N 0 3 263.362 2.838 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(N(CC)CC)c(F)c2)C[C@H]1O ZINC000770384330 627517083 /nfs/dbraw/zinc/51/70/83/627517083.db2.gz XLWIACMUXHVHLN-WMLDXEAASA-N 0 3 294.414 2.875 20 10 CFCDHN CCOC(=O)C1(C[NH2+]Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000770666391 627539007 /nfs/dbraw/zinc/53/90/07/627539007.db2.gz ZXASPUGYNFSRBV-UHFFFAOYSA-N 0 3 297.782 2.787 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC000771894341 627644848 /nfs/dbraw/zinc/64/48/48/627644848.db2.gz WJTQGQYRIPNJFC-WBMJQRKESA-N 0 3 279.380 2.694 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccnn1C)c1ccc(N(C)C)cc1 ZINC000774362268 627918723 /nfs/dbraw/zinc/91/87/23/627918723.db2.gz JIDMFAYUBXJKJK-OLZOCXBDSA-N 0 3 272.396 2.898 20 10 CFCDHN C[C@H](NCc1cn2ccccc2n1)c1ccccc1O ZINC000775131878 627995633 /nfs/dbraw/zinc/99/56/33/627995633.db2.gz YFKLJKGHGDNVEQ-LBPRGKRZSA-N 0 3 267.332 2.891 20 10 CFCDHN C[C@H](NC/C=C\Cl)c1ccc(N2CCOCC2)cc1 ZINC000775261487 628004325 /nfs/dbraw/zinc/00/43/25/628004325.db2.gz VLQQJFXIPKKPIX-MDVHNNDNSA-N 0 3 280.799 2.926 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCCN(C(=O)OC)C1)c1ccccc1[O-] ZINC000775499812 628032251 /nfs/dbraw/zinc/03/22/51/628032251.db2.gz FDBRICPBQCKEFU-GXTWGEPZSA-N 0 3 292.379 2.664 20 10 CFCDHN CC[C@@H]([NH2+]CCCN1CCCCC1=O)c1ccccc1[O-] ZINC000775501702 628032256 /nfs/dbraw/zinc/03/22/56/628032256.db2.gz KJKILSZFAUNJDT-OAHLLOKOSA-N 0 3 290.407 2.836 20 10 CFCDHN CC[C@H](NCc1cc(C)ncn1)c1ccccc1O ZINC000775524616 628033928 /nfs/dbraw/zinc/03/39/28/628033928.db2.gz UANTYFPGHHBMBM-AWEZNQCLSA-N 0 3 257.337 2.732 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)ncn1)c1ccccc1[O-] ZINC000775524616 628033930 /nfs/dbraw/zinc/03/39/30/628033930.db2.gz UANTYFPGHHBMBM-AWEZNQCLSA-N 0 3 257.337 2.732 20 10 CFCDHN COc1ccc(O)c(CN(C)Cc2cccc(O)c2)c1 ZINC000775634721 628048458 /nfs/dbraw/zinc/04/84/58/628048458.db2.gz VPKKIAKTGBLWRA-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCN(CC3CC3)CC2)c1O ZINC000775653846 628050275 /nfs/dbraw/zinc/05/02/75/628050275.db2.gz DEBBLVOSAFCDMS-UHFFFAOYSA-N 0 3 294.826 2.882 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCOC[C@H]2C)c1[O-] ZINC000775704320 628057183 /nfs/dbraw/zinc/05/71/83/628057183.db2.gz APRJNNKILRBEIW-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCOC[C@H]2C)c1[O-] ZINC000775704320 628057188 /nfs/dbraw/zinc/05/71/88/628057188.db2.gz APRJNNKILRBEIW-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCCOC[C@H]2C)c1O ZINC000775704320 628057191 /nfs/dbraw/zinc/05/71/91/628057191.db2.gz APRJNNKILRBEIW-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)CC(F)(F)F)c1[O-] ZINC000776252885 628123050 /nfs/dbraw/zinc/12/30/50/628123050.db2.gz GDAUKNQQARKYBQ-SNVBAGLBSA-N 0 3 297.704 2.757 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@@H](C)[C@H](OC)C2(C)C)c([O-])c1 ZINC000776497668 628154250 /nfs/dbraw/zinc/15/42/50/628154250.db2.gz DVRLRKAIRMRHBE-LYRGGWFBSA-N 0 3 293.407 2.940 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000779084394 628350839 /nfs/dbraw/zinc/35/08/39/628350839.db2.gz VFLMTYAUSGJZHW-SYEHKZFSSA-N 0 3 279.355 2.973 20 10 CFCDHN CCN(CC)c1ccc(CNC2CSC2)cc1F ZINC000780875920 628501500 /nfs/dbraw/zinc/50/15/00/628501500.db2.gz BIXIEUQLHLBUGO-UHFFFAOYSA-N 0 3 268.401 2.877 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(CC(F)F)CC1)c1ccccc1[O-] ZINC000783509520 628714417 /nfs/dbraw/zinc/71/44/17/628714417.db2.gz SZYACERWXAXRLT-LLVKDONJSA-N 0 3 284.350 2.772 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1cccc(F)c1)c1ccccc1[O-] ZINC000783522201 628716442 /nfs/dbraw/zinc/71/64/42/628716442.db2.gz MLIFUAOXONTMDY-NHYWBVRUSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@H](N[C@@H](CO)c1cccc(F)c1)c1ccccc1O ZINC000783522201 628716446 /nfs/dbraw/zinc/71/64/46/628716446.db2.gz MLIFUAOXONTMDY-NHYWBVRUSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@@H](C)[C@@H](C)O1 ZINC000783546826 628719742 /nfs/dbraw/zinc/71/97/42/628719742.db2.gz UFXZCNXGMDFKQV-FRRDWIJNSA-N 0 3 275.392 2.879 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1C[C@@H]2C[C@]2(CO)C1 ZINC000783744082 628741274 /nfs/dbraw/zinc/74/12/74/628741274.db2.gz SJXQEIDDVUXYLL-PKOBYXMFSA-N 0 3 295.382 2.873 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@@H]2C[C@]2(CO)C1 ZINC000783744082 628741277 /nfs/dbraw/zinc/74/12/77/628741277.db2.gz SJXQEIDDVUXYLL-PKOBYXMFSA-N 0 3 295.382 2.873 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000784036310 628767540 /nfs/dbraw/zinc/76/75/40/628767540.db2.gz SSVORPOUPAYVTB-WFASDCNBSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000784036310 628767543 /nfs/dbraw/zinc/76/75/43/628767543.db2.gz SSVORPOUPAYVTB-WFASDCNBSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000785989173 628928716 /nfs/dbraw/zinc/92/87/16/628928716.db2.gz TWOPEZIBYVXJHK-JTNHKYCSSA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000785989173 628928718 /nfs/dbraw/zinc/92/87/18/628928718.db2.gz TWOPEZIBYVXJHK-JTNHKYCSSA-N 0 3 267.344 2.513 20 10 CFCDHN CO[C@@H](CC[NH2+]Cc1cc(F)ccc1[O-])C(F)(F)F ZINC000787418333 629012112 /nfs/dbraw/zinc/01/21/12/629012112.db2.gz SCPNDACVKSJBKB-NSHDSACASA-N 0 3 281.249 2.588 20 10 CFCDHN CO[C@H](CC[NH2+]Cc1cc(F)ccc1[O-])C(F)(F)F ZINC000787418331 629012288 /nfs/dbraw/zinc/01/22/88/629012288.db2.gz SCPNDACVKSJBKB-LLVKDONJSA-N 0 3 281.249 2.588 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cccn(CC)c1=O)c1ccccc1[O-] ZINC000788605236 629085884 /nfs/dbraw/zinc/08/58/84/629085884.db2.gz NWEVTFOHVQGXEC-OAHLLOKOSA-N 0 3 286.375 2.815 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CC[C@@H](O)C2)c([O-])c1 ZINC000788775641 629099229 /nfs/dbraw/zinc/09/92/29/629099229.db2.gz IWZJVOOPSJBLCJ-MELADBBJSA-N 0 3 263.381 2.821 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2c([O-])cccc2OC)C1 ZINC000788970949 629112408 /nfs/dbraw/zinc/11/24/08/629112408.db2.gz YAYBERPLLAPUDT-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1N(C)CCCC1(C)C ZINC000790484559 629242444 /nfs/dbraw/zinc/24/24/44/629242444.db2.gz FNVIZWQAMWZOQS-MRXNPFEDSA-N 0 3 292.423 2.611 20 10 CFCDHN CCCN1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835026161 629324604 /nfs/dbraw/zinc/32/46/04/629324604.db2.gz QZOXQPFLHABUSI-AATRIKPKSA-N 0 3 287.451 2.793 20 10 CFCDHN Cc1nn(C)c(C)c1CNC/C=C/c1ccc(N(C)C)cc1 ZINC000835038529 629333984 /nfs/dbraw/zinc/33/39/84/629333984.db2.gz VVCDIVADYGOEOU-VOTSOKGWSA-N 0 3 298.434 2.906 20 10 CFCDHN CC1(C)C[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000835060297 629363808 /nfs/dbraw/zinc/36/38/08/629363808.db2.gz RBTMVANXCJVSCH-NSHDSACASA-N 0 3 267.344 2.826 20 10 CFCDHN CC(C)(C)OC(=O)[C@]1(C)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000835068677 629368238 /nfs/dbraw/zinc/36/82/38/629368238.db2.gz AAOHFVKCZJHEJC-QGZVFWFLSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000835068677 629368249 /nfs/dbraw/zinc/36/82/49/629368249.db2.gz AAOHFVKCZJHEJC-QGZVFWFLSA-N 0 3 291.391 2.946 20 10 CFCDHN C[C@H]1COC(C)(C)CN1Cc1cc2c(cc1O)CCC2 ZINC000792726693 629447318 /nfs/dbraw/zinc/44/73/18/629447318.db2.gz DCQYYAPXUCIPRU-LBPRGKRZSA-N 0 3 275.392 2.880 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnn(C(C)(C)C)c2)c([O-])c1 ZINC000793386249 629536204 /nfs/dbraw/zinc/53/62/04/629536204.db2.gz JMYXHBPKJJOOJG-UHFFFAOYSA-N 0 3 289.379 2.642 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCCC1)c1ccc(C)cc1[O-] ZINC000794791602 629686387 /nfs/dbraw/zinc/68/63/87/629686387.db2.gz BQTCZURXSFOSAX-HNNXBMFYSA-N 0 3 262.397 2.837 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CSC[C@@H]2C)c([O-])c1 ZINC000796485753 629925557 /nfs/dbraw/zinc/92/55/57/629925557.db2.gz ZKRPHSLLDQXBER-GWCFXTLKSA-N 0 3 267.394 2.632 20 10 CFCDHN Cc1ccc([C@H](O)[C@@H](C)[NH2+]Cc2ccccc2[O-])cc1 ZINC000796484013 629925739 /nfs/dbraw/zinc/92/57/39/629925739.db2.gz MUCRTTPAVNPNCB-CXAGYDPISA-N 0 3 271.360 2.912 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC000799736329 630342153 /nfs/dbraw/zinc/34/21/53/630342153.db2.gz NQZLQVYKXKOGMY-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC000799736329 630342154 /nfs/dbraw/zinc/34/21/54/630342154.db2.gz NQZLQVYKXKOGMY-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN CN(C)c1ccc(CN2CC(C3CCOCC3)C2)cc1F ZINC000800530818 630394729 /nfs/dbraw/zinc/39/47/29/630394729.db2.gz VLGKDWYXQCYLTN-UHFFFAOYSA-N 0 3 292.398 2.750 20 10 CFCDHN CCCCN(Cc1ccccc1O)[C@H](C(=O)OC)C1CC1 ZINC000801596033 630461102 /nfs/dbraw/zinc/46/11/02/630461102.db2.gz ZVYNZVLDZLMSOR-INIZCTEOSA-N 0 3 291.391 2.946 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H]1CCCN(C)C1=O ZINC000801597572 630461993 /nfs/dbraw/zinc/46/19/93/630461993.db2.gz JMPHPUPAMCUAHR-HNNXBMFYSA-N 0 3 290.407 2.615 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H]1CCCN(C)C1=O ZINC000801597572 630461997 /nfs/dbraw/zinc/46/19/97/630461997.db2.gz JMPHPUPAMCUAHR-HNNXBMFYSA-N 0 3 290.407 2.615 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC(C)CC1)c1ccccc1[O-] ZINC000040771478 649986564 /nfs/dbraw/zinc/98/65/64/649986564.db2.gz IUQWURIIQBAXBB-AWEZNQCLSA-N 0 3 262.397 2.775 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCSC(C)C ZINC000808419938 630989525 /nfs/dbraw/zinc/98/95/25/630989525.db2.gz RWHNYDKVHWAEOW-UHFFFAOYSA-N 0 3 255.383 2.632 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCCNC2=O)c1[O-] ZINC000808675414 631026081 /nfs/dbraw/zinc/02/60/81/631026081.db2.gz GEPPQBBFZDPNLT-GXFFZTMASA-N 0 3 296.798 2.673 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](O)C(F)(F)F)c1[O-] ZINC000808679925 631027807 /nfs/dbraw/zinc/02/78/07/631027807.db2.gz FGAQSBXQFXWYGV-OIBJUYFYSA-N 0 3 297.704 2.928 20 10 CFCDHN COCCOCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808680953 631028462 /nfs/dbraw/zinc/02/84/62/631028462.db2.gz RKJYGUBIYHIFBI-LLVKDONJSA-N 0 3 287.787 2.668 20 10 CFCDHN CC(C)[N@@H+]1CCCC[C@H]1COC(=O)c1cc([O-])cs1 ZINC000837516166 631052623 /nfs/dbraw/zinc/05/26/23/631052623.db2.gz XXSAEFABFPJJDL-NSHDSACASA-N 0 3 283.393 2.873 20 10 CFCDHN CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1cc([O-])cs1 ZINC000837516166 631052632 /nfs/dbraw/zinc/05/26/32/631052632.db2.gz XXSAEFABFPJJDL-NSHDSACASA-N 0 3 283.393 2.873 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccccc1[O-])[C@@H](O)C(C)C ZINC000840882085 631249597 /nfs/dbraw/zinc/24/95/97/631249597.db2.gz MAWOQRAKMOBAIC-ZLDLUXBVSA-N 0 3 251.370 2.838 20 10 CFCDHN CC[C@H](N[C@H](C)C(=O)NC(C)C)c1ccc(N(C)C)cc1 ZINC000840890419 631253222 /nfs/dbraw/zinc/25/32/22/631253222.db2.gz MLFYNIKCVFGMQX-CJNGLKHVSA-N 0 3 291.439 2.706 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1c2ccccc2C[C@H]1O ZINC000840935762 631268991 /nfs/dbraw/zinc/26/89/91/631268991.db2.gz CSOTYSPGEWIYSE-MOPGFXCFSA-N 0 3 296.414 2.809 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H](O)c1ccccc1 ZINC000809747037 631278429 /nfs/dbraw/zinc/27/84/29/631278429.db2.gz GZOUEFOMWQYVKQ-HNNXBMFYSA-N 0 3 287.359 2.614 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(c2ccncn2)CC1 ZINC000840953412 631280468 /nfs/dbraw/zinc/28/04/68/631280468.db2.gz OZPMRHXGZWXVIC-UHFFFAOYSA-N 0 3 269.348 2.562 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c([O-])c1 ZINC000809765819 631282528 /nfs/dbraw/zinc/28/25/28/631282528.db2.gz QVIQZCQYDADGBI-XJKSGUPXSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c([O-])c1 ZINC000809765819 631282532 /nfs/dbraw/zinc/28/25/32/631282532.db2.gz QVIQZCQYDADGBI-XJKSGUPXSA-N 0 3 292.423 2.563 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H](CO)c1ccc(F)cc1 ZINC000840964738 631286740 /nfs/dbraw/zinc/28/67/40/631286740.db2.gz ZYNZKRWTSASPHH-ZDUSSCGKSA-N 0 3 293.313 2.536 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)NCc1ncc[nH]1 ZINC000840977196 631292680 /nfs/dbraw/zinc/29/26/80/631292680.db2.gz ULKXAAQBPCHIQK-ZDUSSCGKSA-N 0 3 272.396 2.505 20 10 CFCDHN CC[N@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC(C)(C)C1 ZINC000840185608 631294374 /nfs/dbraw/zinc/29/43/74/631294374.db2.gz ZOMWSZAXYFXLRU-OAHLLOKOSA-N 0 3 291.391 2.829 20 10 CFCDHN CC[N@@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC(C)(C)C1 ZINC000840185608 631294379 /nfs/dbraw/zinc/29/43/79/631294379.db2.gz ZOMWSZAXYFXLRU-OAHLLOKOSA-N 0 3 291.391 2.829 20 10 CFCDHN CC1(C)CNCC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000841073444 631331069 /nfs/dbraw/zinc/33/10/69/631331069.db2.gz UGMIJVKKAMUXBB-GFCCVEGCSA-N 0 3 286.778 2.662 20 10 CFCDHN NC[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C1CCCC1 ZINC000841087178 631336108 /nfs/dbraw/zinc/33/61/08/631336108.db2.gz OVXVTJMAJTZLLA-LBPRGKRZSA-N 0 3 286.778 2.792 20 10 CFCDHN [NH3+]C[C@H](NCc1c([O-])ccc(Cl)c1F)C1CCCC1 ZINC000841087178 631336112 /nfs/dbraw/zinc/33/61/12/631336112.db2.gz OVXVTJMAJTZLLA-LBPRGKRZSA-N 0 3 286.778 2.792 20 10 CFCDHN CCCN(CC(=O)N[C@@H](C)C(C)C)Cc1ccccc1O ZINC000104682364 631571231 /nfs/dbraw/zinc/57/12/31/631571231.db2.gz ITNSEGVUXORKJG-AWEZNQCLSA-N 0 3 292.423 2.765 20 10 CFCDHN [NH3+]C1C[C@H]2CCC[C@@H](C1)N2Cc1cccc(Cl)c1[O-] ZINC000843054432 631818034 /nfs/dbraw/zinc/81/80/34/631818034.db2.gz ZRKLQBOVFHIPRV-YHWZYXNKSA-N 0 3 280.799 2.890 20 10 CFCDHN C[NH2+]C[C@H]1CCCN1Cc1c([O-])cc(C)cc1Cl ZINC000843055892 631819339 /nfs/dbraw/zinc/81/93/39/631819339.db2.gz RUANXJQFEKETIQ-LLVKDONJSA-N 0 3 268.788 2.538 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843417179 631948761 /nfs/dbraw/zinc/94/87/61/631948761.db2.gz QOZWHUWHETYGKE-GJZGRUSLSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843417179 631948765 /nfs/dbraw/zinc/94/87/65/631948765.db2.gz QOZWHUWHETYGKE-GJZGRUSLSA-N 0 3 261.365 2.783 20 10 CFCDHN CCC[N@H+](Cc1ccc(OCC)cc1[O-])[C@H]1CCN(C)C1 ZINC000843422804 631952508 /nfs/dbraw/zinc/95/25/08/631952508.db2.gz SBQIFZJPVSQWSG-HNNXBMFYSA-N 0 3 292.423 2.707 20 10 CFCDHN CCC[N@@H+](Cc1ccc(OCC)cc1[O-])[C@H]1CCN(C)C1 ZINC000843422804 631952509 /nfs/dbraw/zinc/95/25/09/631952509.db2.gz SBQIFZJPVSQWSG-HNNXBMFYSA-N 0 3 292.423 2.707 20 10 CFCDHN COc1ccc(O)c(CN2C[C@@H](C)OC3(CCCC3)C2)c1 ZINC000843435614 631959280 /nfs/dbraw/zinc/95/92/80/631959280.db2.gz WMPYVNBZIINQGO-CYBMUJFWSA-N 0 3 291.391 2.934 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000044684722 650053241 /nfs/dbraw/zinc/05/32/41/650053241.db2.gz CSZVWBRBOSTHSN-IUODEOHRSA-N 0 3 260.381 2.670 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](CO)C(C)C)c([O-])c1 ZINC000815626116 632300763 /nfs/dbraw/zinc/30/07/63/632300763.db2.gz WDJGKIQFTRXVOM-KBPBESRZSA-N 0 3 265.397 2.924 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CNc2ccccc2C1 ZINC000844907375 632332975 /nfs/dbraw/zinc/33/29/75/632332975.db2.gz ISAKDYBDHFDACI-CYBMUJFWSA-N 0 3 284.359 2.527 20 10 CFCDHN C[C@@H]1[C@@H](C)CN1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000816648509 632503801 /nfs/dbraw/zinc/50/38/01/632503801.db2.gz LLYSBOWKEJKTSL-QWHCGFSZSA-N 0 3 278.371 2.503 20 10 CFCDHN Cc1cccc(CN2C[C@]3(CCCO3)[C@@H]2C2CC2)c1O ZINC000816666277 632509055 /nfs/dbraw/zinc/50/90/55/632509055.db2.gz JIOPHGPEUZNIFS-DLBZAZTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412646 632624257 /nfs/dbraw/zinc/62/42/57/632624257.db2.gz NOXIZZHWKGRMRY-PWSUYJOCSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412646 632624261 /nfs/dbraw/zinc/62/42/61/632624261.db2.gz NOXIZZHWKGRMRY-PWSUYJOCSA-N 0 3 283.799 2.804 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@@H](CO)CCF ZINC000846097052 632630966 /nfs/dbraw/zinc/63/09/66/632630966.db2.gz MNWMAZUTSRTQJI-MRXNPFEDSA-N 0 3 289.350 2.869 20 10 CFCDHN COc1cccc([C@@H](C)N[C@@H](CO)c2ccccc2)c1O ZINC000846148821 632648280 /nfs/dbraw/zinc/64/82/80/632648280.db2.gz HVTFPLLZVNZHPX-DOMZBBRYSA-N 0 3 287.359 2.785 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CC(=O)N(CC)C1)c1ccc(C)cc1[O-] ZINC000846209708 632660421 /nfs/dbraw/zinc/66/04/21/632660421.db2.gz SLBXDASWNKGMDQ-ZFWWWQNUSA-N 0 3 290.407 2.610 20 10 CFCDHN CC[C@H]([NH2+]CC[C@]1(O)CCCOC1)c1ccc(C)cc1[O-] ZINC000846215195 632662605 /nfs/dbraw/zinc/66/26/05/632662605.db2.gz ZCXIPSYZUFCLOH-DOTOQJQBSA-N 0 3 293.407 2.673 20 10 CFCDHN C[C@H](NCc1ccc(N2CCCC2)cc1)c1cnccc1N ZINC000817898331 632722193 /nfs/dbraw/zinc/72/21/93/632722193.db2.gz GHDUKHOOHPOOKS-AWEZNQCLSA-N 0 3 296.418 2.945 20 10 CFCDHN C[C@H](NCc1ccc(N(C)C)c(F)c1)c1cnccc1N ZINC000817900920 632724705 /nfs/dbraw/zinc/72/47/05/632724705.db2.gz RCDKNMNFMWVHPJ-NSHDSACASA-N 0 3 288.370 2.550 20 10 CFCDHN CC[C@H]([NH2+]C1CCNCC1)c1cccc(Cl)c1[O-] ZINC000817936030 632742037 /nfs/dbraw/zinc/74/20/37/632742037.db2.gz MCZXRDZUMIUNIV-ZDUSSCGKSA-N 0 3 268.788 2.838 20 10 CFCDHN CC[C@H](N[C@@H]1CCC[NH2+]C1)c1cccc(Cl)c1[O-] ZINC000817940740 632744266 /nfs/dbraw/zinc/74/42/66/632744266.db2.gz KHOCFLAEJFIEOT-MFKMUULPSA-N 0 3 268.788 2.838 20 10 CFCDHN CC[C@@H](N[C@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817944822 632747612 /nfs/dbraw/zinc/74/76/12/632747612.db2.gz NGQPXRBBNJKXSO-CMPLNLGQSA-N 0 3 288.313 2.814 20 10 CFCDHN N[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000817955348 632754608 /nfs/dbraw/zinc/75/46/08/632754608.db2.gz WBUMCQUWPKTBIK-LSDHHAIUSA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@@H]([NH2+][C@H](CN)C1CC1)c1ccc2ccccc2c1[O-] ZINC000817960320 632759242 /nfs/dbraw/zinc/75/92/42/632759242.db2.gz LXCKCZMGQXIPRM-BDJLRTHQSA-N 0 3 270.376 2.933 20 10 CFCDHN C[C@@H](NCC1C[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817965407 632764434 /nfs/dbraw/zinc/76/44/34/632764434.db2.gz PXKLVMZGHAFXEQ-SSDOTTSWSA-N 0 3 275.179 2.569 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(F)cc1[O-] ZINC000817969302 632767110 /nfs/dbraw/zinc/76/71/10/632767110.db2.gz BBXHPOFAVPJRED-SWHYSGLUSA-N 0 3 266.360 2.570 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1NCCc3ccccc31)CC2 ZINC000817975489 632773667 /nfs/dbraw/zinc/77/36/67/632773667.db2.gz VODOVTVJYIMDTB-IRXDYDNUSA-N 0 3 294.398 2.856 20 10 CFCDHN C[C@H](NCc1cnc(Cl)n1C)c1ccc(N(C)C)cc1 ZINC000848547513 633286265 /nfs/dbraw/zinc/28/62/65/633286265.db2.gz PSCWGBZWQWFRCV-NSHDSACASA-N 0 3 292.814 2.990 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCCN3CCCC[C@@H]13)CC2 ZINC000848568218 633291370 /nfs/dbraw/zinc/29/13/70/633291370.db2.gz BNWDORSGILIEGA-XHSDSOJGSA-N 0 3 286.419 2.986 20 10 CFCDHN CCc1cccc(CN2CCOC3(CCC3)C2)c1O ZINC000848887937 633363996 /nfs/dbraw/zinc/36/39/96/633363996.db2.gz IQBCMXMLEOXZTK-UHFFFAOYSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H]2CCC[C@H]2CCO)c1[O-] ZINC000848904094 633391462 /nfs/dbraw/zinc/39/14/62/633391462.db2.gz KKZZLWUKSPRVCR-DZGCQCFKSA-N 0 3 263.381 2.595 20 10 CFCDHN CCc1cccc(CN2C[C@H](C)O[C@H](C)[C@H]2C)c1O ZINC000848905381 633392428 /nfs/dbraw/zinc/39/24/28/633392428.db2.gz JVAHEYUKMHTBQN-YNEHKIRRSA-N 0 3 263.381 2.952 20 10 CFCDHN COc1ccc(CNC(=[NH2+])Nc2cccc(C)c2)c([O-])c1 ZINC000849095807 633485636 /nfs/dbraw/zinc/48/56/36/633485636.db2.gz ODGXOQUWNPZOST-UHFFFAOYSA-N 0 3 285.347 2.846 20 10 CFCDHN Cc1ccc(O)c(CNCc2cccnc2N2CCCC2)c1 ZINC000850353227 633951923 /nfs/dbraw/zinc/95/19/23/633951923.db2.gz WXEVCOKZDNTTHI-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000850377737 633965809 /nfs/dbraw/zinc/96/58/09/633965809.db2.gz KPUXOIHKKDBFHU-AGIUHOORSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccccc1[O-] ZINC000850411895 633983008 /nfs/dbraw/zinc/98/30/08/633983008.db2.gz NNIHIJZREAOHGI-DYVFJYSZSA-N 0 3 271.360 2.646 20 10 CFCDHN C[C@@H](O)[C@@H](NCc1ccc(N(C)C)cc1)c1ccccc1 ZINC000850421536 633985514 /nfs/dbraw/zinc/98/55/14/633985514.db2.gz YGQUETZTVPFZKI-RDTXWAMCSA-N 0 3 284.403 2.964 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](OC)[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000850484944 634013283 /nfs/dbraw/zinc/01/32/83/634013283.db2.gz VFPGQJDPDJCJAY-QRTARXTBSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H](CO)C2CCC2)c2c1c(F)ccc2[O-] ZINC000850487379 634014419 /nfs/dbraw/zinc/01/44/19/634014419.db2.gz IDIRYXUGAUHMHS-JIMOISOXSA-N 0 3 279.355 2.830 20 10 CFCDHN COC[C@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)OC ZINC000850486005 634014748 /nfs/dbraw/zinc/01/47/48/634014748.db2.gz QDZCHAWXYQMQOK-MDZLAQPJSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H]([S@](C)=O)C1)c1ccccc1[O-] ZINC000850500663 634020128 /nfs/dbraw/zinc/02/01/28/634020128.db2.gz GECGYAJJUPIXCM-JHXTVGTDSA-N 0 3 281.421 2.733 20 10 CFCDHN C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)C1(CO)CC1 ZINC000850515804 634025878 /nfs/dbraw/zinc/02/58/78/634025878.db2.gz HZQAVECVQICEOF-FOGDFJRCSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1cncc(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])n1 ZINC000850552169 634051578 /nfs/dbraw/zinc/05/15/78/634051578.db2.gz XNQCQAOUKLADNP-NSHDSACASA-N 0 3 275.327 2.523 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)[C@]1(O)CCCOC1)c1ccccc1[O-] ZINC000850561131 634053840 /nfs/dbraw/zinc/05/38/40/634053840.db2.gz HZZCNLMFOATDIS-DYVFJYSZSA-N 0 3 293.407 2.611 20 10 CFCDHN CC[C@@H](CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858165755 636144877 /nfs/dbraw/zinc/14/48/77/636144877.db2.gz MOLGPVTVJLWOSL-NSHDSACASA-N 0 3 272.339 2.545 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](F)[C@H](N)C2)cc1F ZINC000853248769 634951433 /nfs/dbraw/zinc/95/14/33/634951433.db2.gz YWGVYXDBJBUOKP-UKRRQHHQSA-N 0 3 297.393 2.543 20 10 CFCDHN COc1cccc(CNCc2cc(C)oc2C)c1O ZINC000114504779 635836295 /nfs/dbraw/zinc/83/62/95/635836295.db2.gz QPFRTTZVAIBHPS-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN CC[C@H](CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858165754 636146063 /nfs/dbraw/zinc/14/60/63/636146063.db2.gz MOLGPVTVJLWOSL-LLVKDONJSA-N 0 3 272.339 2.545 20 10 CFCDHN CO[C@H]([C@H](C)NCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858173646 636147075 /nfs/dbraw/zinc/14/70/75/636147075.db2.gz DXAFJPWMGGZCBZ-MGPLVRAMSA-N 0 3 298.377 2.934 20 10 CFCDHN CO[C@@H]([C@@H](C)NCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858173645 636147213 /nfs/dbraw/zinc/14/72/13/636147213.db2.gz DXAFJPWMGGZCBZ-HWPZZCPQSA-N 0 3 298.377 2.934 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000858204949 636155187 /nfs/dbraw/zinc/15/51/87/636155187.db2.gz ODHUADZZDFHVJO-FRRDWIJNSA-N 0 3 261.365 2.927 20 10 CFCDHN COCc1ccc(CNCc2cc(C)ccc2O)o1 ZINC000858237621 636160568 /nfs/dbraw/zinc/16/05/68/636160568.db2.gz NNZPWOOKWNRXMP-UHFFFAOYSA-N 0 3 261.321 2.730 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[C@@H](O)C2)c1[O-] ZINC000858544218 636287096 /nfs/dbraw/zinc/28/70/96/636287096.db2.gz SCBSHZZXJHEYBS-FOGDFJRCSA-N 0 3 269.772 2.776 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN(C)CC(F)F)c([O-])c1 ZINC000858597772 636304440 /nfs/dbraw/zinc/30/44/40/636304440.db2.gz WUKVLSOHDUNEJJ-NSHDSACASA-N 0 3 272.339 2.548 20 10 CFCDHN Cc1cc(CN2CCN(CCCF)CC2)ccc1N(C)C ZINC000860007054 636758750 /nfs/dbraw/zinc/75/87/50/636758750.db2.gz UFTCNDMYWVKOKN-UHFFFAOYSA-N 0 3 293.430 2.538 20 10 CFCDHN CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000188037132 650312427 /nfs/dbraw/zinc/31/24/27/650312427.db2.gz YLSSXLACWYVIQQ-INIZCTEOSA-N 0 3 281.371 2.904 20 10 CFCDHN CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000188037132 650312430 /nfs/dbraw/zinc/31/24/30/650312430.db2.gz YLSSXLACWYVIQQ-INIZCTEOSA-N 0 3 281.371 2.904 20 10 CFCDHN CCN(Cc1cc(F)c(N(C)C)cc1F)C[C@H]1CCOC1 ZINC000862222560 637290221 /nfs/dbraw/zinc/29/02/21/637290221.db2.gz DUPSCCWSNDRFKS-GFCCVEGCSA-N 0 3 298.377 2.889 20 10 CFCDHN CC[C@H](C)N(CCO)Cc1cc(F)c(N(C)C)cc1F ZINC000862386770 637349192 /nfs/dbraw/zinc/34/91/92/637349192.db2.gz CAIMHHMSPVFUNX-NSHDSACASA-N 0 3 286.366 2.624 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000862435809 637376646 /nfs/dbraw/zinc/37/66/46/637376646.db2.gz MCEPSZSSIDHTML-INIZCTEOSA-N 0 3 287.334 2.762 20 10 CFCDHN Cc1ccc(O)c(CNC(=O)[C@H](C)N2CCCCCC2)c1 ZINC000862760500 637483294 /nfs/dbraw/zinc/48/32/94/637483294.db2.gz SRUPWBBOCQGVRR-AWEZNQCLSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1cc([O-])c(CN[C@H]2CC[C@@H](C)[NH2+]C2)c(Cl)c1 ZINC000863650300 637725374 /nfs/dbraw/zinc/72/53/74/637725374.db2.gz PXVVYPMXVZPMTC-MNOVXSKESA-N 0 3 268.788 2.584 20 10 CFCDHN C[C@@H]1C[C@H](NCc2cc(F)c(N(C)C)cc2F)[C@@H](C)O1 ZINC000864050594 637842990 /nfs/dbraw/zinc/84/29/90/637842990.db2.gz LCACRLURIKJLKM-RULNRJAQSA-N 0 3 284.350 2.686 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CC(C)(C)CC[C@H]2O)c([O-])c1 ZINC000865699895 638523614 /nfs/dbraw/zinc/52/36/14/638523614.db2.gz LTQBEMJHSHESBN-HUUCEWRRSA-N 0 3 293.407 2.820 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)CC(C)C)c1ccccc1[O-] ZINC000121084030 638831515 /nfs/dbraw/zinc/83/15/15/638831515.db2.gz YUKJGROIXSVPNU-JSGCOSHPSA-N 0 3 251.370 2.840 20 10 CFCDHN CCCOc1ccc(CN[C@@H](CO)CC(F)F)cc1C ZINC000873114384 642016357 /nfs/dbraw/zinc/01/63/57/642016357.db2.gz DEBRWDOFECGOTE-CYBMUJFWSA-N 0 3 287.350 2.890 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)c([O-])c1 ZINC000873156731 642039326 /nfs/dbraw/zinc/03/93/26/642039326.db2.gz MTZPTMQDSDGGHT-YLQAJVPDSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000876570993 642928326 /nfs/dbraw/zinc/92/83/26/642928326.db2.gz QXWVYIPNQBVKRN-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000876570993 642928329 /nfs/dbraw/zinc/92/83/29/642928329.db2.gz QXWVYIPNQBVKRN-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000876570992 642928700 /nfs/dbraw/zinc/92/87/00/642928700.db2.gz QXWVYIPNQBVKRN-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000876570992 642928704 /nfs/dbraw/zinc/92/87/04/642928704.db2.gz QXWVYIPNQBVKRN-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN COCC[N@@H+](Cc1ccc(C)cc1[O-])CC(C)C ZINC000876600826 642940668 /nfs/dbraw/zinc/94/06/68/642940668.db2.gz IVULQNKLIVIIKM-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN COCC[N@H+](Cc1ccc(C)cc1[O-])CC(C)C ZINC000876600826 642940672 /nfs/dbraw/zinc/94/06/72/642940672.db2.gz IVULQNKLIVIIKM-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN CCCN(Cc1ccccc1O)C(=O)[C@H](N)CCC(C)C ZINC000876632682 642950924 /nfs/dbraw/zinc/95/09/24/642950924.db2.gz MJJDMYXWLVOWSM-OAHLLOKOSA-N 0 3 292.423 2.894 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000876770734 643003411 /nfs/dbraw/zinc/00/34/11/643003411.db2.gz JGALMFHRPFXFHS-ZDUSSCGKSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000876770734 643003418 /nfs/dbraw/zinc/00/34/18/643003418.db2.gz JGALMFHRPFXFHS-ZDUSSCGKSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc3c(c2)OCO3)c([O-])c1 ZINC000876898790 643056292 /nfs/dbraw/zinc/05/62/92/643056292.db2.gz VUXDUAZSZHWSON-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCOCC(F)(F)F ZINC000876926904 643067505 /nfs/dbraw/zinc/06/75/05/643067505.db2.gz KEGXOQAVHMOFIP-UHFFFAOYSA-N 0 3 277.286 2.759 20 10 CFCDHN CC[N@H+](C)Cc1cc(Br)cc(OC)c1[O-] ZINC000126257006 643082248 /nfs/dbraw/zinc/08/22/48/643082248.db2.gz IKRWWBBLSHBMCA-UHFFFAOYSA-N 0 3 274.158 2.615 20 10 CFCDHN CC[N@@H+](C)Cc1cc(Br)cc(OC)c1[O-] ZINC000126257006 643082254 /nfs/dbraw/zinc/08/22/54/643082254.db2.gz IKRWWBBLSHBMCA-UHFFFAOYSA-N 0 3 274.158 2.615 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000876960116 643082600 /nfs/dbraw/zinc/08/26/00/643082600.db2.gz UJYNIWFLHUZXCZ-MRXNPFEDSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)C2CCCCC2)c([O-])c1 ZINC000877005519 643101270 /nfs/dbraw/zinc/10/12/70/643101270.db2.gz SLNZKQQEEFPBIL-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN CC(=O)Nc1ccc(CC[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877011466 643103357 /nfs/dbraw/zinc/10/33/57/643103357.db2.gz CWDDJMSTFPRGRU-UHFFFAOYSA-N 0 3 298.386 2.991 20 10 CFCDHN Cc1ccc(CN[C@@H](CO)c2cccc(F)c2)c(O)c1 ZINC000877035867 643114048 /nfs/dbraw/zinc/11/40/48/643114048.db2.gz LMVPGBRNEFMSSA-HNNXBMFYSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)c2ccccc2)c([O-])c1 ZINC000877041378 643116385 /nfs/dbraw/zinc/11/63/85/643116385.db2.gz WEZNMOFPPLKDNV-QGZVFWFLSA-N 0 3 271.360 2.698 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)c1cccs1 ZINC000877047514 643119345 /nfs/dbraw/zinc/11/93/45/643119345.db2.gz BNXQQHFXRZNRDM-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccccc2[N+](=O)[O-])c([O-])c1 ZINC000877064409 643130701 /nfs/dbraw/zinc/13/07/01/643130701.db2.gz SHKXCZJBZUXNIT-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)[C@@H](O)C(C)C)c([O-])c1 ZINC000877124228 643162723 /nfs/dbraw/zinc/16/27/23/643162723.db2.gz UKLHOQWULUAODX-HNNXBMFYSA-N 0 3 265.397 2.833 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2[O-])[C@@]12CCCO2 ZINC000877345426 643244222 /nfs/dbraw/zinc/24/42/22/643244222.db2.gz CSXWLHIKIMGDOM-ZACQAIPSSA-N 0 3 291.391 2.517 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877438694 643272808 /nfs/dbraw/zinc/27/28/08/643272808.db2.gz NXBPTDBTLHYXNV-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877438694 643272812 /nfs/dbraw/zinc/27/28/12/643272812.db2.gz NXBPTDBTLHYXNV-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1ccc(C)cc1[O-])C(C)C ZINC000877469442 643288392 /nfs/dbraw/zinc/28/83/92/643288392.db2.gz VGJFXWSZAPOQCO-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN CCC(O)(CC)CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877471107 643289132 /nfs/dbraw/zinc/28/91/32/643289132.db2.gz OVWNZFAJQISGDM-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN Cc1ccc(CN2C[C@@H](C3CC3)O[C@@H](C)C2)c(O)c1 ZINC000877486094 643302445 /nfs/dbraw/zinc/30/24/45/643302445.db2.gz DRICSJPTDKZNBS-LRDDRELGSA-N 0 3 261.365 2.700 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@]1(OC)CCOC1 ZINC000877503504 643314458 /nfs/dbraw/zinc/31/44/58/643314458.db2.gz OFYHHCCHNWDLHL-QGZVFWFLSA-N 0 3 293.407 2.800 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@]1(OC)CCOC1 ZINC000877503504 643314462 /nfs/dbraw/zinc/31/44/62/643314462.db2.gz OFYHHCCHNWDLHL-QGZVFWFLSA-N 0 3 293.407 2.800 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@]1(OC)CCOC1 ZINC000877503503 643314480 /nfs/dbraw/zinc/31/44/80/643314480.db2.gz OFYHHCCHNWDLHL-KRWDZBQOSA-N 0 3 293.407 2.800 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@]1(OC)CCOC1 ZINC000877503503 643314482 /nfs/dbraw/zinc/31/44/82/643314482.db2.gz OFYHHCCHNWDLHL-KRWDZBQOSA-N 0 3 293.407 2.800 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCCSC1 ZINC000877533807 643336426 /nfs/dbraw/zinc/33/64/26/643336426.db2.gz WJFBKENNAKDNMJ-GFCCVEGCSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CC2)C(C)(C)CO)c([O-])c1 ZINC000877542125 643344201 /nfs/dbraw/zinc/34/42/01/643344201.db2.gz VXZQWCNUORJRPO-OAHLLOKOSA-N 0 3 263.381 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]CCCC2CCOCC2)c([O-])c1 ZINC000877557037 643358566 /nfs/dbraw/zinc/35/85/66/643358566.db2.gz DRHZFIOLKQPSKC-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000877572426 643371808 /nfs/dbraw/zinc/37/18/08/643371808.db2.gz FDUDQZJEDJVBBX-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000877572426 643371825 /nfs/dbraw/zinc/37/18/25/643371825.db2.gz FDUDQZJEDJVBBX-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(CC[NH2+]Cc2ccc(C)cc2[O-])nc1 ZINC000877577143 643373869 /nfs/dbraw/zinc/37/38/69/643373869.db2.gz AJHCNDYIXGLYEC-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+]Cc2c(C)cccc2[O-])C12CCC2 ZINC000877585119 643380562 /nfs/dbraw/zinc/38/05/62/643380562.db2.gz PYLCNQHGJHWDAE-GJZGRUSLSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc(O)c1CN1CCO[C@H](C2CCC2)C1 ZINC000877587626 643382592 /nfs/dbraw/zinc/38/25/92/643382592.db2.gz PAMUUKLXPUNJBX-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CO)c1ccc(F)cc1 ZINC000877590238 643383770 /nfs/dbraw/zinc/38/37/70/643383770.db2.gz XLBHZPGGOXDQRR-AWEZNQCLSA-N 0 3 289.350 2.705 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877603903 643391939 /nfs/dbraw/zinc/39/19/39/643391939.db2.gz FMSUELPPGFGZGP-IBGZPJMESA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877603903 643391944 /nfs/dbraw/zinc/39/19/44/643391944.db2.gz FMSUELPPGFGZGP-IBGZPJMESA-N 0 3 297.398 2.966 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2[O-])[C@@H]1SC ZINC000877607104 643394882 /nfs/dbraw/zinc/39/48/82/643394882.db2.gz XEIPZBVLNRFSOG-YUELXQCFSA-N 0 3 281.421 2.699 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccns3)C2)cc1 ZINC000877620342 643406322 /nfs/dbraw/zinc/40/63/22/643406322.db2.gz HEWILEQPAZIXJZ-GFCCVEGCSA-N 0 3 289.404 2.520 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cnccc2C)c([O-])c1 ZINC000877623910 643410188 /nfs/dbraw/zinc/41/01/88/643410188.db2.gz DMTGAGIQYQPVLM-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2cnn(C)c2)c([O-])c1 ZINC000877631293 643416330 /nfs/dbraw/zinc/41/63/30/643416330.db2.gz OTEOMSMXTRFXJM-WBVHZDCISA-N 0 3 299.418 2.935 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2cnn(C)c2)c([O-])c1 ZINC000877631292 643416863 /nfs/dbraw/zinc/41/68/63/643416863.db2.gz OTEOMSMXTRFXJM-RDJZCZTQSA-N 0 3 299.418 2.935 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(O)CCC(C)CC1 ZINC000877643515 643428521 /nfs/dbraw/zinc/42/85/21/643428521.db2.gz JSVKRYWGIOLYBW-UHFFFAOYSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000877649682 643431112 /nfs/dbraw/zinc/43/11/12/643431112.db2.gz FAKUPYIOXBBGNU-INIZCTEOSA-N 0 3 283.371 2.932 20 10 CFCDHN CN(C)c1ccc(CN2Cc3cccc(O)c3C2)cc1 ZINC000877703354 643469394 /nfs/dbraw/zinc/46/93/94/643469394.db2.gz DJJPWPQQYBCYLV-UHFFFAOYSA-N 0 3 268.360 2.974 20 10 CFCDHN CN(C)c1ccc(C[N@@H+]2Cc3cccc([O-])c3C2)cc1 ZINC000877703354 643469400 /nfs/dbraw/zinc/46/94/00/643469400.db2.gz DJJPWPQQYBCYLV-UHFFFAOYSA-N 0 3 268.360 2.974 20 10 CFCDHN CN(C)c1ccc(C[N@H+]2Cc3cccc([O-])c3C2)cc1 ZINC000877703354 643469405 /nfs/dbraw/zinc/46/94/05/643469405.db2.gz DJJPWPQQYBCYLV-UHFFFAOYSA-N 0 3 268.360 2.974 20 10 CFCDHN CC(C)(O)C1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000877753500 643532372 /nfs/dbraw/zinc/53/23/72/643532372.db2.gz FOTZDLCPOQREIJ-UHFFFAOYSA-N 0 3 267.344 2.514 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc2c(c1)nnn2C)c1ccccc1[O-] ZINC000877757164 643536541 /nfs/dbraw/zinc/53/65/41/643536541.db2.gz KPRNXWCYENOUGQ-NSHDSACASA-N 0 3 282.347 2.525 20 10 CFCDHN Cc1nn(C)c2ncc(C[NH2+][C@H](C)c3ccccc3[O-])cc12 ZINC000877756250 643537643 /nfs/dbraw/zinc/53/76/43/643537643.db2.gz BHWRYMRJMAWMOH-LLVKDONJSA-N 0 3 296.374 2.833 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@H]1SC ZINC000877758399 643538614 /nfs/dbraw/zinc/53/86/14/643538614.db2.gz YHMIDDJEMIHARF-QMGNLALYSA-N 0 3 281.421 2.952 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](C(C)(C)O)C2)c([O-])c1 ZINC000877795222 643560740 /nfs/dbraw/zinc/56/07/40/643560740.db2.gz CILXODOMMGNNMM-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](C(C)(C)O)C2)c([O-])c1 ZINC000877795222 643560743 /nfs/dbraw/zinc/56/07/43/643560743.db2.gz CILXODOMMGNNMM-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOC(F)(F)C(F)(F)F ZINC000877807484 643569407 /nfs/dbraw/zinc/56/94/07/643569407.db2.gz QOWGSYAAPSYJOO-UHFFFAOYSA-N 0 3 299.239 2.962 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877818872 643583446 /nfs/dbraw/zinc/58/34/46/643583446.db2.gz RFDAIQPKRVMLCT-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877818872 643583447 /nfs/dbraw/zinc/58/34/47/643583447.db2.gz RFDAIQPKRVMLCT-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cccc(O)c1CN1CCO[C@@H](C(F)(F)F)CC1 ZINC000877820207 643586444 /nfs/dbraw/zinc/58/64/44/643586444.db2.gz CQHZZEHHORCOQT-CYBMUJFWSA-N 0 3 289.297 2.854 20 10 CFCDHN Cc1cccc(CN[C@H](C)c2nccnc2C)c1O ZINC000877829255 643595264 /nfs/dbraw/zinc/59/52/64/643595264.db2.gz XPLQQVJIMOMKSI-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN CCN(C#N)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000878102914 643736814 /nfs/dbraw/zinc/73/68/14/643736814.db2.gz DYSLYZDIARULBO-UHFFFAOYSA-N 0 3 287.407 2.940 20 10 CFCDHN CCN(C#N)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000878102914 643736817 /nfs/dbraw/zinc/73/68/17/643736817.db2.gz DYSLYZDIARULBO-UHFFFAOYSA-N 0 3 287.407 2.940 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[O-])CCN1C ZINC000090721342 650880651 /nfs/dbraw/zinc/88/06/51/650880651.db2.gz CBBLCKFJKAFMDF-GWCFXTLKSA-N 0 3 268.788 2.618 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)C(=O)Nc1nccs1)c1ccccc1[O-] ZINC000879648307 644361125 /nfs/dbraw/zinc/36/11/25/644361125.db2.gz JHPSZRZQQMARBA-ZJUUUORDSA-N 0 3 291.376 2.527 20 10 CFCDHN CC[C@@H]1CCCCN1C(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879647806 644361283 /nfs/dbraw/zinc/36/12/83/644361283.db2.gz MAQOHTCDBJMWCQ-ZIAGYGMSSA-N 0 3 290.407 2.834 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2ccccc2O)nc1 ZINC000879650922 644364626 /nfs/dbraw/zinc/36/46/26/644364626.db2.gz XBDGHVRNOQIYHN-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CCC[C@H](C)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651767 644364796 /nfs/dbraw/zinc/36/47/96/644364796.db2.gz JZDBDEVEEJZEAP-AVGNSLFASA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@H]([NH2+]CC[S@@](=O)c1ccccc1)c1ccccc1[O-] ZINC000879652031 644366429 /nfs/dbraw/zinc/36/64/29/644366429.db2.gz UPIBUCBOTDLSRZ-RNODOKPDSA-N 0 3 289.400 2.851 20 10 CFCDHN CC[C@H]1CCCCN1C(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879653069 644366453 /nfs/dbraw/zinc/36/64/53/644366453.db2.gz MAQOHTCDBJMWCQ-KBPBESRZSA-N 0 3 290.407 2.834 20 10 CFCDHN CC[C@@H]1CCCCN1C(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879653070 644366557 /nfs/dbraw/zinc/36/65/57/644366557.db2.gz MAQOHTCDBJMWCQ-UONOGXRCSA-N 0 3 290.407 2.834 20 10 CFCDHN CCC[C@@H](N)c1cn(Cc2ccc(N(C)CC)cc2)nn1 ZINC000881313284 644950166 /nfs/dbraw/zinc/95/01/66/644950166.db2.gz GYQUBBSCVGKMBV-OAHLLOKOSA-N 0 3 287.411 2.582 20 10 CFCDHN CC[C@H](CCO)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000094949535 650965879 /nfs/dbraw/zinc/96/58/79/650965879.db2.gz AMFMUGYUUZFWHO-OCCSQVGLSA-N 0 3 251.370 2.842 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)c(F)c1 ZINC000303977642 651010255 /nfs/dbraw/zinc/01/02/55/651010255.db2.gz CYWOAUDMFGRAMM-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)c(F)c1 ZINC000303977642 651010260 /nfs/dbraw/zinc/01/02/60/651010260.db2.gz CYWOAUDMFGRAMM-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)Cc2ccoc2)c([O-])c1 ZINC000883276555 645718194 /nfs/dbraw/zinc/71/81/94/645718194.db2.gz MJLPTDBVGHAGOJ-UKRRQHHQSA-N 0 3 289.375 2.795 20 10 CFCDHN CC(C)[C@H]([NH3+])CCN(C)Cc1c([O-])cccc1Cl ZINC000133355972 646075297 /nfs/dbraw/zinc/07/52/97/646075297.db2.gz XAOPTVDSQQMTOK-CYBMUJFWSA-N 0 3 270.804 2.851 20 10 CFCDHN O=C(C[NH2+]Cc1ccccc1[O-])Nc1ccc(Cl)cc1 ZINC000134229434 646308489 /nfs/dbraw/zinc/30/84/89/646308489.db2.gz RAKDPSURMAOUMA-UHFFFAOYSA-N 0 3 290.750 2.774 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2[O-])cc1[N+](=O)[O-] ZINC000134230167 646308922 /nfs/dbraw/zinc/30/89/22/646308922.db2.gz VXMJTSZZLDOPMF-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(CO)CCCC2)c([O-])c1 ZINC000135065757 646452975 /nfs/dbraw/zinc/45/29/75/646452975.db2.gz KXOJVMXGJTXXDH-CYBMUJFWSA-N 0 3 263.381 2.904 20 10 CFCDHN Cc1[nH]nc(CNCc2ccc(N(C)C)c(F)c2)c1C ZINC000885953992 646781621 /nfs/dbraw/zinc/78/16/21/646781621.db2.gz KXFYWUJXLOFKDB-UHFFFAOYSA-N 0 3 276.359 2.521 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1c([O-])cccc1F ZINC000886505304 647022264 /nfs/dbraw/zinc/02/22/64/647022264.db2.gz UXRONUAFHXSIHZ-RWMBFGLXSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c([O-])cccc1F ZINC000886505304 647022268 /nfs/dbraw/zinc/02/22/68/647022268.db2.gz UXRONUAFHXSIHZ-RWMBFGLXSA-N 0 3 278.371 2.809 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000219807674 647034812 /nfs/dbraw/zinc/03/48/12/647034812.db2.gz WOSAPHVIJKYJLB-GJZGRUSLSA-N 0 3 278.371 2.638 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000219807588 647035145 /nfs/dbraw/zinc/03/51/45/647035145.db2.gz WOSAPHVIJKYJLB-LSDHHAIUSA-N 0 3 278.371 2.638 20 10 CFCDHN CC[C@H](NCc1cc(N)ccn1)c1ccc(N(C)C)cc1 ZINC000925771581 648314537 /nfs/dbraw/zinc/31/45/37/648314537.db2.gz NAGSQIDBFUXFPD-KRWDZBQOSA-N 0 3 284.407 2.971 20 10 CFCDHN C[C@H](N[C@@H]1C[NH2+]C[C@H]1C)c1cccc(C(F)(F)F)c1[O-] ZINC000925782617 648320760 /nfs/dbraw/zinc/32/07/60/648320760.db2.gz GTFRSTLMBDSIMI-VDDIYKPWSA-N 0 3 288.313 2.670 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000927017804 648683978 /nfs/dbraw/zinc/68/39/78/648683978.db2.gz MVEHENVCJUKYJQ-QWHCGFSZSA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000927017803 648684102 /nfs/dbraw/zinc/68/41/02/648684102.db2.gz MVEHENVCJUKYJQ-OLZOCXBDSA-N 0 3 251.370 2.902 20 10 CFCDHN C[C@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCCO1 ZINC000927018207 648684652 /nfs/dbraw/zinc/68/46/52/648684652.db2.gz KXGWQASOVMVZBT-CZUORRHYSA-N 0 3 261.365 2.928 20 10 CFCDHN CC[C@H]([NH2+]CCOC1CCOCC1)c1ccc(C)cc1[O-] ZINC000927078119 648700342 /nfs/dbraw/zinc/70/03/42/648700342.db2.gz FJXYEORLOOHPNM-INIZCTEOSA-N 0 3 293.407 2.937 20 10 CFCDHN CCOCCOCC[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000927087656 648705759 /nfs/dbraw/zinc/70/57/59/648705759.db2.gz PKEAAKHYMLHIND-OAHLLOKOSA-N 0 3 281.396 2.794 20 10 CFCDHN COc1ccc(N2CCN([C@H](C)C3CC3)CC2)c(OC)c1 ZINC000931531489 649448177 /nfs/dbraw/zinc/44/81/77/649448177.db2.gz DXYODFNXJDREQP-CYBMUJFWSA-N 0 3 290.407 2.624 20 10 CFCDHN CC[C@@H](CCC(=O)OC)C[N@H+](C)Cc1ccccc1[O-] ZINC001208787119 769940951 /nfs/dbraw/zinc/94/09/51/769940951.db2.gz ZUOUCIVSLOIDHE-ZDUSSCGKSA-N 0 3 279.380 2.803 20 10 CFCDHN CC[C@@H](CCC(=O)OC)C[N@@H+](C)Cc1ccccc1[O-] ZINC001208787119 769940956 /nfs/dbraw/zinc/94/09/56/769940956.db2.gz ZUOUCIVSLOIDHE-ZDUSSCGKSA-N 0 3 279.380 2.803 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC2(C[C@@H]2CCO)CC1 ZINC001140057655 770114978 /nfs/dbraw/zinc/11/49/78/770114978.db2.gz JFQCWEKCPDBNPJ-ZDUSSCGKSA-N 0 3 279.355 2.516 20 10 CFCDHN C[C@H]([NH2+]CCO[C@@H]1CC1(F)F)c1cc(F)ccc1[O-] ZINC000690725616 770779061 /nfs/dbraw/zinc/77/90/61/770779061.db2.gz GQCASPPLRUIJEI-QPUJVOFHSA-N 0 3 275.270 2.606 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCO[C@H]2CC2(F)F)c([O-])c1 ZINC000690730721 770806211 /nfs/dbraw/zinc/80/62/11/770806211.db2.gz KJYRQQMKBVHTOH-MFKMUULPSA-N 0 3 271.307 2.775 20 10 CFCDHN C[C@H]([NH2+][C@H](CCO)C1CCCC1)c1ccccc1[O-] ZINC000725105318 775273035 /nfs/dbraw/zinc/27/30/35/775273035.db2.gz UBIIWDIHWQUVSN-SWLSCSKDSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001140948662 775686609 /nfs/dbraw/zinc/68/66/09/775686609.db2.gz UDMNJKZXJDSBHZ-HOCLYGCPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001140948662 775686615 /nfs/dbraw/zinc/68/66/15/775686615.db2.gz UDMNJKZXJDSBHZ-HOCLYGCPSA-N 0 3 261.365 2.702 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CCC23C[NH2+]C3)cc1Cl ZINC001222310298 776070069 /nfs/dbraw/zinc/07/00/69/776070069.db2.gz SVHLPMHWSQBWOJ-UHFFFAOYSA-N 0 3 294.826 2.891 20 10 CFCDHN CC[C@@H](O)CCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000398491786 776174527 /nfs/dbraw/zinc/17/45/27/776174527.db2.gz IGNZVZRRBVEJJH-ZYHUDNBSSA-N 0 3 255.333 2.733 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](CO)CC1CCCCC1 ZINC000223882887 776630382 /nfs/dbraw/zinc/63/03/82/776630382.db2.gz HLWWRXAMCLIYNF-OAHLLOKOSA-N 0 3 263.381 2.813 20 10 CFCDHN COc1cc(CN(C)Cc2cccc(F)c2)c(O)cc1O ZINC001231634061 777287542 /nfs/dbraw/zinc/28/75/42/777287542.db2.gz HEAAEJLQLOZEAB-UHFFFAOYSA-N 0 3 291.322 2.878 20 10 CFCDHN CC(=O)[C@H]1CCCCN1Cc1c(C)cc(C)cc1O ZINC001231849405 777351112 /nfs/dbraw/zinc/35/11/12/777351112.db2.gz QIWIESYIIYRXSP-OAHLLOKOSA-N 0 3 261.365 2.953 20 10 CFCDHN CC(=O)[C@@H]1CCCCN1Cc1c(C)cc(C)cc1O ZINC001231849404 777349839 /nfs/dbraw/zinc/34/98/39/777349839.db2.gz QIWIESYIIYRXSP-HNNXBMFYSA-N 0 3 261.365 2.953 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCc3nccn3CC2)cc1Cl ZINC001231870379 777358904 /nfs/dbraw/zinc/35/89/04/777358904.db2.gz XFCNQAUEDGJRHN-UHFFFAOYSA-N 0 3 291.782 2.609 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCc3nccn3CC2)cc1Cl ZINC001231870379 777358915 /nfs/dbraw/zinc/35/89/15/777358915.db2.gz XFCNQAUEDGJRHN-UHFFFAOYSA-N 0 3 291.782 2.609 20 10 CFCDHN Cc1ncccc1CN(C)Cc1ccc(N(C)C)cc1O ZINC001232840987 777690636 /nfs/dbraw/zinc/69/06/36/777690636.db2.gz PGENYWPFFNCUMR-UHFFFAOYSA-N 0 3 285.391 2.794 20 10 CFCDHN C[C@@H]1CCC[C@H](C)N1Cc1cc(O)c(O)c(O)c1 ZINC001233009116 777762610 /nfs/dbraw/zinc/76/26/10/777762610.db2.gz KGUPKLHDQBHOHV-AOOOYVTPSA-N 0 3 251.326 2.566 20 10 CFCDHN Oc1cc(CN2CC[C@H]3CCCC[C@H]3C2)cc(O)c1O ZINC001233012604 777764288 /nfs/dbraw/zinc/76/42/88/777764288.db2.gz LPCUPXNBXPXKMW-OLZOCXBDSA-N 0 3 277.364 2.816 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](O)[C@@H](C)C2)c1[O-] ZINC001233288082 777870349 /nfs/dbraw/zinc/87/03/49/777870349.db2.gz VASHECYYYGQRBY-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c1[O-] ZINC001233288082 777870359 /nfs/dbraw/zinc/87/03/59/777870359.db2.gz VASHECYYYGQRBY-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCc3cccc([O-])c32)O1 ZINC000688872817 777872163 /nfs/dbraw/zinc/87/21/63/777872163.db2.gz AXFXOTWNGVXNNF-KWCYVHTRSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@](C)(O)C3)c2c1 ZINC001234526372 778243593 /nfs/dbraw/zinc/24/35/93/778243593.db2.gz UXNKHFAUSIPZJC-KRWDZBQOSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@](C)(O)C3)c2c1 ZINC001234526372 778243596 /nfs/dbraw/zinc/24/35/96/778243596.db2.gz UXNKHFAUSIPZJC-KRWDZBQOSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc(O)c(CN(C)C3(C)COC3)c2c1 ZINC001234562214 778251803 /nfs/dbraw/zinc/25/18/03/778251803.db2.gz KKWOVMYPQSPLBZ-UHFFFAOYSA-N 0 3 287.359 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3C[C@@H]4CCO[C@@H]4C3)c2c1 ZINC001234562825 778251860 /nfs/dbraw/zinc/25/18/60/778251860.db2.gz VHMCNMAHRICTTL-SCLBCKFNSA-N 0 3 299.370 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3C[C@@H]4CCO[C@@H]4C3)c2c1 ZINC001234562825 778251863 /nfs/dbraw/zinc/25/18/63/778251863.db2.gz VHMCNMAHRICTTL-SCLBCKFNSA-N 0 3 299.370 2.775 20 10 CFCDHN CCN1CCN(c2ccc(OCCOC(C)C)cc2)CC1 ZINC001234657440 778280140 /nfs/dbraw/zinc/28/01/40/778280140.db2.gz DDSWLMPDFDDRAT-UHFFFAOYSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1c(CN2CCCC23C[NH2+]C3)cccc1-c1ccccc1 ZINC001235089965 778377114 /nfs/dbraw/zinc/37/71/14/778377114.db2.gz OHZYGJPHOJRGMA-UHFFFAOYSA-N 0 3 294.398 2.997 20 10 CFCDHN Cc1cc([O-])c(CN(C)[C@H]2CCC[NH2+]C2)cc1Cl ZINC001235347176 778463898 /nfs/dbraw/zinc/46/38/98/778463898.db2.gz NKPXXKVJAXRUEU-LBPRGKRZSA-N 0 3 268.788 2.538 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676376 778533183 /nfs/dbraw/zinc/53/31/83/778533183.db2.gz RUSVBAKHLVOTLD-WFASDCNBSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676376 778533186 /nfs/dbraw/zinc/53/31/86/778533186.db2.gz RUSVBAKHLVOTLD-WFASDCNBSA-N 0 3 277.408 2.892 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@](C)(CO)C2)c([O-])c1 ZINC001235676946 778534464 /nfs/dbraw/zinc/53/44/64/778534464.db2.gz YFNMYMIUHSGYIC-KRWDZBQOSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@](C)(CO)C2)c([O-])c1 ZINC001235676946 778534468 /nfs/dbraw/zinc/53/44/68/778534468.db2.gz YFNMYMIUHSGYIC-KRWDZBQOSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(CN2CC(N3CCCC3)C2)c(O)c1 ZINC001235685652 778537392 /nfs/dbraw/zinc/53/73/92/778537392.db2.gz UQKJZIINCCRHQE-UHFFFAOYSA-N 0 3 288.435 2.970 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]([NH3+])CC[C@H]2C)cc1Cl ZINC001235905571 778603843 /nfs/dbraw/zinc/60/38/43/778603843.db2.gz MQMANCKRHVVIEM-PWSUYJOCSA-N 0 3 268.788 2.666 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1Cl ZINC001236093625 778688896 /nfs/dbraw/zinc/68/88/96/778688896.db2.gz VWNHLLXQJWZYDV-BETUJISGSA-N 0 3 280.799 2.680 20 10 CFCDHN Cc1cc([O-])c(CN(C)[C@]2(C)CCC[NH2+]C2)cc1Cl ZINC001236207412 778736116 /nfs/dbraw/zinc/73/61/16/778736116.db2.gz PTZKCXZNCBPMKT-OAHLLOKOSA-N 0 3 282.815 2.928 20 10 CFCDHN CCCN(Cc1cc(Cl)c(OC)cc1[O-])[C@@H]1CC[NH2+]C1 ZINC001236322740 778780097 /nfs/dbraw/zinc/78/00/97/778780097.db2.gz ACXDEUQVNUDZSR-GFCCVEGCSA-N 0 3 298.814 2.628 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@@](O)(CF)C2)c([O-])c1 ZINC001236782795 778933253 /nfs/dbraw/zinc/93/32/53/778933253.db2.gz FGZSVYLHCLODLS-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@@](O)(CF)C2)c([O-])c1 ZINC001236782795 778933255 /nfs/dbraw/zinc/93/32/55/778933255.db2.gz FGZSVYLHCLODLS-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2CO)c([O-])c1 ZINC001236782674 778933560 /nfs/dbraw/zinc/93/35/60/778933560.db2.gz CUZHFSHGRYGVOM-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2CO)c([O-])c1 ZINC001236782674 778933565 /nfs/dbraw/zinc/93/35/65/778933565.db2.gz CUZHFSHGRYGVOM-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c([O-])c1 ZINC001236782673 778933751 /nfs/dbraw/zinc/93/37/51/778933751.db2.gz CUZHFSHGRYGVOM-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2CO)c([O-])c1 ZINC001236782673 778933757 /nfs/dbraw/zinc/93/37/57/778933757.db2.gz CUZHFSHGRYGVOM-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c([O-])c1 ZINC001236785052 778935597 /nfs/dbraw/zinc/93/55/97/778935597.db2.gz DRMIJMZBGQQIBV-OKILXGFUSA-N 0 3 259.349 2.651 20 10 CFCDHN CCc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c([O-])c1 ZINC001236785052 778935602 /nfs/dbraw/zinc/93/56/02/778935602.db2.gz DRMIJMZBGQQIBV-OKILXGFUSA-N 0 3 259.349 2.651 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236786944 778937366 /nfs/dbraw/zinc/93/73/66/778937366.db2.gz SLLUFHXFEDYFBV-YOEHRIQHSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236786944 778937370 /nfs/dbraw/zinc/93/73/70/778937370.db2.gz SLLUFHXFEDYFBV-YOEHRIQHSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(CN2CCOC[C@H]2C2CC2)c(O)c1 ZINC001236793447 778938755 /nfs/dbraw/zinc/93/87/55/778938755.db2.gz WRXFLSVEHCMXQR-HNNXBMFYSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(CN2CC(N3CCC(F)CC3)C2)c(O)c1 ZINC001236793935 778939359 /nfs/dbraw/zinc/93/93/59/778939359.db2.gz HFDCLFRAIFTABO-UHFFFAOYSA-N 0 3 292.398 2.573 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C(=O)OC)[C@H]2C)c([O-])c1 ZINC001236794236 778939714 /nfs/dbraw/zinc/93/97/14/778939714.db2.gz JYTIBKYEILUETG-DOMZBBRYSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C(=O)OC)[C@H]2C)c([O-])c1 ZINC001236794236 778939720 /nfs/dbraw/zinc/93/97/20/778939720.db2.gz JYTIBKYEILUETG-DOMZBBRYSA-N 0 3 291.391 2.728 20 10 CFCDHN CN(Cc1cc(Cl)c(Cl)cc1[O-])[C@H]1CC[N@H+](C)C1 ZINC001236795149 778940572 /nfs/dbraw/zinc/94/05/72/778940572.db2.gz BBYBFMDQOLTYQY-JTQLQIEISA-N 0 3 289.206 2.835 20 10 CFCDHN CN(Cc1cc(Cl)c(Cl)cc1[O-])[C@H]1CC[N@@H+](C)C1 ZINC001236795149 778940576 /nfs/dbraw/zinc/94/05/76/778940576.db2.gz BBYBFMDQOLTYQY-JTQLQIEISA-N 0 3 289.206 2.835 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236807226 778947442 /nfs/dbraw/zinc/94/74/42/778947442.db2.gz DTXYVWHVQBGTSC-DYVFJYSZSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236807226 778947445 /nfs/dbraw/zinc/94/74/45/778947445.db2.gz DTXYVWHVQBGTSC-DYVFJYSZSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC001236821807 778953834 /nfs/dbraw/zinc/95/38/34/778953834.db2.gz UHQHYHAMYDOGSK-QGZVFWFLSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC001236821807 778953838 /nfs/dbraw/zinc/95/38/38/778953838.db2.gz UHQHYHAMYDOGSK-QGZVFWFLSA-N 0 3 291.391 2.712 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCOCC1 ZINC001236825714 778955178 /nfs/dbraw/zinc/95/51/78/778955178.db2.gz DHSGEEPZDFXASG-UHFFFAOYSA-N 0 3 257.333 2.768 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCOCC1 ZINC001236825714 778955183 /nfs/dbraw/zinc/95/51/83/778955183.db2.gz DHSGEEPZDFXASG-UHFFFAOYSA-N 0 3 257.333 2.768 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CC(C2COC2)C1 ZINC001236827888 778956764 /nfs/dbraw/zinc/95/67/64/778956764.db2.gz WATOUPJQUFVNRU-UHFFFAOYSA-N 0 3 269.344 2.624 20 10 CFCDHN CC(=O)N[C@@H]1CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834817 778959446 /nfs/dbraw/zinc/95/94/46/778959446.db2.gz DHOGOQCDFBAQOL-QGZVFWFLSA-N 0 3 298.386 2.646 20 10 CFCDHN CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834817 778959449 /nfs/dbraw/zinc/95/94/49/778959449.db2.gz DHOGOQCDFBAQOL-QGZVFWFLSA-N 0 3 298.386 2.646 20 10 CFCDHN C[N@H+](Cc1cc2ccccc2cc1[O-])[C@H]1CCOC1 ZINC001236834707 778959755 /nfs/dbraw/zinc/95/97/55/778959755.db2.gz FJUWDGOIWIRQNT-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@@H+](Cc1cc2ccccc2cc1[O-])[C@H]1CCOC1 ZINC001236834707 778959761 /nfs/dbraw/zinc/95/97/61/778959761.db2.gz FJUWDGOIWIRQNT-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@]12CCOC2 ZINC001236836434 778960422 /nfs/dbraw/zinc/96/04/22/778960422.db2.gz JGHPGUPTAOUVBD-QGZVFWFLSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@]12CCOC2 ZINC001236836434 778960426 /nfs/dbraw/zinc/96/04/26/778960426.db2.gz JGHPGUPTAOUVBD-QGZVFWFLSA-N 0 3 269.344 2.910 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](O)C2)c([O-])c1 ZINC001237046682 778998774 /nfs/dbraw/zinc/99/87/74/778998774.db2.gz VMCFRBIRRUNKOL-WBMJQRKESA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@@H](O)C2)c([O-])c1 ZINC001237046682 778998779 /nfs/dbraw/zinc/99/87/79/778998779.db2.gz VMCFRBIRRUNKOL-WBMJQRKESA-N 0 3 263.381 2.718 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001237047352 778998920 /nfs/dbraw/zinc/99/89/20/778998920.db2.gz LRYRITBITOCJOU-SWLSCSKDSA-N 0 3 289.375 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001237047352 778998925 /nfs/dbraw/zinc/99/89/25/778998925.db2.gz LRYRITBITOCJOU-SWLSCSKDSA-N 0 3 289.375 2.592 20 10 CFCDHN CC[N@H+](CCOC)Cc1c([O-])cccc1OC(F)(F)F ZINC001237120167 779018307 /nfs/dbraw/zinc/01/83/07/779018307.db2.gz NMXJTOCZRZQLGB-UHFFFAOYSA-N 0 3 293.285 2.759 20 10 CFCDHN CC[N@@H+](CCOC)Cc1c([O-])cccc1OC(F)(F)F ZINC001237120167 779018312 /nfs/dbraw/zinc/01/83/12/779018312.db2.gz NMXJTOCZRZQLGB-UHFFFAOYSA-N 0 3 293.285 2.759 20 10 CFCDHN C[C@H]1CN(Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122498 779019166 /nfs/dbraw/zinc/01/91/66/779019166.db2.gz VECMJKAQVZCDII-VIFPVBQESA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@H]1C[N@H+](Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122498 779019173 /nfs/dbraw/zinc/01/91/73/779019173.db2.gz VECMJKAQVZCDII-VIFPVBQESA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122498 779019179 /nfs/dbraw/zinc/01/91/79/779019179.db2.gz VECMJKAQVZCDII-VIFPVBQESA-N 0 3 273.735 2.796 20 10 CFCDHN CCOC(=O)[C@@H]1CCCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237492444 779120554 /nfs/dbraw/zinc/12/05/54/779120554.db2.gz PZPJOOXKSQOEAY-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)[C@@H]1CCCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237492444 779120555 /nfs/dbraw/zinc/12/05/55/779120555.db2.gz PZPJOOXKSQOEAY-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(C[C@H](F)CO2)CC1 ZINC001237493497 779120601 /nfs/dbraw/zinc/12/06/01/779120601.db2.gz YGLKMIHRUISJDD-ZDUSSCGKSA-N 0 3 279.355 2.794 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001237682064 779161098 /nfs/dbraw/zinc/16/10/98/779161098.db2.gz WKDAYVDWCXVMOT-IAQYHMDHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001237682064 779161101 /nfs/dbraw/zinc/16/11/01/779161101.db2.gz WKDAYVDWCXVMOT-IAQYHMDHSA-N 0 3 283.799 2.947 20 10 CFCDHN CC(=O)[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237688468 779161176 /nfs/dbraw/zinc/16/11/76/779161176.db2.gz JKCHFNJNPCGACX-NSHDSACASA-N 0 3 267.756 2.765 20 10 CFCDHN CC(=O)[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237688468 779161178 /nfs/dbraw/zinc/16/11/78/779161178.db2.gz JKCHFNJNPCGACX-NSHDSACASA-N 0 3 267.756 2.765 20 10 CFCDHN C[C@H]1COCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933626 779209422 /nfs/dbraw/zinc/20/94/22/779209422.db2.gz FDGBISLGHXSQOK-SECBINFHSA-N 0 3 273.735 2.653 20 10 CFCDHN C[C@H]1COCC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933626 779209428 /nfs/dbraw/zinc/20/94/28/779209428.db2.gz FDGBISLGHXSQOK-SECBINFHSA-N 0 3 273.735 2.653 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H](C)[C@](C)(O)CC2)c1[O-] ZINC001238057814 779240821 /nfs/dbraw/zinc/24/08/21/779240821.db2.gz NVDKBYAEKBCRBO-BLLLJJGKSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H](C)[C@](C)(O)CC2)c1[O-] ZINC001238057814 779240827 /nfs/dbraw/zinc/24/08/27/779240827.db2.gz NVDKBYAEKBCRBO-BLLLJJGKSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@H](C)[C@](C)(O)CC2)c1[O-] ZINC001238057816 779241361 /nfs/dbraw/zinc/24/13/61/779241361.db2.gz NVDKBYAEKBCRBO-MLGOLLRUSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)CC2)c1[O-] ZINC001238057816 779241366 /nfs/dbraw/zinc/24/13/66/779241366.db2.gz NVDKBYAEKBCRBO-MLGOLLRUSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c1[O-] ZINC001238067311 779244407 /nfs/dbraw/zinc/24/44/07/779244407.db2.gz NTVBBVAIRSAGJT-CQSZACIVSA-N 0 3 295.354 2.567 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)[C@@H]2CCC3(C2)OCCO3)c1[O-] ZINC001238067311 779244412 /nfs/dbraw/zinc/24/44/12/779244412.db2.gz NTVBBVAIRSAGJT-CQSZACIVSA-N 0 3 295.354 2.567 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1[O-] ZINC001238065368 779244771 /nfs/dbraw/zinc/24/47/71/779244771.db2.gz TZGBFVPKQNAKDS-PWSUYJOCSA-N 0 3 271.282 2.927 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1[O-] ZINC001238065368 779244775 /nfs/dbraw/zinc/24/47/75/779244775.db2.gz TZGBFVPKQNAKDS-PWSUYJOCSA-N 0 3 271.282 2.927 20 10 CFCDHN COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)cc(C)c1[O-] ZINC001238069350 779246104 /nfs/dbraw/zinc/24/61/04/779246104.db2.gz YJYOPKUDLOQOBY-YIONKMFJSA-N 0 3 279.355 2.982 20 10 CFCDHN COC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(F)cc(C)c1[O-] ZINC001238069350 779246111 /nfs/dbraw/zinc/24/61/11/779246111.db2.gz YJYOPKUDLOQOBY-YIONKMFJSA-N 0 3 279.355 2.982 20 10 CFCDHN CCC1(O)CC[NH+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238071014 779246808 /nfs/dbraw/zinc/24/68/08/779246808.db2.gz QWBDJEAEGQNCKG-UHFFFAOYSA-N 0 3 267.344 2.577 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000703109210 780987356 /nfs/dbraw/zinc/98/73/56/780987356.db2.gz ZCTZSTRGBXCYJT-GHMZBOCLSA-N 0 3 267.344 2.997 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1cc(F)ccc1[O-])OCC ZINC000705376943 781140042 /nfs/dbraw/zinc/14/00/42/781140042.db2.gz KQCLVZVPHQXJHP-CYBMUJFWSA-N 0 3 255.333 2.826 20 10 CFCDHN CCc1cccc(C[NH2+]CC(C)(C)C[C@H](C)O)c1[O-] ZINC000709430822 781310768 /nfs/dbraw/zinc/31/07/68/781310768.db2.gz KNZKYNDOVJKWSR-LBPRGKRZSA-N 0 3 265.397 2.841 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2COC3(CCC3)C2)c1[O-] ZINC000711147697 781391481 /nfs/dbraw/zinc/39/14/81/781391481.db2.gz XOSOJTDCWYTAHN-GFCCVEGCSA-N 0 3 297.782 2.855 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)CC(C)(C)O)c([O-])c1 ZINC000295069885 199329844 /nfs/dbraw/zinc/32/98/44/199329844.db2.gz PEKXMQQDIRKBSE-GFCCVEGCSA-N 0 3 281.396 2.820 20 10 CFCDHN [O-]c1ccccc1C[NH+](C[C@@H]1CCCO1)C[C@@H]1CCCO1 ZINC000072952775 346952543 /nfs/dbraw/zinc/95/25/43/346952543.db2.gz DLTDGFUIQAWOFW-HOTGVXAUSA-N 0 3 291.391 2.552 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC[C@H](C)CCO)cc1C ZINC000295127475 199359000 /nfs/dbraw/zinc/35/90/00/199359000.db2.gz OARGAGNLTKSPGF-NSHDSACASA-N 0 3 251.370 2.507 20 10 CFCDHN C[C@@](O)(CNCc1ccc2c(c1)CCO2)c1ccsc1 ZINC000077461180 347193462 /nfs/dbraw/zinc/19/34/62/347193462.db2.gz ZBEIDNHGIJYTNE-MRXNPFEDSA-N 0 3 289.400 2.680 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@@H](CO)C1 ZINC000092763656 347645517 /nfs/dbraw/zinc/64/55/17/347645517.db2.gz LUDNORUEXHMWIT-CQSZACIVSA-N 0 3 283.371 2.873 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@H](CO)C1 ZINC000092763656 347645518 /nfs/dbraw/zinc/64/55/18/347645518.db2.gz LUDNORUEXHMWIT-CQSZACIVSA-N 0 3 283.371 2.873 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)CC2(O)CCCC2)cc1C ZINC000093503071 347677663 /nfs/dbraw/zinc/67/76/63/347677663.db2.gz AOARHPQTKNKJPB-UHFFFAOYSA-N 0 3 263.381 2.746 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)CC2(O)CCCC2)cc1C ZINC000093503071 347677669 /nfs/dbraw/zinc/67/76/69/347677669.db2.gz AOARHPQTKNKJPB-UHFFFAOYSA-N 0 3 263.381 2.746 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccc1 ZINC000206094889 348155818 /nfs/dbraw/zinc/15/58/18/348155818.db2.gz GVTCNXABFJWQNV-INIZCTEOSA-N 0 3 257.333 2.558 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccc1 ZINC000206094889 348155823 /nfs/dbraw/zinc/15/58/23/348155823.db2.gz GVTCNXABFJWQNV-INIZCTEOSA-N 0 3 257.333 2.558 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2cscn2)c1 ZINC000104448654 186006242 /nfs/dbraw/zinc/00/62/42/186006242.db2.gz LDVLRMSKWRFWJK-JTQLQIEISA-N 0 3 278.377 2.751 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](C)CCO)c1ccccc1[O-] ZINC000295178859 199390946 /nfs/dbraw/zinc/39/09/46/199390946.db2.gz VHZMZMCGIGEBSM-JSGCOSHPSA-N 0 3 251.370 2.842 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCCCO)c([O-])c1 ZINC000294512597 199068214 /nfs/dbraw/zinc/06/82/14/199068214.db2.gz YTJNVWOCZZCHTM-ZDUSSCGKSA-N 0 3 251.370 2.822 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CCCCO)c1 ZINC000294925292 199251647 /nfs/dbraw/zinc/25/16/47/199251647.db2.gz BEVJGQHTUGXIRJ-VXGBXAGGSA-N 0 3 267.369 2.603 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)CC2 ZINC000297161744 200101776 /nfs/dbraw/zinc/10/17/76/200101776.db2.gz CWGCZJCPVDDQAP-HOTGVXAUSA-N 0 3 283.371 2.573 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000020092000 372228055 /nfs/dbraw/zinc/22/80/55/372228055.db2.gz IKZGMFLHAAAXCA-KBPBESRZSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1ccccc1[O-] ZINC000036996985 372625002 /nfs/dbraw/zinc/62/50/02/372625002.db2.gz BPYFCLXCAUKXSE-NWANDNLSSA-N 0 3 260.381 2.670 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2ccsc2)c1 ZINC000042599865 372936856 /nfs/dbraw/zinc/93/68/56/372936856.db2.gz VOXVVKMDXZSYMS-UHFFFAOYSA-N 0 3 263.362 2.795 20 10 CFCDHN CCC[C@H](CC)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000050402772 373374292 /nfs/dbraw/zinc/37/42/92/373374292.db2.gz ZNNROJMMNVEREJ-NSHDSACASA-N 0 3 251.326 2.789 20 10 CFCDHN CCOC(=O)C1CCN(Cc2cc(C)c(C)cc2O)CC1 ZINC000057394979 373591831 /nfs/dbraw/zinc/59/18/31/373591831.db2.gz DUPWEXRDUVQORA-UHFFFAOYSA-N 0 3 291.391 2.784 20 10 CFCDHN CCOC(=O)C1CC[NH+](Cc2cc(C)c(C)cc2[O-])CC1 ZINC000057394979 373591834 /nfs/dbraw/zinc/59/18/34/373591834.db2.gz DUPWEXRDUVQORA-UHFFFAOYSA-N 0 3 291.391 2.784 20 10 CFCDHN Cc1nn(C)c(C)c1CN[C@@H](C)c1cc(C)ccc1O ZINC000092324427 375102196 /nfs/dbraw/zinc/10/21/96/375102196.db2.gz PKHSUWHJTZQKGQ-NSHDSACASA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000092324427 375102203 /nfs/dbraw/zinc/10/22/03/375102203.db2.gz PKHSUWHJTZQKGQ-NSHDSACASA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1noc([C@H]2CCC[N@H+](Cc3cc(C)ccc3[O-])C2)n1 ZINC000091833160 375063499 /nfs/dbraw/zinc/06/34/99/375063499.db2.gz QHDOCBNYMXSPLI-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@H]2CCC[N@@H+](Cc3cc(C)ccc3[O-])C2)n1 ZINC000091833160 375063506 /nfs/dbraw/zinc/06/35/06/375063506.db2.gz QHDOCBNYMXSPLI-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN CN(C)c1ccc(CN2CCC(n3ccnc3)CC2)cc1 ZINC000092648310 375135511 /nfs/dbraw/zinc/13/55/11/375135511.db2.gz PICWHVORYKQSSU-UHFFFAOYSA-N 0 3 284.407 2.786 20 10 CFCDHN CCCN(Cc1ccnn1C)Cc1ccccc1O ZINC000092705027 375139645 /nfs/dbraw/zinc/13/96/45/375139645.db2.gz MCBSZPZWDPHSQS-UHFFFAOYSA-N 0 3 259.353 2.538 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@@H](C(C)C)C2)c1[O-] ZINC000093869256 375326250 /nfs/dbraw/zinc/32/62/50/375326250.db2.gz KKPIAUYFVOMTPB-CQSZACIVSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@@H](C(C)C)C2)c1[O-] ZINC000093869256 375326254 /nfs/dbraw/zinc/32/62/54/375326254.db2.gz KKPIAUYFVOMTPB-CQSZACIVSA-N 0 3 281.421 2.974 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](O)C(CC)CC)c1[O-] ZINC000111404448 375844759 /nfs/dbraw/zinc/84/47/59/375844759.db2.gz LSFCDDKKIYHUJI-AWEZNQCLSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1ccsc1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000112017563 375877491 /nfs/dbraw/zinc/87/74/91/375877491.db2.gz PSTMQTFCJPRPHT-UHFFFAOYSA-N 0 3 277.345 2.781 20 10 CFCDHN COC[C@@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000113355652 376011332 /nfs/dbraw/zinc/01/13/32/376011332.db2.gz OBTMKFIVYZOPID-OAHLLOKOSA-N 0 3 257.333 2.870 20 10 CFCDHN Cc1cccc(C[NH2+]CC2(N(C)C)CCCC2)c1[O-] ZINC000124672175 377074808 /nfs/dbraw/zinc/07/48/08/377074808.db2.gz QOJHKQDNRUKMKK-UHFFFAOYSA-N 0 3 262.397 2.665 20 10 CFCDHN CCCOc1ccc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([O-])c1 ZINC000126755448 377245815 /nfs/dbraw/zinc/24/58/15/377245815.db2.gz FUGKLAGJKRATBA-YIONKMFJSA-N 0 3 291.391 2.669 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([O-])c1 ZINC000126755448 377245822 /nfs/dbraw/zinc/24/58/22/377245822.db2.gz FUGKLAGJKRATBA-YIONKMFJSA-N 0 3 291.391 2.669 20 10 CFCDHN C[C@H](CO)N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000129302697 377409519 /nfs/dbraw/zinc/40/95/19/377409519.db2.gz LYSNFEQSXMFSIV-OLZOCXBDSA-N 0 3 280.387 2.847 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@@H](C)[C@@H]2C)c1 ZINC000180311487 295165958 /nfs/dbraw/zinc/16/59/58/295165958.db2.gz JPJANEHGGDQLAO-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCc1ccc2c(c1)CCO2 ZINC000134650348 378041407 /nfs/dbraw/zinc/04/14/07/378041407.db2.gz UDSFQMXHPMEXDF-UHFFFAOYSA-N 0 3 269.344 2.659 20 10 CFCDHN CC[C@H](NCc1cnn(C)c1)c1ccc(N(C)C)cc1 ZINC000151151185 378302274 /nfs/dbraw/zinc/30/22/74/378302274.db2.gz MLMUHIYKXIBYEG-INIZCTEOSA-N 0 3 272.396 2.727 20 10 CFCDHN CN(Cc1ccc(N(C)C)cc1)CC1=CCCOC1 ZINC000155184359 378615800 /nfs/dbraw/zinc/61/58/00/378615800.db2.gz YVNFEZLCEIMUIL-UHFFFAOYSA-N 0 3 260.381 2.531 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(CCOC)CC1)c1ccccc1[O-] ZINC000155317266 378621418 /nfs/dbraw/zinc/62/14/18/378621418.db2.gz HWFHPINEBNDGKD-INIZCTEOSA-N 0 3 292.423 2.544 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[N@H+](C)Cc1ccccc1[O-] ZINC000179584273 380561029 /nfs/dbraw/zinc/56/10/29/380561029.db2.gz RCABAPAUDQOVEE-AWEZNQCLSA-N 0 3 271.364 2.635 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccccc1[O-] ZINC000179584273 380561035 /nfs/dbraw/zinc/56/10/35/380561035.db2.gz RCABAPAUDQOVEE-AWEZNQCLSA-N 0 3 271.364 2.635 20 10 CFCDHN CC[C@@H](CSC)[N@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000179787493 380580001 /nfs/dbraw/zinc/58/00/01/380580001.db2.gz WUHQVOQJZABIKR-LBPRGKRZSA-N 0 3 299.436 2.983 20 10 CFCDHN CC[C@@H](CSC)[N@@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000179787493 380580005 /nfs/dbraw/zinc/58/00/05/380580005.db2.gz WUHQVOQJZABIKR-LBPRGKRZSA-N 0 3 299.436 2.983 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC000180208060 380634632 /nfs/dbraw/zinc/63/46/32/380634632.db2.gz VZNUOCUZXJUAFJ-ZDUSSCGKSA-N 0 3 277.364 2.556 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000180208060 380634635 /nfs/dbraw/zinc/63/46/35/380634635.db2.gz VZNUOCUZXJUAFJ-ZDUSSCGKSA-N 0 3 277.364 2.556 20 10 CFCDHN CCC[N@H+](C)C[C@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180215318 380634866 /nfs/dbraw/zinc/63/48/66/380634866.db2.gz PCAYMTRDJSYXFE-CYBMUJFWSA-N 0 3 280.387 2.695 20 10 CFCDHN CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180215318 380634870 /nfs/dbraw/zinc/63/48/70/380634870.db2.gz PCAYMTRDJSYXFE-CYBMUJFWSA-N 0 3 280.387 2.695 20 10 CFCDHN C[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccccc1[O-] ZINC000179899403 380593567 /nfs/dbraw/zinc/59/35/67/380593567.db2.gz FSWLASCCKLYYGC-DYVFJYSZSA-N 0 3 271.360 2.951 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000179903007 380595968 /nfs/dbraw/zinc/59/59/68/380595968.db2.gz KTEVSFPBNSKMRT-SJKOYZFVSA-N 0 3 287.359 2.785 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1 ZINC000179963900 380604213 /nfs/dbraw/zinc/60/42/13/380604213.db2.gz CSNQUFIVBFPSBW-CYBMUJFWSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1 ZINC000179963900 380604217 /nfs/dbraw/zinc/60/42/17/380604217.db2.gz CSNQUFIVBFPSBW-CYBMUJFWSA-N 0 3 291.391 2.864 20 10 CFCDHN CC[N@@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCO1 ZINC000179975064 380604944 /nfs/dbraw/zinc/60/49/44/380604944.db2.gz MTHIYOSPCQVTIL-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[N@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCO1 ZINC000179975064 380604948 /nfs/dbraw/zinc/60/49/48/380604948.db2.gz MTHIYOSPCQVTIL-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN COCCCOC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000180180394 380629384 /nfs/dbraw/zinc/62/93/84/380629384.db2.gz CGMQAPSMIDRBEY-UHFFFAOYSA-N 0 3 297.370 2.549 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2cc(F)ccc2[O-])c(C)o1 ZINC000180796507 380701273 /nfs/dbraw/zinc/70/12/73/380701273.db2.gz YZUZORLIHPFMGF-INIZCTEOSA-N 0 3 293.338 2.738 20 10 CFCDHN CCOCC[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000181482114 380802767 /nfs/dbraw/zinc/80/27/67/380802767.db2.gz MWDJBFQFJRBWBN-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN CCOCC[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000181482114 380802771 /nfs/dbraw/zinc/80/27/71/380802771.db2.gz MWDJBFQFJRBWBN-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN C[N@H+](CCC(=O)OCc1ccccc1)Cc1ccccc1[O-] ZINC000181485040 380805349 /nfs/dbraw/zinc/80/53/49/380805349.db2.gz RBRIQYOQDHOQMS-UHFFFAOYSA-N 0 3 299.370 2.958 20 10 CFCDHN C[N@@H+](CCC(=O)OCc1ccccc1)Cc1ccccc1[O-] ZINC000181485040 380805354 /nfs/dbraw/zinc/80/53/54/380805354.db2.gz RBRIQYOQDHOQMS-UHFFFAOYSA-N 0 3 299.370 2.958 20 10 CFCDHN COC(=O)c1cnc(SCC[C@@H]2CCCN2C)s1 ZINC000295433526 380851113 /nfs/dbraw/zinc/85/11/13/380851113.db2.gz ZGMLYMFHALKQOC-VIFPVBQESA-N 0 3 286.422 2.506 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1ccccc1 ZINC000288432343 381013438 /nfs/dbraw/zinc/01/34/38/381013438.db2.gz BTQWBOUPYWEAGY-WBMJQRKESA-N 0 3 257.333 2.604 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c1 ZINC000288614735 381017463 /nfs/dbraw/zinc/01/74/63/381017463.db2.gz QXZQIQPGCDRVCQ-SUMWQHHRSA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C2 ZINC000368315608 380986798 /nfs/dbraw/zinc/98/67/98/380986798.db2.gz LAHQRJZXUXKYND-ZIAGYGMSSA-N 0 3 285.391 2.871 20 10 CFCDHN CC[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000182441001 381089352 /nfs/dbraw/zinc/08/93/52/381089352.db2.gz RPJLCPIUMIMAFB-CYBMUJFWSA-N 0 3 257.761 2.605 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc3c(c1)OCO3)CC2 ZINC000295816712 381094948 /nfs/dbraw/zinc/09/49/48/381094948.db2.gz DAQRIKJFRRAORZ-CYBMUJFWSA-N 0 3 283.327 2.898 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295926010 381160977 /nfs/dbraw/zinc/16/09/77/381160977.db2.gz JYVASZFKKGNBLN-ZIAGYGMSSA-N 0 3 283.375 2.780 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)c1cccc(F)c1)CC2 ZINC000295999222 381205210 /nfs/dbraw/zinc/20/52/10/381205210.db2.gz OFOQGMYATCLYGD-ZBFHGGJFSA-N 0 3 287.334 2.842 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])[nH]n1 ZINC000183621607 381295289 /nfs/dbraw/zinc/29/52/89/381295289.db2.gz ANEPZKSBWRDJBH-JQWIXIFHSA-N 0 3 259.353 2.706 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])n[nH]1 ZINC000183621607 381295297 /nfs/dbraw/zinc/29/52/97/381295297.db2.gz ANEPZKSBWRDJBH-JQWIXIFHSA-N 0 3 259.353 2.706 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(c2ccccn2)C1)c1ccccc1[O-] ZINC000183628818 381297179 /nfs/dbraw/zinc/29/71/79/381297179.db2.gz HZLWTVWHFVZOPA-KGLIPLIRSA-N 0 3 283.375 2.717 20 10 CFCDHN CCCN1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000183440806 381271715 /nfs/dbraw/zinc/27/17/15/381271715.db2.gz LOPBFDOOJCRCFI-KBPBESRZSA-N 0 3 262.397 2.775 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccccc1[O-] ZINC000183487338 381276556 /nfs/dbraw/zinc/27/65/56/381276556.db2.gz DKQVDWWUYIFLOJ-LRDDRELGSA-N 0 3 263.381 2.984 20 10 CFCDHN COCCCN1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000183484511 381277020 /nfs/dbraw/zinc/27/70/20/381277020.db2.gz YWSHIPJJSVFOCU-CQSZACIVSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccccc1[O-] ZINC000183527762 381284626 /nfs/dbraw/zinc/28/46/26/381284626.db2.gz WWIQGAKHDRGSPO-LVGORTOPSA-N 0 3 261.365 2.856 20 10 CFCDHN COc1cccc(CN(C)[C@@H](C)c2cccnc2)c1O ZINC000183730578 381311818 /nfs/dbraw/zinc/31/18/18/381311818.db2.gz JTPMSMDJKWIZLS-LBPRGKRZSA-N 0 3 272.348 2.989 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000296369693 381366142 /nfs/dbraw/zinc/36/61/42/381366142.db2.gz JEAUQVFTDSOMBX-FFHGMXDLSA-N 0 3 274.408 2.976 20 10 CFCDHN Cn1cc2c(n1)CCC[C@H]2[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296470106 381409619 /nfs/dbraw/zinc/40/96/19/381409619.db2.gz OJHCHLYFXLLAHQ-HIFRSBDPSA-N 0 3 283.375 2.780 20 10 CFCDHN Cn1cc2c(n1)CCC[C@@H]2[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296470119 381410976 /nfs/dbraw/zinc/41/09/76/381410976.db2.gz OJHCHLYFXLLAHQ-ZFWWWQNUSA-N 0 3 283.375 2.780 20 10 CFCDHN CCOCC[N@H+](CC)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184684102 381461076 /nfs/dbraw/zinc/46/10/76/381461076.db2.gz USNNSQUZXZIKHD-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184684102 381461082 /nfs/dbraw/zinc/46/10/82/381461082.db2.gz USNNSQUZXZIKHD-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000184695473 381463129 /nfs/dbraw/zinc/46/31/29/381463129.db2.gz URFCIHLHQOTLLU-ZWNOBZJWSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000184695473 381463135 /nfs/dbraw/zinc/46/31/35/381463135.db2.gz URFCIHLHQOTLLU-ZWNOBZJWSA-N 0 3 299.798 2.790 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)CCCO)c1 ZINC000296662259 381497422 /nfs/dbraw/zinc/49/74/22/381497422.db2.gz ZXOVREROLOYBET-QWHCGFSZSA-N 0 3 251.370 2.760 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])c1 ZINC000185150431 381546745 /nfs/dbraw/zinc/54/67/45/381546745.db2.gz JCBKTDRGRRQUCX-CYBMUJFWSA-N 0 3 298.386 2.911 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCNC(=O)c2ccccc2)c1 ZINC000185202991 381562816 /nfs/dbraw/zinc/56/28/16/381562816.db2.gz MOVJPCZZTXIXGT-CQSZACIVSA-N 0 3 298.386 2.781 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000371316001 381589362 /nfs/dbraw/zinc/58/93/62/381589362.db2.gz ZADWHHWQINKTJL-KGLIPLIRSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000371316001 381589367 /nfs/dbraw/zinc/58/93/67/381589367.db2.gz ZADWHHWQINKTJL-KGLIPLIRSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c([O-])c1 ZINC000185369137 381614537 /nfs/dbraw/zinc/61/45/37/381614537.db2.gz KDTQMKYOAVUULN-OLZOCXBDSA-N 0 3 262.397 2.834 20 10 CFCDHN CC[C@H](C)[C@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185439518 381631935 /nfs/dbraw/zinc/63/19/35/381631935.db2.gz ODQNKYGDVUFTLX-PKFCDNJMSA-N 0 3 255.333 2.589 20 10 CFCDHN CC[C@H](C)[C@H](O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000185438494 381632513 /nfs/dbraw/zinc/63/25/13/381632513.db2.gz QJXIAGAOOYGMHQ-SLEUVZQESA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c1 ZINC000185474849 381644881 /nfs/dbraw/zinc/64/48/81/381644881.db2.gz CUMJPXJJXLONOX-CWTRNNRKSA-N 0 3 283.437 2.898 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccsc1)c1cc(F)ccc1[O-] ZINC000185513977 381655389 /nfs/dbraw/zinc/65/53/89/381655389.db2.gz XUZLNUDEYYMRRJ-XPTSAGLGSA-N 0 3 281.352 2.977 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)C[C@@H](C)O)c1 ZINC000185521042 381657196 /nfs/dbraw/zinc/65/71/96/381657196.db2.gz YQSKMEWFMZRABK-JHJVBQTASA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000185535115 381660196 /nfs/dbraw/zinc/66/01/96/381660196.db2.gz UWJTVBDWXBNCNB-YIVQXAGMSA-N 0 3 279.355 2.995 20 10 CFCDHN CCOC(=O)C1(C)CC[NH+](Cc2ccccc2[O-])CC1 ZINC000371617029 381665927 /nfs/dbraw/zinc/66/59/27/381665927.db2.gz SKKCMRQVBPXTCB-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCCC[C@H]1Cn1cccn1 ZINC000371529769 381652168 /nfs/dbraw/zinc/65/21/68/381652168.db2.gz UYURRLKYQFGPBV-HNNXBMFYSA-N 0 3 271.364 2.643 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCCC[C@H]1Cn1cccn1 ZINC000371529769 381652175 /nfs/dbraw/zinc/65/21/75/381652175.db2.gz UYURRLKYQFGPBV-HNNXBMFYSA-N 0 3 271.364 2.643 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c([O-])c1 ZINC000185672512 381700209 /nfs/dbraw/zinc/70/02/09/381700209.db2.gz CYJZYHSHYBENRF-IHRRRGAJSA-N 0 3 274.408 2.976 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])[nH]n1 ZINC000186131633 381830057 /nfs/dbraw/zinc/83/00/57/381830057.db2.gz ZBPPQMHBZPDLPM-KOLCDFICSA-N 0 3 277.343 2.845 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])n[nH]1 ZINC000186131633 381830061 /nfs/dbraw/zinc/83/00/61/381830061.db2.gz ZBPPQMHBZPDLPM-KOLCDFICSA-N 0 3 277.343 2.845 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCCC23CCC3)cc1OC ZINC000372971272 381900761 /nfs/dbraw/zinc/90/07/61/381900761.db2.gz BNHGRDZJLUBHFZ-UHFFFAOYSA-N 0 3 277.364 2.928 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCCC23CCC3)cc1OC ZINC000372971272 381900769 /nfs/dbraw/zinc/90/07/69/381900769.db2.gz BNHGRDZJLUBHFZ-UHFFFAOYSA-N 0 3 277.364 2.928 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000186444692 381913606 /nfs/dbraw/zinc/91/36/06/381913606.db2.gz LZTNXYFMIBJKJD-OLZOCXBDSA-N 0 3 292.379 2.582 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000373253421 381962021 /nfs/dbraw/zinc/96/20/21/381962021.db2.gz UPZFOAFBHVECLS-ZDUSSCGKSA-N 0 3 279.355 2.780 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1[O-] ZINC000373222395 381953700 /nfs/dbraw/zinc/95/37/00/381953700.db2.gz CDODVSZUTMMBIG-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1[O-] ZINC000373222395 381953706 /nfs/dbraw/zinc/95/37/06/381953706.db2.gz CDODVSZUTMMBIG-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCCCS(C)(=O)=O)c1 ZINC000186862163 382031984 /nfs/dbraw/zinc/03/19/84/382031984.db2.gz NTASVDDYYOLELM-CYBMUJFWSA-N 0 3 299.436 2.566 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@]2(CCOC2)C1 ZINC000375978044 382112714 /nfs/dbraw/zinc/11/27/14/382112714.db2.gz VZGWUMOTEOHNHN-GOEBONIOSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000375978044 382112720 /nfs/dbraw/zinc/11/27/20/382112720.db2.gz VZGWUMOTEOHNHN-GOEBONIOSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000375978046 382113396 /nfs/dbraw/zinc/11/33/96/382113396.db2.gz VZGWUMOTEOHNHN-ZBFHGGJFSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@]2(CCOC2)C1 ZINC000375978046 382113399 /nfs/dbraw/zinc/11/33/99/382113399.db2.gz VZGWUMOTEOHNHN-ZBFHGGJFSA-N 0 3 261.365 2.956 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC000375303099 382079400 /nfs/dbraw/zinc/07/94/00/382079400.db2.gz NAQKWKSSQPXGEU-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC000375303099 382079404 /nfs/dbraw/zinc/07/94/04/382079404.db2.gz NAQKWKSSQPXGEU-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN CCC[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])OC ZINC000293622444 382201416 /nfs/dbraw/zinc/20/14/16/382201416.db2.gz IKURDQNCONDWDZ-PWSUYJOCSA-N 0 3 255.333 2.997 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000293693176 382236955 /nfs/dbraw/zinc/23/69/55/382236955.db2.gz LHGNBYRASCWXPY-RYUDHWBXSA-N 0 3 296.386 2.734 20 10 CFCDHN COCC1=CCN(Cc2ccc(N(C)C)cc2)CC1 ZINC000187617214 382226690 /nfs/dbraw/zinc/22/66/90/382226690.db2.gz OJPARCWDHNFBQM-UHFFFAOYSA-N 0 3 260.381 2.531 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](O)C23CCCC3)c1 ZINC000293808389 382287693 /nfs/dbraw/zinc/28/76/93/382287693.db2.gz DUHACRYRECVKNO-HNNXBMFYSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](O)C23CCCC3)c1 ZINC000293808389 382287699 /nfs/dbraw/zinc/28/76/99/382287699.db2.gz DUHACRYRECVKNO-HNNXBMFYSA-N 0 3 261.365 2.580 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293814891 382290299 /nfs/dbraw/zinc/29/02/99/382290299.db2.gz RTRMJEKSGARAJZ-UONOGXRCSA-N 0 3 292.423 2.964 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](n3cncn3)C2)cc1 ZINC000377282378 382248552 /nfs/dbraw/zinc/24/85/52/382248552.db2.gz FAFHBHROYJNCRT-KRWDZBQOSA-N 0 3 299.422 2.571 20 10 CFCDHN COC[C@@H]1CCN1Cc1ccc(N2CCCCC2)cc1 ZINC000293722519 382250700 /nfs/dbraw/zinc/25/07/00/382250700.db2.gz UCRZNXRLPONBSD-KRWDZBQOSA-N 0 3 274.408 2.898 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1[O-] ZINC000293751087 382262861 /nfs/dbraw/zinc/26/28/61/382262861.db2.gz RISQHFIQLPBZQZ-JSGCOSHPSA-N 0 3 250.386 2.631 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]1Cn1cncn1 ZINC000377694615 382321742 /nfs/dbraw/zinc/32/17/42/382321742.db2.gz HBGXVTSHEOTEIY-ZFWWWQNUSA-N 0 3 286.379 2.599 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H]1Cn1cncn1 ZINC000377694615 382321750 /nfs/dbraw/zinc/32/17/50/382321750.db2.gz HBGXVTSHEOTEIY-ZFWWWQNUSA-N 0 3 286.379 2.599 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2CCO)c1 ZINC000188009325 382324129 /nfs/dbraw/zinc/32/41/29/382324129.db2.gz DVGGBEWPGPXISH-YWPYICTPSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000188267260 382379945 /nfs/dbraw/zinc/37/99/45/382379945.db2.gz HXAQNXUKSBERJK-QGZVFWFLSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c1[O-] ZINC000188568517 382436271 /nfs/dbraw/zinc/43/62/71/382436271.db2.gz RVPCKYHLKVRDFC-UPJWGTAASA-N 0 3 297.782 2.711 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C1CCN(c2ccccn2)CC1 ZINC000378372233 382449565 /nfs/dbraw/zinc/44/95/65/382449565.db2.gz AIGWIVMJRISALR-UHFFFAOYSA-N 0 3 297.402 2.888 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C1CCN(c2ccccn2)CC1 ZINC000378372233 382449569 /nfs/dbraw/zinc/44/95/69/382449569.db2.gz AIGWIVMJRISALR-UHFFFAOYSA-N 0 3 297.402 2.888 20 10 CFCDHN [O-]c1c(F)cccc1CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000378488528 382471601 /nfs/dbraw/zinc/47/16/01/382471601.db2.gz BFHNILLFJPJRCH-OAHLLOKOSA-N 0 3 292.398 2.982 20 10 CFCDHN CCOc1ccc(O)c(CN2CCC[C@H]3OCC[C@H]32)c1 ZINC000366269565 382494759 /nfs/dbraw/zinc/49/47/59/382494759.db2.gz MUATURNIHNSOPA-GDBMZVCRSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2cc(C)ccc2[O-])C1 ZINC000188786543 382475809 /nfs/dbraw/zinc/47/58/09/382475809.db2.gz QPHFXUVCFFKPJV-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000378631876 382496224 /nfs/dbraw/zinc/49/62/24/382496224.db2.gz KDGVIZSNYHMRMH-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN CCN1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263486 382485609 /nfs/dbraw/zinc/48/56/09/382485609.db2.gz NYMUDHYPCUWEAN-JTQLQIEISA-N 0 3 286.778 2.616 20 10 CFCDHN CC[N@@H+]1CC[C@@H](CNCc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263486 382485615 /nfs/dbraw/zinc/48/56/15/382485615.db2.gz NYMUDHYPCUWEAN-JTQLQIEISA-N 0 3 286.778 2.616 20 10 CFCDHN CC[N@H+]1CC[C@@H](CNCc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263486 382485618 /nfs/dbraw/zinc/48/56/18/382485618.db2.gz NYMUDHYPCUWEAN-JTQLQIEISA-N 0 3 286.778 2.616 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)cc1C ZINC000366651567 382540193 /nfs/dbraw/zinc/54/01/93/382540193.db2.gz IIDJAJJMOZHUOT-HUUCEWRRSA-N 0 3 275.392 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)cc1C ZINC000366651567 382540197 /nfs/dbraw/zinc/54/01/97/382540197.db2.gz IIDJAJJMOZHUOT-HUUCEWRRSA-N 0 3 275.392 2.867 20 10 CFCDHN CCOc1ccc(O)c(CN[C@H](C)c2cnn(CC)c2)c1 ZINC000294929709 382544738 /nfs/dbraw/zinc/54/47/38/382544738.db2.gz UKYTXRATVKYTRU-GFCCVEGCSA-N 0 3 289.379 2.858 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2ncccc2C)c1 ZINC000294928174 382545010 /nfs/dbraw/zinc/54/50/10/382545010.db2.gz GBCITMMPLFWJBR-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@]2(CCO[C@@H]2C)C1 ZINC000367294853 382562577 /nfs/dbraw/zinc/56/25/77/382562577.db2.gz NKOQMNZZRCUELY-UNEWFSDZSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@]2(CCO[C@@H]2C)C1 ZINC000367294853 382562580 /nfs/dbraw/zinc/56/25/80/382562580.db2.gz NKOQMNZZRCUELY-UNEWFSDZSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@@H](COCC(F)(F)F)[NH2+]Cc1cc(F)ccc1[O-] ZINC000295208211 382584388 /nfs/dbraw/zinc/58/43/88/382584388.db2.gz ZRNBSDBDIOTVBP-NSHDSACASA-N 0 3 295.276 2.978 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CC2(O)CCCCCC2)c1 ZINC000190139799 382654462 /nfs/dbraw/zinc/65/44/62/382654462.db2.gz XNOXLWXMXUNCKG-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CC2(O)CCCCCC2)c1 ZINC000190139799 382654463 /nfs/dbraw/zinc/65/44/63/382654463.db2.gz XNOXLWXMXUNCKG-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c([O-])c1 ZINC000190347391 382663243 /nfs/dbraw/zinc/66/32/43/382663243.db2.gz GQUDZUUJLLSUFU-BFYDXBDKSA-N 0 3 291.391 2.838 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c1 ZINC000251685377 383393706 /nfs/dbraw/zinc/39/37/06/383393706.db2.gz JENGNLPZQBTFGD-SFXCNKRSSA-N 0 3 277.364 2.619 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)=O)C1)c1ccccc1[O-] ZINC000281260554 385187600 /nfs/dbraw/zinc/18/76/00/385187600.db2.gz WMHFUWCENNCZRK-HOCLYGCPSA-N 0 3 290.407 2.691 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCN(C(C)=O)C1)c1ccccc1[O-] ZINC000281260558 385189796 /nfs/dbraw/zinc/18/97/96/385189796.db2.gz WMHFUWCENNCZRK-ZBFHGGJFSA-N 0 3 290.407 2.691 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)CCCSC)cc1OC ZINC000281306480 385189938 /nfs/dbraw/zinc/18/99/38/385189938.db2.gz QBNXZRLEANSACX-UHFFFAOYSA-N 0 3 285.409 2.594 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)CCCSC)cc1OC ZINC000281306480 385189942 /nfs/dbraw/zinc/18/99/42/385189942.db2.gz QBNXZRLEANSACX-UHFFFAOYSA-N 0 3 285.409 2.594 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(COC)CCC2)c1[O-] ZINC000282046246 385207777 /nfs/dbraw/zinc/20/77/77/385207777.db2.gz PAJHZILLSKAZCR-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000282180288 385237729 /nfs/dbraw/zinc/23/77/29/385237729.db2.gz FQEUMVUMHXUIRW-MFKMUULPSA-N 0 3 253.317 2.531 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000282180288 385237732 /nfs/dbraw/zinc/23/77/32/385237732.db2.gz FQEUMVUMHXUIRW-MFKMUULPSA-N 0 3 253.317 2.531 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H]2CCC(F)(F)C2)c1[O-] ZINC000281823935 385204836 /nfs/dbraw/zinc/20/48/36/385204836.db2.gz WRLGXQDTOFECLK-JTQLQIEISA-N 0 3 271.307 2.926 20 10 CFCDHN CC[C@@H](NCc1ccc(N(C)C)cc1)[C@H](O)C(F)(F)F ZINC000271026947 385307858 /nfs/dbraw/zinc/30/78/58/385307858.db2.gz VYGGJIMRKKUPFV-OLZOCXBDSA-N 0 3 290.329 2.544 20 10 CFCDHN CCCC[N@H+](CCc1cnn(C)c1)Cc1ccccc1[O-] ZINC000282426749 385308064 /nfs/dbraw/zinc/30/80/64/385308064.db2.gz JUTHFOJWRBEHBM-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN CCCC[N@@H+](CCc1cnn(C)c1)Cc1ccccc1[O-] ZINC000282426749 385308068 /nfs/dbraw/zinc/30/80/68/385308068.db2.gz JUTHFOJWRBEHBM-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN CCCC[N@H+](CCN1CCCC1=O)Cc1ccccc1[O-] ZINC000282552324 385339930 /nfs/dbraw/zinc/33/99/30/385339930.db2.gz XHWBGBKDRLXIJX-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN CCCC[N@@H+](CCN1CCCC1=O)Cc1ccccc1[O-] ZINC000282552324 385339933 /nfs/dbraw/zinc/33/99/33/385339933.db2.gz XHWBGBKDRLXIJX-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN CCC[N@H+](CC)Cc1cc(OC)c(OC)cc1[O-] ZINC000271117786 385341405 /nfs/dbraw/zinc/34/14/05/385341405.db2.gz WXLHQSKCWKMRMI-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCC[N@@H+](CC)Cc1cc(OC)c(OC)cc1[O-] ZINC000271117786 385341409 /nfs/dbraw/zinc/34/14/09/385341409.db2.gz WXLHQSKCWKMRMI-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CC[C@H]([NH2+]CCn1ccnc1C)c1ccccc1[O-] ZINC000271733413 385390004 /nfs/dbraw/zinc/39/00/04/385390004.db2.gz SXKMXKMIUIEJIY-AWEZNQCLSA-N 0 3 259.353 2.638 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H]2CCO[C@H](C)C2)c1 ZINC000271569579 385385438 /nfs/dbraw/zinc/38/54/38/385385438.db2.gz WXOFIGOLAFRWNZ-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1cccc(C)c1[O-] ZINC000271804354 385392314 /nfs/dbraw/zinc/39/23/14/385392314.db2.gz JRKVFAALYFCQJO-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)C2)c1[O-] ZINC000271799117 385392328 /nfs/dbraw/zinc/39/23/28/385392328.db2.gz KXUXFSXJGMHUGI-LLVKDONJSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)C2)c1[O-] ZINC000271799117 385392331 /nfs/dbraw/zinc/39/23/31/385392331.db2.gz KXUXFSXJGMHUGI-LLVKDONJSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CCC[C@@H]2O)c1[O-] ZINC000271797298 385392824 /nfs/dbraw/zinc/39/28/24/385392824.db2.gz KGBHKOKGDLPXRP-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1[O-] ZINC000271797298 385392828 /nfs/dbraw/zinc/39/28/28/385392828.db2.gz KGBHKOKGDLPXRP-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@](C)(CO)C2CCCCC2)c1 ZINC000271873176 385395842 /nfs/dbraw/zinc/39/58/42/385395842.db2.gz YNEWKEJCIQFNIX-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN Cc1cc(C)cc([C@H](O)C[NH2+]Cc2ccccc2[O-])c1 ZINC000283129305 385439992 /nfs/dbraw/zinc/43/99/92/385439992.db2.gz ZPNFVYWRXKKIDX-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](Oc2ccccn2)C1 ZINC000272333807 385513687 /nfs/dbraw/zinc/51/36/87/385513687.db2.gz XCLLHFQLZMFNBV-AWEZNQCLSA-N 0 3 288.322 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](Oc2ccccn2)C1 ZINC000272333807 385513693 /nfs/dbraw/zinc/51/36/93/385513693.db2.gz XCLLHFQLZMFNBV-AWEZNQCLSA-N 0 3 288.322 2.580 20 10 CFCDHN Cc1cc(C)c([C@@H](C)NCc2ccnn2C)c(O)c1 ZINC000283691641 385490161 /nfs/dbraw/zinc/49/01/61/385490161.db2.gz AHXNKMSRKCNOMJ-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccnn2C)c([O-])c1 ZINC000283691641 385490163 /nfs/dbraw/zinc/49/01/63/385490163.db2.gz AHXNKMSRKCNOMJ-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284086015 385533277 /nfs/dbraw/zinc/53/32/77/385533277.db2.gz MAJLTDZFMOPLGA-CYBMUJFWSA-N 0 3 273.380 2.865 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284301646 385547377 /nfs/dbraw/zinc/54/73/77/385547377.db2.gz BPKUHTSWIVBOIC-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284301646 385547378 /nfs/dbraw/zinc/54/73/78/385547378.db2.gz BPKUHTSWIVBOIC-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000272394941 385527269 /nfs/dbraw/zinc/52/72/69/385527269.db2.gz HXXIPKABSMAEBD-CABCVRRESA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000272394941 385527271 /nfs/dbraw/zinc/52/72/71/385527271.db2.gz HXXIPKABSMAEBD-CABCVRRESA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)CC[S@@](C)=O)c([O-])c1 ZINC000285008401 385551792 /nfs/dbraw/zinc/55/17/92/385551792.db2.gz HBLVWTCXJQWMSG-WTOJCKNJSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2([S@](C)=O)CCC2)c([O-])c1 ZINC000285219841 385552424 /nfs/dbraw/zinc/55/24/24/385552424.db2.gz OVWHRSJBGGGFKT-RBZFPXEDSA-N 0 3 295.448 2.961 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)C(C)C)c([O-])c1 ZINC000285248829 385554592 /nfs/dbraw/zinc/55/45/92/385554592.db2.gz PWRVNIMNMIGZHI-JSGCOSHPSA-N 0 3 251.370 2.677 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@@H](O)C2(C)C)c([O-])c1 ZINC000285402636 385555364 /nfs/dbraw/zinc/55/53/64/385555364.db2.gz XGPREKOBOOURGM-FPMFFAJLSA-N 0 3 263.381 2.819 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@H]2CCCC[C@H]2O)c1[O-] ZINC000272683490 385588178 /nfs/dbraw/zinc/58/81/78/385588178.db2.gz VVPSSNXOTRTXMT-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c1[O-] ZINC000272683490 385588180 /nfs/dbraw/zinc/58/81/80/385588180.db2.gz VVPSSNXOTRTXMT-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273179994 385673375 /nfs/dbraw/zinc/67/33/75/385673375.db2.gz OBRRGFJALDFZGH-UONOGXRCSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc([C@@H](C)NCc2cccc(C(N)=O)c2)c(O)c1C ZINC000273305964 385677477 /nfs/dbraw/zinc/67/74/77/385677477.db2.gz CRUNWXAPADJWFQ-CYBMUJFWSA-N 0 3 298.386 2.959 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@@]1(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000273397973 385680672 /nfs/dbraw/zinc/68/06/72/385680672.db2.gz FUHCDDOJSCYLEQ-CZUORRHYSA-N 0 3 295.354 2.743 20 10 CFCDHN Cc1ccc([C@H](C)NCc2ccnn2C)c(O)c1C ZINC000273440119 385682374 /nfs/dbraw/zinc/68/23/74/385682374.db2.gz YCGJXGWBGNJOMI-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2ccccc2[O-])C[C@H]1O ZINC000273446129 385682897 /nfs/dbraw/zinc/68/28/97/385682897.db2.gz XNRBDEUNXWZOLU-DZGCQCFKSA-N 0 3 263.381 2.621 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@H]1O ZINC000273446129 385682901 /nfs/dbraw/zinc/68/29/01/385682901.db2.gz XNRBDEUNXWZOLU-DZGCQCFKSA-N 0 3 263.381 2.621 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOc2ncccc2F)c([O-])c1 ZINC000273477781 385684048 /nfs/dbraw/zinc/68/40/48/385684048.db2.gz LDJNNYTTYHLFQF-LBPRGKRZSA-N 0 3 290.338 2.964 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000273548965 385688378 /nfs/dbraw/zinc/68/83/78/385688378.db2.gz FNPNKORZTVKXIS-BFQNTYOBSA-N 0 3 290.407 2.534 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@]2(N(C)C)CCSC2)c1 ZINC000273585275 385688961 /nfs/dbraw/zinc/68/89/61/385688961.db2.gz NSLMSSMIUBFAOH-CZUORRHYSA-N 0 3 294.464 2.789 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273583653 385689128 /nfs/dbraw/zinc/68/91/28/385689128.db2.gz NFPQORPOWMJPKM-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000273603146 385691204 /nfs/dbraw/zinc/69/12/04/385691204.db2.gz SKTKNBBHABDGOA-HZMBPMFUSA-N 0 3 255.333 2.853 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cc(F)ccc2[O-])o1 ZINC000273619843 385692635 /nfs/dbraw/zinc/69/26/35/385692635.db2.gz YQXMNPZRKUDQNO-IINYFYTJSA-N 0 3 279.311 2.817 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000273618332 385693129 /nfs/dbraw/zinc/69/31/29/385693129.db2.gz YFCBHVLEDNSPHX-KGLIPLIRSA-N 0 3 290.407 2.671 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1COC3(CCCC3)O1)CC2 ZINC000296936267 285397685 /nfs/dbraw/zinc/39/76/85/285397685.db2.gz QDOPNADMNWFZJE-ZIAGYGMSSA-N 0 3 289.375 2.655 20 10 CFCDHN CCCN1CCC([N@H+](C)Cc2cc(F)ccc2[O-])CC1 ZINC000179948864 393473834 /nfs/dbraw/zinc/47/38/34/393473834.db2.gz QCYNHGODWGEARP-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CCCN1CCC([N@@H+](C)Cc2cc(F)ccc2[O-])CC1 ZINC000179948864 393473839 /nfs/dbraw/zinc/47/38/39/393473839.db2.gz QCYNHGODWGEARP-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374120769 393483854 /nfs/dbraw/zinc/48/38/54/393483854.db2.gz OTVLEKMHKVUTBI-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374120769 393483860 /nfs/dbraw/zinc/48/38/60/393483860.db2.gz OTVLEKMHKVUTBI-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC000180316202 393478971 /nfs/dbraw/zinc/47/89/71/393478971.db2.gz WHIDAULZJSYJJB-UKRRQHHQSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC000180316202 393478980 /nfs/dbraw/zinc/47/89/80/393478980.db2.gz WHIDAULZJSYJJB-UKRRQHHQSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC3(CCO3)CC2)c1[O-] ZINC000374370718 393495069 /nfs/dbraw/zinc/49/50/69/393495069.db2.gz GDEWYKYBQWGLFO-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CN(C)c1ccc(CN2CCC3(CCO3)CC2)cc1F ZINC000374371985 393495533 /nfs/dbraw/zinc/49/55/33/393495533.db2.gz NAJCBZMGFJQSSP-UHFFFAOYSA-N 0 3 278.371 2.647 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CC(=O)N3CCCC[C@H]23)c1 ZINC000374509418 393498260 /nfs/dbraw/zinc/49/82/60/393498260.db2.gz XWHOJABOBHULMB-NWANDNLSSA-N 0 3 288.391 2.505 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)Cc2ccc(O)cc2)c1[O-] ZINC000105446966 393864027 /nfs/dbraw/zinc/86/40/27/393864027.db2.gz OVLNJDIBXYXDBJ-GFCCVEGCSA-N 0 3 287.359 2.827 20 10 CFCDHN C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccccc1[O-] ZINC000119276339 393916910 /nfs/dbraw/zinc/91/69/10/393916910.db2.gz UZZWETDOCJSQOC-CQSZACIVSA-N 0 3 271.360 2.948 20 10 CFCDHN C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccccc1[O-] ZINC000119276339 393916914 /nfs/dbraw/zinc/91/69/14/393916914.db2.gz UZZWETDOCJSQOC-CQSZACIVSA-N 0 3 271.360 2.948 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCN2CCC[C@H]2C1 ZINC000251295851 393931439 /nfs/dbraw/zinc/93/14/39/393931439.db2.gz SKQFNTHLHKWLDC-ZFWWWQNUSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCN2CCC[C@H]2C1 ZINC000251295851 393931441 /nfs/dbraw/zinc/93/14/41/393931441.db2.gz SKQFNTHLHKWLDC-ZFWWWQNUSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)[C@@H](C)N1CCOCC1)c1ccccc1[O-] ZINC000155706242 394321672 /nfs/dbraw/zinc/32/16/72/394321672.db2.gz JHBRJQXTODFPOM-SQWLQELKSA-N 0 3 292.423 2.542 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCO)C(C)C)c1ccccc1[O-] ZINC000156059994 394328999 /nfs/dbraw/zinc/32/89/99/394328999.db2.gz VEWWRDQRLBTAHQ-ZIAGYGMSSA-N 0 3 251.370 2.840 20 10 CFCDHN CN1CCc2cc(CNCc3ccc(F)nc3)ccc21 ZINC000372357750 397536218 /nfs/dbraw/zinc/53/62/18/397536218.db2.gz LVFOROMSICQNJE-UHFFFAOYSA-N 0 3 271.339 2.503 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@](C)(OC)C2CC2)c1[O-] ZINC000291062372 286223128 /nfs/dbraw/zinc/22/31/28/286223128.db2.gz PQJPLMDNJOKPBO-OAHLLOKOSA-N 0 3 299.798 2.959 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccccc1[O-] ZINC000020146668 171033124 /nfs/dbraw/zinc/03/31/24/171033124.db2.gz IYPIURACBXOYPA-ZIAGYGMSSA-N 0 3 279.380 2.629 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)N(C)C)c1 ZINC000035628803 172308374 /nfs/dbraw/zinc/30/83/74/172308374.db2.gz SIHZXSMOPBSJCX-GFCCVEGCSA-N 0 3 250.386 2.691 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCC[C@@H]2C2CC2)cc1OC ZINC000367221345 228092097 /nfs/dbraw/zinc/09/20/97/228092097.db2.gz IQCOLJAXXIIVMK-CYBMUJFWSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCC[C@@H]2C2CC2)cc1OC ZINC000367221345 228092100 /nfs/dbraw/zinc/09/21/00/228092100.db2.gz IQCOLJAXXIIVMK-CYBMUJFWSA-N 0 3 277.364 2.784 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCOC[C@@H]2CCCO2)c1 ZINC000035628893 260030645 /nfs/dbraw/zinc/03/06/45/260030645.db2.gz UIVOZUUCLPEPJC-CABCVRRESA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCOC[C@H]2CCCO2)c1 ZINC000035628895 260030797 /nfs/dbraw/zinc/03/07/97/260030797.db2.gz UIVOZUUCLPEPJC-HUUCEWRRSA-N 0 3 293.407 2.937 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCOCC[C@@H]2C)c1 ZINC000367700887 267111119 /nfs/dbraw/zinc/11/11/19/267111119.db2.gz DRUSUHRPFYPQFJ-RYUDHWBXSA-N 0 3 265.353 2.573 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCOCC[C@@H]2C)c1 ZINC000367700887 267111121 /nfs/dbraw/zinc/11/11/21/267111121.db2.gz DRUSUHRPFYPQFJ-RYUDHWBXSA-N 0 3 265.353 2.573 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@@](=O)C[C@@H](C)C1 ZINC000368038969 267140045 /nfs/dbraw/zinc/14/00/45/267140045.db2.gz QFIOOAYFRYWXNC-BBEJJTJUSA-N 0 3 281.421 2.544 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCO[C@]2(CCCOC2)C1 ZINC000368052468 267143145 /nfs/dbraw/zinc/14/31/45/267143145.db2.gz WDOVNGZKCWIWSH-DOTOQJQBSA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCO[C@]2(CCCOC2)C1 ZINC000368052468 267143147 /nfs/dbraw/zinc/14/31/47/267143147.db2.gz WDOVNGZKCWIWSH-DOTOQJQBSA-N 0 3 291.391 2.725 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c([O-])c1 ZINC000370394571 267315870 /nfs/dbraw/zinc/31/58/70/267315870.db2.gz FRPBQFCZYBQJPT-YPMHNXCESA-N 0 3 271.364 2.632 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000370397281 267316451 /nfs/dbraw/zinc/31/64/51/267316451.db2.gz MNQIGOHMPXPXQJ-JOYOIKCWSA-N 0 3 291.782 2.977 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](O)[C@@H]2CCCO2)c1[O-] ZINC000527954366 270562005 /nfs/dbraw/zinc/56/20/05/270562005.db2.gz JMNPRYAKOPVJQG-BPNCWPANSA-N 0 3 299.798 2.545 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1cn3ccccc3n1)CC2 ZINC000295872202 275061725 /nfs/dbraw/zinc/06/17/25/275061725.db2.gz HDRIWNJLIFZWRI-HNNXBMFYSA-N 0 3 293.370 2.860 20 10 CFCDHN CCCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000185112293 276263574 /nfs/dbraw/zinc/26/35/74/276263574.db2.gz CFWUYZLINZKXLJ-QWHCGFSZSA-N 0 3 280.387 2.914 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cccc(OC)c1[O-])OC ZINC000294241769 276419275 /nfs/dbraw/zinc/41/92/75/276419275.db2.gz PGEJEHKGYVDSEP-BXUZGUMPSA-N 0 3 267.369 2.552 20 10 CFCDHN COCCOCCC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293278743 277231014 /nfs/dbraw/zinc/23/10/14/277231014.db2.gz CRAAYSIWNPSKOH-AWEZNQCLSA-N 0 3 281.396 2.713 20 10 CFCDHN CC[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])N1CCCC1 ZINC000183410390 280837433 /nfs/dbraw/zinc/83/74/33/280837433.db2.gz BAHJXRKDCQAERW-UONOGXRCSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@]2(CCN(C)C2)C1 ZINC000312704259 281025187 /nfs/dbraw/zinc/02/51/87/281025187.db2.gz OIFPIWUPZYYZIK-WBVHZDCISA-N 0 3 274.408 2.871 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@]2(CCN(C)C2)C1 ZINC000312704259 281025190 /nfs/dbraw/zinc/02/51/90/281025190.db2.gz OIFPIWUPZYYZIK-WBVHZDCISA-N 0 3 274.408 2.871 20 10 CFCDHN COc1ccc(O)c(CN2CCS[C@@H](C)[C@@H]2C)c1 ZINC000180311487 295165953 /nfs/dbraw/zinc/16/59/53/295165953.db2.gz JPJANEHGGDQLAO-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c1 ZINC000180311487 295165956 /nfs/dbraw/zinc/16/59/56/295165956.db2.gz JPJANEHGGDQLAO-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1 ZINC000296325686 301654219 /nfs/dbraw/zinc/65/42/19/301654219.db2.gz HARRCMAETKWENX-NWDGAFQWSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1n[nH]cc1C1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000375268323 329002407 /nfs/dbraw/zinc/00/24/07/329002407.db2.gz MVLXNGIXXIRVHS-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC23CC(C2)CO3)c2c1c(F)ccc2[O-] ZINC000527983006 330298366 /nfs/dbraw/zinc/29/83/66/330298366.db2.gz RVKGYTDZGXSYQP-MSYMGVCBSA-N 0 3 277.339 2.848 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC23CC(C2)CO3)c([O-])c1C ZINC000527985139 330298531 /nfs/dbraw/zinc/29/85/31/330298531.db2.gz YVGHEKHLTWEIBY-FUJMWEONSA-N 0 3 261.365 2.839 20 10 CFCDHN COc1ccc(CC[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000527985617 330298769 /nfs/dbraw/zinc/29/87/69/330298769.db2.gz FEUDFJNHDVCGFU-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000527976797 330302133 /nfs/dbraw/zinc/30/21/33/330302133.db2.gz GBBHJOZQFKRIGR-KMUNFCNLSA-N 0 3 265.353 2.619 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)C(=O)N1CCCC1)c1ccccc1[O-] ZINC000528014127 330304201 /nfs/dbraw/zinc/30/42/01/330304201.db2.gz FSVVDLFNJYQARK-CYBMUJFWSA-N 0 3 290.407 2.691 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H](OC)C(C)C)c([O-])c1 ZINC000266652195 520366049 /nfs/dbraw/zinc/36/60/49/520366049.db2.gz ZAFIOSGKURVPLZ-MRXNPFEDSA-N 0 3 281.396 2.942 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC(O)(CC)CC)c([O-])c1 ZINC000101596103 520366861 /nfs/dbraw/zinc/36/68/61/520366861.db2.gz MBHNYKOPOBSMBZ-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000087014939 521657186 /nfs/dbraw/zinc/65/71/86/521657186.db2.gz CNGWEEVXKPLDCT-GFCCVEGCSA-N 0 3 251.370 2.902 20 10 CFCDHN COC(C)(C)C[C@@H](C)[NH2+]Cc1cc(C)ccc1[O-] ZINC000174557253 522506500 /nfs/dbraw/zinc/50/65/00/522506500.db2.gz MBMOTWPSMULPIG-GFCCVEGCSA-N 0 3 251.370 2.994 20 10 CFCDHN CC(C)C1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000227832874 519553700 /nfs/dbraw/zinc/55/37/00/519553700.db2.gz MXQBURFMJVRYEE-UHFFFAOYSA-N 0 3 263.337 2.647 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000279150030 519717766 /nfs/dbraw/zinc/71/77/66/519717766.db2.gz SQVRAFUSTDSOJV-LLVKDONJSA-N 0 3 285.347 2.596 20 10 CFCDHN CCC1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CCC1 ZINC000227762440 519842454 /nfs/dbraw/zinc/84/24/54/519842454.db2.gz UFCINLZQAVBZBM-UHFFFAOYSA-N 0 3 263.337 2.791 20 10 CFCDHN CCC[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000157755814 519944236 /nfs/dbraw/zinc/94/42/36/519944236.db2.gz AIUYOFYFHUZDMY-UHFFFAOYSA-N 0 3 258.159 2.963 20 10 CFCDHN CCOCCNCc1ccc(N2CCCCC2)cc1 ZINC000036228400 519966788 /nfs/dbraw/zinc/96/67/88/519966788.db2.gz GJEQDJXHXVURFF-UHFFFAOYSA-N 0 3 262.397 2.803 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C(C)C ZINC000296617315 520200826 /nfs/dbraw/zinc/20/08/26/520200826.db2.gz WQTVOFUIEWASIN-BBRMVZONSA-N 0 3 292.423 2.854 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H](OC)C2CC2)c([O-])c1 ZINC000292929992 520369748 /nfs/dbraw/zinc/36/97/48/520369748.db2.gz GWULKPBYYOFTMA-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cccc(OCC)c1[O-] ZINC000278750475 520959154 /nfs/dbraw/zinc/95/91/54/520959154.db2.gz SBSHUWRQJXLAJC-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cccc(OCC)c1[O-] ZINC000278750475 520959171 /nfs/dbraw/zinc/95/91/71/520959171.db2.gz SBSHUWRQJXLAJC-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H]2CCN(C)C[C@@H]2C)c1 ZINC000290529127 521143582 /nfs/dbraw/zinc/14/35/82/521143582.db2.gz QNZYPDFDCORNDF-BBRMVZONSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H]2CCN(C)C[C@@H]2C)c1 ZINC000290529127 521143587 /nfs/dbraw/zinc/14/35/87/521143587.db2.gz QNZYPDFDCORNDF-BBRMVZONSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H](O)c2ccc(C)o2)c1 ZINC000266038002 521153069 /nfs/dbraw/zinc/15/30/69/521153069.db2.gz SZEGQDHHNHWGIC-OAHLLOKOSA-N 0 3 291.347 2.516 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)CCCN(C)C)c1[O-] ZINC000230744827 521332849 /nfs/dbraw/zinc/33/28/49/521332849.db2.gz ILTFDILMAJRIOQ-UHFFFAOYSA-N 0 3 280.412 2.565 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)CCCN(C)C)c1[O-] ZINC000230744827 521332859 /nfs/dbraw/zinc/33/28/59/521332859.db2.gz ILTFDILMAJRIOQ-UHFFFAOYSA-N 0 3 280.412 2.565 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCc2c[nH]nc2C)c1[O-] ZINC000050182470 521361220 /nfs/dbraw/zinc/36/12/20/521361220.db2.gz AXOYXLPEVYMBIS-UHFFFAOYSA-N 0 3 289.379 2.545 20 10 CFCDHN CCCN(CC(=O)NC(C)(C)C)Cc1ccccc1O ZINC000069009943 521541950 /nfs/dbraw/zinc/54/19/50/521541950.db2.gz FQPWEDSRZREYQM-UHFFFAOYSA-N 0 3 278.396 2.519 20 10 CFCDHN CN(C)CCOc1ccc(NCc2ccccc2O)cc1 ZINC000037774300 521800968 /nfs/dbraw/zinc/80/09/68/521800968.db2.gz UPBNKKKVIGYDLD-UHFFFAOYSA-N 0 3 286.375 2.945 20 10 CFCDHN CN(C)c1ccc(CN[C@]2(CO)CCc3ccccc32)cc1 ZINC000305150067 522213604 /nfs/dbraw/zinc/21/36/04/522213604.db2.gz KCZMCNZRUWIJID-IBGZPJMESA-N 0 3 296.414 2.676 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCO[C@H](C)C2)c1[O-] ZINC000273792556 522541757 /nfs/dbraw/zinc/54/17/57/522541757.db2.gz VLRPCWBHNDYOCR-GHMZBOCLSA-N 0 3 299.798 2.959 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@H](C)CO)c1ccccc1[O-] ZINC000229565072 522585847 /nfs/dbraw/zinc/58/58/47/522585847.db2.gz UYPSVIKKMZLJJE-JSGCOSHPSA-N 0 3 251.370 2.842 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)C[C@@H](C)O)c1ccccc1[O-] ZINC000155962682 522624115 /nfs/dbraw/zinc/62/41/15/522624115.db2.gz DITXSAHSKQHFIG-BZPMIXESSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)C(C)C)c1ccc(C)cc1[O-] ZINC000280063982 522628147 /nfs/dbraw/zinc/62/81/47/522628147.db2.gz KOAZPWNDLZIRFZ-ZFWWWQNUSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@@H](CO)SC)c1ccc(C)cc1[O-] ZINC000280205978 522692509 /nfs/dbraw/zinc/69/25/09/522692509.db2.gz TVYNXYUDDBYSMP-CORIIIEPSA-N 0 3 283.437 2.854 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])[C@H]1CCCO1 ZINC000278605866 522758441 /nfs/dbraw/zinc/75/84/41/522758441.db2.gz BHVDPRZDFAOZNG-DUVNUKRYSA-N 0 3 279.380 2.545 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCC[C@@H]2CSC)cc1OC ZINC000160449571 522772796 /nfs/dbraw/zinc/77/27/96/522772796.db2.gz FJXFFJYWIADLFN-GFCCVEGCSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCC[C@@H]2CSC)cc1OC ZINC000160449571 522772807 /nfs/dbraw/zinc/77/28/07/522772807.db2.gz FJXFFJYWIADLFN-GFCCVEGCSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCS[C@@H](C)CC2)cc1OC ZINC000191658740 522776150 /nfs/dbraw/zinc/77/61/50/522776150.db2.gz YBGHQOBSSCSYLA-NSHDSACASA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCS[C@@H](C)CC2)cc1OC ZINC000191658740 522776158 /nfs/dbraw/zinc/77/61/58/522776158.db2.gz YBGHQOBSSCSYLA-NSHDSACASA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@H](C)[C@H]2C)cc1OC ZINC000160353053 522779010 /nfs/dbraw/zinc/77/90/10/522779010.db2.gz FBTYEMPKAMEFST-WDEREUQCSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@H](C)[C@H]2C)cc1OC ZINC000160353053 522779015 /nfs/dbraw/zinc/77/90/15/522779015.db2.gz FBTYEMPKAMEFST-WDEREUQCSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@@H]2CCCSC2)cc1OC ZINC000290221264 522780599 /nfs/dbraw/zinc/78/05/99/522780599.db2.gz RPYXARXTOZFPHC-NSHDSACASA-N 0 3 297.420 2.642 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(C)CC1)c1ccc(C)cc1[O-] ZINC000280138211 522812261 /nfs/dbraw/zinc/81/22/61/522812261.db2.gz PMKAMWIWXTXBDB-OAHLLOKOSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@@H]([NH2+]CCCN(C)C)c1ccc(C)cc1[O-] ZINC000279975629 522826704 /nfs/dbraw/zinc/82/67/04/522826704.db2.gz DFXASEJZPDJRMV-CQSZACIVSA-N 0 3 250.386 2.693 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nc(C)no1)c1ccc(C)cc1[O-] ZINC000280274486 522845469 /nfs/dbraw/zinc/84/54/69/522845469.db2.gz YCHWCUCFFHCUAG-CYBMUJFWSA-N 0 3 275.352 2.675 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000280040335 522861870 /nfs/dbraw/zinc/86/18/70/522861870.db2.gz IUGADNPSAIUXSM-WBVHZDCISA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)[C@@H](CO)SC)c1ccccc1[O-] ZINC000155947550 522911894 /nfs/dbraw/zinc/91/18/94/522911894.db2.gz PGDWHCPVUMLYDZ-ZKYQVNSYSA-N 0 3 269.410 2.545 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CCN(C)C)c1ccccc1[O-] ZINC000049553310 522932371 /nfs/dbraw/zinc/93/23/71/522932371.db2.gz MUPSZENNNWUWFW-TZMCWYRMSA-N 0 3 250.386 2.773 20 10 CFCDHN CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000273603152 523540391 /nfs/dbraw/zinc/54/03/91/523540391.db2.gz SKTKNBBHABDGOA-YGRLFVJLSA-N 0 3 255.333 2.853 20 10 CFCDHN C[C@H]1CCC[C@@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000044418170 524151875 /nfs/dbraw/zinc/15/18/75/524151875.db2.gz DZTPNOBOHRGNRR-CMPLNLGQSA-N 0 3 263.337 2.789 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC000245948522 524407212 /nfs/dbraw/zinc/40/72/12/524407212.db2.gz WHIDAULZJSYJJB-DZGCQCFKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1[O-] ZINC000245948522 524407219 /nfs/dbraw/zinc/40/72/19/524407219.db2.gz WHIDAULZJSYJJB-DZGCQCFKSA-N 0 3 261.365 2.702 20 10 CFCDHN COc1ccccc1CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000226582609 524422655 /nfs/dbraw/zinc/42/26/55/524422655.db2.gz FQPCTTCOTUVUBW-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c1[O-] ZINC000292704224 524434968 /nfs/dbraw/zinc/43/49/68/524434968.db2.gz CPSWPFAMRVTKMI-INIZCTEOSA-N 0 3 277.408 2.977 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)c1[O-] ZINC000290273407 524438579 /nfs/dbraw/zinc/43/85/79/524438579.db2.gz YDNOQDBVNWWIBL-CXAGYDPISA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+]Cc2cccc(C)c2[O-])c1 ZINC000191683153 524466012 /nfs/dbraw/zinc/46/60/12/524466012.db2.gz FRAXMMBZWLBJBH-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN COc1ccccc1CNCc1cc(C)ccc1O ZINC000071403722 524488913 /nfs/dbraw/zinc/48/89/13/524488913.db2.gz WNUGUOZFMUKBKC-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN COc1ccc(O)c(CN2CCCc3occc3C2)c1 ZINC000290206196 524742615 /nfs/dbraw/zinc/74/26/15/524742615.db2.gz QBHTUWRKGQWBNC-UHFFFAOYSA-N 0 3 273.332 2.942 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(SC)CC2)c1 ZINC000193834162 524769272 /nfs/dbraw/zinc/76/92/72/524769272.db2.gz UFIOCMPOWHNQMC-JTQLQIEISA-N 0 3 267.394 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](O)C(C)(C)C2)c1[O-] ZINC000280483986 524866839 /nfs/dbraw/zinc/86/68/39/524866839.db2.gz OGAURCYESNEUQO-GFCCVEGCSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](O)C(C)(C)C2)c1[O-] ZINC000280483986 524866850 /nfs/dbraw/zinc/86/68/50/524866850.db2.gz OGAURCYESNEUQO-GFCCVEGCSA-N 0 3 269.772 2.557 20 10 CFCDHN C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000156074783 525085230 /nfs/dbraw/zinc/08/52/30/525085230.db2.gz RXXJOAPSHLMGHR-BXUZGUMPSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000156074783 525085239 /nfs/dbraw/zinc/08/52/39/525085239.db2.gz RXXJOAPSHLMGHR-BXUZGUMPSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])C1CCCCC1 ZINC000191653427 525180430 /nfs/dbraw/zinc/18/04/30/525180430.db2.gz LQCZCGQXANQLRV-INIZCTEOSA-N 0 3 281.371 2.952 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@](C)(O)c2cccs2)c1 ZINC000265766852 525348490 /nfs/dbraw/zinc/34/84/90/525348490.db2.gz LCHWDWLEGUUYKA-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@](C)(O)c2ccsc2)c1 ZINC000265871021 525349391 /nfs/dbraw/zinc/34/93/91/525349391.db2.gz MIACYLDZVUDLRK-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1 ZINC000368766937 525350137 /nfs/dbraw/zinc/35/01/37/525350137.db2.gz VPIDIMIHMDHWME-IRXDYDNUSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)c1 ZINC000085965358 525364771 /nfs/dbraw/zinc/36/47/71/525364771.db2.gz HXMYDZCWDGYCKC-GUTXKFCHSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000094617769 525388680 /nfs/dbraw/zinc/38/86/80/525388680.db2.gz HXMJDDXJKLUAGI-QWRGUYRKSA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCSC1)c1cc(F)ccc1[O-] ZINC000228558993 525392906 /nfs/dbraw/zinc/39/29/06/525392906.db2.gz JWGFHJQAEMKWFG-UWVGGRQHSA-N 0 3 255.358 2.935 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(c2ncccn2)CC1)c1ccccc1[O-] ZINC000192712789 525404335 /nfs/dbraw/zinc/40/43/35/525404335.db2.gz AWJPPPVYXBBTMJ-CYBMUJFWSA-N 0 3 298.390 2.502 20 10 CFCDHN C[C@@H]([NH2+]CCc1nccs1)c1cc(F)ccc1[O-] ZINC000094618174 525467933 /nfs/dbraw/zinc/46/79/33/525467933.db2.gz WLTZOFWOXSMAAU-SECBINFHSA-N 0 3 266.341 2.881 20 10 CFCDHN C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000163860733 525532481 /nfs/dbraw/zinc/53/24/81/525532481.db2.gz KZMNWSVTOKCYIP-STQMWFEESA-N 0 3 272.396 2.898 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094618165 525543713 /nfs/dbraw/zinc/54/37/13/525543713.db2.gz CGEPSMVBKAWDKT-NHYWBVRUSA-N 0 3 275.323 2.916 20 10 CFCDHN COc1cccc(C[N@H+](C)CCCOC(C)C)c1[O-] ZINC000271190471 525913691 /nfs/dbraw/zinc/91/36/91/525913691.db2.gz LIQHJFUEFKAMBN-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCCOC(C)C)c1[O-] ZINC000271190471 525913699 /nfs/dbraw/zinc/91/36/99/525913699.db2.gz LIQHJFUEFKAMBN-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cccnc2)c([O-])c1 ZINC000037717938 525921898 /nfs/dbraw/zinc/92/18/98/525921898.db2.gz NPEVYUPUHQVTLZ-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000085972912 525926115 /nfs/dbraw/zinc/92/61/15/525926115.db2.gz QXQUJISCGIZCNG-GUTXKFCHSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000280583990 525934736 /nfs/dbraw/zinc/93/47/36/525934736.db2.gz WVUZQEUYHBQUDZ-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000280583990 525934742 /nfs/dbraw/zinc/93/47/42/525934742.db2.gz WVUZQEUYHBQUDZ-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@](C)(OC)CC2)c1[O-] ZINC000280279695 525942299 /nfs/dbraw/zinc/94/22/99/525942299.db2.gz NFZVFHPHXIIABZ-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@](C)(OC)CC2)c1[O-] ZINC000280279695 525942307 /nfs/dbraw/zinc/94/23/07/525942307.db2.gz NFZVFHPHXIIABZ-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc(C[NH2+]CCSC(F)(F)F)c1[O-] ZINC000171128247 526015684 /nfs/dbraw/zinc/01/56/84/526015684.db2.gz NJUBBRBFIOZHQN-UHFFFAOYSA-N 0 3 281.299 2.743 20 10 CFCDHN COc1cccc(C[NH2+]CCc2cccc(F)c2)c1[O-] ZINC000036778725 526016286 /nfs/dbraw/zinc/01/62/86/526016286.db2.gz OJEXMSPSMUHVHG-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2C[C@](C)(OC)C2(C)C)c1[O-] ZINC000174132979 526035016 /nfs/dbraw/zinc/03/50/16/526035016.db2.gz FEDJDHOXQNJDJK-CJNGLKHVSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1nnc(CC[NH2+][C@@H](C)c2cc(C)ccc2[O-])s1 ZINC000289657485 526328867 /nfs/dbraw/zinc/32/88/67/526328867.db2.gz GOCUAEGUZUFFQL-JTQLQIEISA-N 0 3 277.393 2.754 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]3CCC[C@H]31)OCO2 ZINC000228173103 526334719 /nfs/dbraw/zinc/33/47/19/526334719.db2.gz SZXMVIJEOGZEPP-WCQYABFASA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]3CCC[C@H]31)OCO2 ZINC000228173103 526334723 /nfs/dbraw/zinc/33/47/23/526334723.db2.gz SZXMVIJEOGZEPP-WCQYABFASA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293612058 526346599 /nfs/dbraw/zinc/34/65/99/526346599.db2.gz KBAHDADCSJPMLF-INIZCTEOSA-N 0 3 291.366 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293612058 526346601 /nfs/dbraw/zinc/34/66/01/526346601.db2.gz KBAHDADCSJPMLF-INIZCTEOSA-N 0 3 291.366 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1COc2ccccc21 ZINC000290206161 526351079 /nfs/dbraw/zinc/35/10/79/526351079.db2.gz QAQDTUZHXOGHSS-LBPRGKRZSA-N 0 3 273.307 2.797 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000289536235 526371393 /nfs/dbraw/zinc/37/13/93/526371393.db2.gz WLRIPIVYPANKAJ-MRXNPFEDSA-N 0 3 257.333 2.606 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1COc2ccccc21 ZINC000228414816 526374089 /nfs/dbraw/zinc/37/40/89/526374089.db2.gz XGJCYPPCDDVPHP-ZDUSSCGKSA-N 0 3 255.317 2.658 20 10 CFCDHN Cc1nnsc1CN[C@@H](C)c1ccc(C)cc1O ZINC000293275490 526449236 /nfs/dbraw/zinc/44/92/36/526449236.db2.gz CNQRPKNGEKOGRI-VIFPVBQESA-N 0 3 263.366 2.711 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)Cc2ccoc2)c1[O-] ZINC000754046347 574065321 /nfs/dbraw/zinc/06/53/21/574065321.db2.gz KUNHSMXISMSVCX-LLVKDONJSA-N 0 3 261.321 2.715 20 10 CFCDHN COc1cc(C)cc(CN(C)CCOC(C)(C)C)c1O ZINC000754741065 574118007 /nfs/dbraw/zinc/11/80/07/574118007.db2.gz OLGNGQBYLLEHSX-UHFFFAOYSA-N 0 3 281.396 2.956 20 10 CFCDHN C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)c2cc([O-])cs2)C1 ZINC000731871944 574131395 /nfs/dbraw/zinc/13/13/95/574131395.db2.gz RCQIJMCAMPKVOZ-RYUDHWBXSA-N 0 3 296.436 2.552 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@](C)(O)[C@@H](C)CC)c([O-])c1 ZINC000732820959 574173364 /nfs/dbraw/zinc/17/33/64/574173364.db2.gz QSOJMCABRFRREQ-BLLLJJGKSA-N 0 3 281.396 2.678 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]CC1(CO)CC1 ZINC000747100763 574180008 /nfs/dbraw/zinc/18/00/08/574180008.db2.gz RZKUEWXOSZTKEH-UHFFFAOYSA-N 0 3 283.371 2.921 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756345456 574227775 /nfs/dbraw/zinc/22/77/75/574227775.db2.gz XQHSAINANZZUOZ-AAEUAGOBSA-N 0 3 289.354 2.956 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)Cc1cccc(O)c1 ZINC000729680864 574227713 /nfs/dbraw/zinc/22/77/13/574227713.db2.gz CURSWOFPSHNVCO-LBPRGKRZSA-N 0 3 287.359 2.827 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)Cc2cccc(O)c2)c1[O-] ZINC000729681082 574227978 /nfs/dbraw/zinc/22/79/78/574227978.db2.gz SGSJHYMZFGZEHU-GFCCVEGCSA-N 0 3 287.359 2.827 20 10 CFCDHN C[C@H](Cn1ccnc1)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756401668 574234142 /nfs/dbraw/zinc/23/41/42/574234142.db2.gz JEVUUCSBYPRGTF-WZRBSPASSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417172 574235288 /nfs/dbraw/zinc/23/52/88/574235288.db2.gz KLKYBXRXXFHMAY-UHTWSYAYSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417172 574235292 /nfs/dbraw/zinc/23/52/92/574235292.db2.gz KLKYBXRXXFHMAY-UHTWSYAYSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417172 574235296 /nfs/dbraw/zinc/23/52/96/574235296.db2.gz KLKYBXRXXFHMAY-UHTWSYAYSA-N 0 3 296.361 2.948 20 10 CFCDHN COC[C@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756467778 574239447 /nfs/dbraw/zinc/23/94/47/574239447.db2.gz YLOFHXKQYZQIGZ-FOGDFJRCSA-N 0 3 267.344 2.952 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)Cc2cnccn2)c1 ZINC000756496098 574241524 /nfs/dbraw/zinc/24/15/24/574241524.db2.gz UXXNBKHGDHHACS-STQMWFEESA-N 0 3 271.364 2.772 20 10 CFCDHN CC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(C)ccc1[O-] ZINC000748241677 574242737 /nfs/dbraw/zinc/24/27/37/574242737.db2.gz DJXCNWSFUFFIKZ-HNNXBMFYSA-N 0 3 265.353 2.522 20 10 CFCDHN CCOc1ccc(C[NH2+][C@](C)(CC)CC(=O)OC)c([O-])c1 ZINC000748247341 574243253 /nfs/dbraw/zinc/24/32/53/574243253.db2.gz UIHIWQLWNYRIEG-MRXNPFEDSA-N 0 3 295.379 2.612 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000756525244 574243650 /nfs/dbraw/zinc/24/36/50/574243650.db2.gz NJTYGIGQFPGPRY-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN COC(=O)N1CCC[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2[O-])C1 ZINC000756528672 574243827 /nfs/dbraw/zinc/24/38/27/574243827.db2.gz OPGNVCHIFMKJDX-QWHCGFSZSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C)C1)c1cc2c(cc1[O-])CCCC2 ZINC000756536316 574244425 /nfs/dbraw/zinc/24/44/25/574244425.db2.gz UWHPCZKWGPFUFL-SWLSCSKDSA-N 0 3 274.408 2.626 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000756551718 574246378 /nfs/dbraw/zinc/24/63/78/574246378.db2.gz ALLIJQBASXQTAI-SCVCMEIPSA-N 0 3 265.328 2.848 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c([O-])c1 ZINC000756555575 574246893 /nfs/dbraw/zinc/24/68/93/574246893.db2.gz SLFHAOJXZOSRBZ-HIFRSBDPSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC2(O)CCCC2)c2c1c(F)ccc2[O-] ZINC000756571738 574248633 /nfs/dbraw/zinc/24/86/33/574248633.db2.gz DQPOUGLLSORYCJ-JQWIXIFHSA-N 0 3 279.355 2.974 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCOc2cccnc2)c1 ZINC000756569924 574248863 /nfs/dbraw/zinc/24/88/63/574248863.db2.gz ACTGQFWZLVFZTD-LBPRGKRZSA-N 0 3 288.347 2.525 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000756576626 574249950 /nfs/dbraw/zinc/24/99/50/574249950.db2.gz VFLMTYAUSGJZHW-IXOXFDKPSA-N 0 3 279.355 2.973 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(F)ccc1[O-] ZINC000756617115 574252705 /nfs/dbraw/zinc/25/27/05/574252705.db2.gz MIRCJGKNNVDOPX-RYUDHWBXSA-N 0 3 266.360 2.666 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@]2(O)CCSC2)c2c1c(F)ccc2[O-] ZINC000756636329 574254243 /nfs/dbraw/zinc/25/42/43/574254243.db2.gz ITTAJFZVBWCNIT-XDMRBOTDSA-N 0 3 297.395 2.537 20 10 CFCDHN C[C@H](CC[S@](C)=O)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756743228 574260420 /nfs/dbraw/zinc/26/04/20/574260420.db2.gz QVGPLXXHCHIZME-JOZYRBCSSA-N 0 3 299.411 2.826 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(CCO)CCC2)c1 ZINC000756763880 574260873 /nfs/dbraw/zinc/26/08/73/574260873.db2.gz AYGQVVHKEODOBY-GFCCVEGCSA-N 0 3 279.380 2.604 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)NCc2cc(C)ncn2)c1 ZINC000756775901 574261953 /nfs/dbraw/zinc/26/19/53/574261953.db2.gz MREODVQBVNPQIJ-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN CCOc1ccc(C[NH2+]C(C)(C)c2cnn(C)c2)c([O-])c1 ZINC000742374274 574325508 /nfs/dbraw/zinc/32/55/08/574325508.db2.gz UOVDZMWCWPEAIO-UHFFFAOYSA-N 0 3 289.379 2.549 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2cc(C)c(C)cc2[O-])o1 ZINC000742372624 574325700 /nfs/dbraw/zinc/32/57/00/574325700.db2.gz QHEBZYFUFHKHEF-OAHLLOKOSA-N 0 3 275.348 2.734 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC(=O)OC(C)(C)C)c([O-])c1 ZINC000742372561 574325774 /nfs/dbraw/zinc/32/57/74/574325774.db2.gz QDMQLXXQAZVJGY-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1COCCO1 ZINC000725846639 574327990 /nfs/dbraw/zinc/32/79/90/574327990.db2.gz JYMQEUBUHBEWON-QGZVFWFLSA-N 0 3 299.370 2.564 20 10 CFCDHN C[C@H](O)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811009 574395517 /nfs/dbraw/zinc/39/55/17/574395517.db2.gz KITHDHSXYNNHAT-LRDDRELGSA-N 0 3 275.392 2.616 20 10 CFCDHN C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811009 574395518 /nfs/dbraw/zinc/39/55/18/574395518.db2.gz KITHDHSXYNNHAT-LRDDRELGSA-N 0 3 275.392 2.616 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@@H](OC)C2(C)C)c([O-])c1 ZINC000753372452 574401794 /nfs/dbraw/zinc/40/17/94/574401794.db2.gz FJLXNDMLMFMKRD-HUUCEWRRSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000050182528 618082880 /nfs/dbraw/zinc/08/28/80/618082880.db2.gz KXSPFCMYVBUYIZ-LBPRGKRZSA-N 0 3 259.353 2.707 20 10 CFCDHN CCC(C)(C)OCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000308543551 617692615 /nfs/dbraw/zinc/69/26/15/617692615.db2.gz MDPSZMRDYTYOTF-UHFFFAOYSA-N 0 3 255.333 2.826 20 10 CFCDHN COc1ccc(CN2CCS[C@H](C)[C@H]2C)c(O)c1OC ZINC000892066206 617934207 /nfs/dbraw/zinc/93/42/07/617934207.db2.gz BSQRTEKCLPUGQR-GHMZBOCLSA-N 0 3 297.420 2.735 20 10 CFCDHN Oc1ccc(CNCc2ccc3c(c2)CCO3)cc1 ZINC000083410134 618022409 /nfs/dbraw/zinc/02/24/09/618022409.db2.gz CZKAZTWHTPOQQT-UHFFFAOYSA-N 0 3 255.317 2.617 20 10 CFCDHN CC1([NH2+]Cc2cc3c(cc2[O-])OCO3)CCCCC1 ZINC000045042897 618033502 /nfs/dbraw/zinc/03/35/02/618033502.db2.gz QVEJTGNISSVJPS-UHFFFAOYSA-N 0 3 263.337 2.933 20 10 CFCDHN O=[N+]([O-])c1ccccc1CNCc1ccccc1O ZINC000050015518 618078133 /nfs/dbraw/zinc/07/81/33/618078133.db2.gz FHQMIQQBQQTZOA-UHFFFAOYSA-N 0 3 258.277 2.590 20 10 CFCDHN CC[C@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000891251206 618082226 /nfs/dbraw/zinc/08/22/26/618082226.db2.gz AVAUFYXYTCMNDJ-BBRMVZONSA-N 0 3 291.439 2.518 20 10 CFCDHN CCOC1(C)CC[NH+](Cc2c([O-])cccc2OC)CC1 ZINC000814169242 618458438 /nfs/dbraw/zinc/45/84/38/618458438.db2.gz FTDJAAMOAUDKQX-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCN(C2CCC2)CC1 ZINC000840915254 618460652 /nfs/dbraw/zinc/46/06/52/618460652.db2.gz NHMCUSOWRIXJTK-UHFFFAOYSA-N 0 3 287.451 2.731 20 10 CFCDHN C[C@H](CCNCc1c([O-])ccc(Cl)c1F)[NH+](C)C ZINC000895292972 618511428 /nfs/dbraw/zinc/51/14/28/618511428.db2.gz IAQNWPUDZCLLCP-SECBINFHSA-N 0 3 274.767 2.615 20 10 CFCDHN COc1cc(C)cc(CN[C@@H]2CCCn3nccc32)c1O ZINC000895463686 618599578 /nfs/dbraw/zinc/59/95/78/618599578.db2.gz AELPURSFZVQHOC-CYBMUJFWSA-N 0 3 287.363 2.530 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)NCc1ccc2c(c1)CCCN2C ZINC000178191654 618634820 /nfs/dbraw/zinc/63/48/20/618634820.db2.gz SLDXAIQOAHFXFC-CYBMUJFWSA-N 0 3 298.434 2.962 20 10 CFCDHN CO[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C ZINC000784669062 618790552 /nfs/dbraw/zinc/79/05/52/618790552.db2.gz YEMQUAZXNXIODJ-LRDDRELGSA-N 0 3 280.387 2.749 20 10 CFCDHN CO[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C ZINC000784669059 618790654 /nfs/dbraw/zinc/79/06/54/618790654.db2.gz YEMQUAZXNXIODJ-BLLLJJGKSA-N 0 3 280.387 2.749 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(NC(N)=O)cc1)c1ccccc1[O-] ZINC000183405651 618905621 /nfs/dbraw/zinc/90/56/21/618905621.db2.gz QTUAFFWVLRYHOU-NSHDSACASA-N 0 3 285.347 2.734 20 10 CFCDHN C[C@@H](NCc1cccc(N(C)C)n1)c1ccccc1O ZINC000183629926 618907925 /nfs/dbraw/zinc/90/79/25/618907925.db2.gz JXECYLWYRSGJBL-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccc(N(C)C)n1)c1ccccc1[O-] ZINC000183629926 618907926 /nfs/dbraw/zinc/90/79/26/618907926.db2.gz JXECYLWYRSGJBL-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2COCC2(C)C)c1[O-] ZINC000313069953 618974156 /nfs/dbraw/zinc/97/41/56/618974156.db2.gz UBLDLDYODGMQNW-GFCCVEGCSA-N 0 3 285.771 2.569 20 10 CFCDHN CCn1cccc(CNCc2ccc(N(C)C)cc2C)c1=O ZINC000840940594 619085379 /nfs/dbraw/zinc/08/53/79/619085379.db2.gz HOQFQYKGDNYYSR-UHFFFAOYSA-N 0 3 299.418 2.532 20 10 CFCDHN COCC1CCC([NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000840964175 619162316 /nfs/dbraw/zinc/16/23/16/619162316.db2.gz YNRZSAHFQNVZFK-UHFFFAOYSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1ccnc(N)c1CNCc1ccc2c(c1)CCCN2C ZINC000894209795 619258022 /nfs/dbraw/zinc/25/80/22/619258022.db2.gz XGCLHZLHAJWGBH-UHFFFAOYSA-N 0 3 296.418 2.644 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnc[nH]2)cc1F ZINC000894253009 619285020 /nfs/dbraw/zinc/28/50/20/619285020.db2.gz VLCAJKLDLWMVET-UHFFFAOYSA-N 0 3 276.359 2.685 20 10 CFCDHN COc1cccc(CNCc2cnn(C3CCC3)c2)c1O ZINC000894458649 619390966 /nfs/dbraw/zinc/39/09/66/619390966.db2.gz UTQVJLHVWHQDLN-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN CCc1noc(C)c1CNCc1cc(C)cc(OC)c1O ZINC000894858071 619485711 /nfs/dbraw/zinc/48/57/11/619485711.db2.gz WXBKXRJGOXUEEV-UHFFFAOYSA-N 0 3 290.363 2.858 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])[C@@H]1CCCOC1 ZINC000895662299 619578385 /nfs/dbraw/zinc/57/83/85/619578385.db2.gz DIFDWGTYAUQVDI-HUUCEWRRSA-N 0 3 263.381 2.995 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])[C@H]1CCCOC1 ZINC000895662300 619578416 /nfs/dbraw/zinc/57/84/16/619578416.db2.gz DIFDWGTYAUQVDI-LSDHHAIUSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000895791620 619607720 /nfs/dbraw/zinc/60/77/20/619607720.db2.gz UAKIRLMUYIVMIR-ZDUSSCGKSA-N 0 3 261.365 2.749 20 10 CFCDHN CC(C)OC(=O)C1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000895827795 619612740 /nfs/dbraw/zinc/61/27/40/619612740.db2.gz HIKJCEULIHOUKG-UHFFFAOYSA-N 0 3 277.364 2.556 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCC2(C[C@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852383 619622975 /nfs/dbraw/zinc/62/29/75/619622975.db2.gz UNBQSIFPHWOVEO-MRVWCRGKSA-N 0 3 295.354 2.677 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCC2(C[C@@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852385 619623458 /nfs/dbraw/zinc/62/34/58/619623458.db2.gz UNBQSIFPHWOVEO-XBFCOCLRSA-N 0 3 295.354 2.677 20 10 CFCDHN COCC1CN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000895972493 619646878 /nfs/dbraw/zinc/64/68/78/619646878.db2.gz YVVLIACUAFCFRX-UHFFFAOYSA-N 0 3 274.408 2.755 20 10 CFCDHN C[C@]1(C[NH2+]Cc2cc(F)ccc2[O-])CCCCO1 ZINC000896924120 619893902 /nfs/dbraw/zinc/89/39/02/619893902.db2.gz KMLVCODIWGAKMD-CQSZACIVSA-N 0 3 253.317 2.580 20 10 CFCDHN CCCNC(=O)[C@@H](C)[N@H+](CCC)Cc1ccccc1[O-] ZINC000076074322 625392428 /nfs/dbraw/zinc/39/24/28/625392428.db2.gz JWFXQVFLHUKUBP-CYBMUJFWSA-N 0 3 278.396 2.519 20 10 CFCDHN CCCNC(=O)[C@@H](C)[N@@H+](CCC)Cc1ccccc1[O-] ZINC000076074322 625392432 /nfs/dbraw/zinc/39/24/32/625392432.db2.gz JWFXQVFLHUKUBP-CYBMUJFWSA-N 0 3 278.396 2.519 20 10 CFCDHN CCCNC(=O)[C@H](C)[N@H+](CCC)Cc1ccccc1[O-] ZINC000076074324 625392967 /nfs/dbraw/zinc/39/29/67/625392967.db2.gz JWFXQVFLHUKUBP-ZDUSSCGKSA-N 0 3 278.396 2.519 20 10 CFCDHN CCCNC(=O)[C@H](C)[N@@H+](CCC)Cc1ccccc1[O-] ZINC000076074324 625392971 /nfs/dbraw/zinc/39/29/71/625392971.db2.gz JWFXQVFLHUKUBP-ZDUSSCGKSA-N 0 3 278.396 2.519 20 10 CFCDHN CC(C)(C)OC(=O)NC1(C[NH2+]Cc2ccccc2[O-])CC1 ZINC000897423333 620116738 /nfs/dbraw/zinc/11/67/38/620116738.db2.gz XYRFGCZHFWTFHU-UHFFFAOYSA-N 0 3 292.379 2.539 20 10 CFCDHN C[C@@H]([NH2+]CCCN(C)C)c1ccc(Cl)cc1[O-] ZINC000841743094 620178146 /nfs/dbraw/zinc/17/81/46/620178146.db2.gz CBMKEBPULAAFBQ-SNVBAGLBSA-N 0 3 256.777 2.648 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC000897505636 620195656 /nfs/dbraw/zinc/19/56/56/620195656.db2.gz MWBCJJLOEGLBSP-XJKSGUPXSA-N 0 3 261.365 2.748 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(CC(F)F)C1)c1ccccc1[O-] ZINC000841765149 620264575 /nfs/dbraw/zinc/26/45/75/620264575.db2.gz NHVPIXRMYCPGBC-DGCLKSJQSA-N 0 3 284.350 2.772 20 10 CFCDHN Cc1ccc(C[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c([O-])c1 ZINC000898140943 620339204 /nfs/dbraw/zinc/33/92/04/620339204.db2.gz WZFHFNJWOAUCGC-IEBWSBKVSA-N 0 3 297.398 2.736 20 10 CFCDHN Cc1ccc(C[N@@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c([O-])c1 ZINC000898140943 620339205 /nfs/dbraw/zinc/33/92/05/620339205.db2.gz WZFHFNJWOAUCGC-IEBWSBKVSA-N 0 3 297.398 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cccnc1C ZINC000898252016 620357342 /nfs/dbraw/zinc/35/73/42/620357342.db2.gz UQGABNIZDVULEP-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CN(C)CC(C)(C)C[N@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000898306536 620369385 /nfs/dbraw/zinc/36/93/85/620369385.db2.gz LGHRKVBYMVZIOX-UHFFFAOYSA-N 0 3 286.366 2.690 20 10 CFCDHN CN(C)CC(C)(C)C[N@@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000898306536 620369387 /nfs/dbraw/zinc/36/93/87/620369387.db2.gz LGHRKVBYMVZIOX-UHFFFAOYSA-N 0 3 286.366 2.690 20 10 CFCDHN CN(Cc1cc(F)cc(F)c1[O-])CC(C)(C)C[NH+](C)C ZINC000898306536 620369389 /nfs/dbraw/zinc/36/93/89/620369389.db2.gz LGHRKVBYMVZIOX-UHFFFAOYSA-N 0 3 286.366 2.690 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2COC[C@H]2C2CC2)cc1F ZINC000898375750 620377404 /nfs/dbraw/zinc/37/74/04/620377404.db2.gz HDVKJLVKAUKRDG-WFASDCNBSA-N 0 3 296.361 2.545 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2COC[C@@H]2C2CC2)cc1F ZINC000898375747 620377451 /nfs/dbraw/zinc/37/74/51/620377451.db2.gz HDVKJLVKAUKRDG-DOMZBBRYSA-N 0 3 296.361 2.545 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CN)C2CCCCC2)c([O-])c1 ZINC000841039582 620381158 /nfs/dbraw/zinc/38/11/58/620381158.db2.gz VISKTRWMQQHOCS-MRXNPFEDSA-N 0 3 292.423 2.788 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N)CC1)c1cc(Cl)ccc1[O-] ZINC000902404290 621069383 /nfs/dbraw/zinc/06/93/83/621069383.db2.gz DKDWMXBADRHSGV-LLVKDONJSA-N 0 3 254.761 2.578 20 10 CFCDHN CC[C@@H](CN1CCOCC1)[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000903342498 621335392 /nfs/dbraw/zinc/33/53/92/621335392.db2.gz FRMQZNUFGNHSOA-HOCLYGCPSA-N 0 3 292.423 2.544 20 10 CFCDHN CC1(C)CCN(CC[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000903343142 621336420 /nfs/dbraw/zinc/33/64/20/621336420.db2.gz DGKUIHVKXXVPCN-CQSZACIVSA-N 0 3 274.408 2.701 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C2CC(CCO)C2)c2c1c(F)ccc2[O-] ZINC000903328731 621339900 /nfs/dbraw/zinc/33/99/00/621339900.db2.gz FCVXEVOMXFVOLH-PGHLRGPGSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@@H]([NH2+]C1CC(CCO)C1)c1ccc(C)cc1[O-] ZINC000903328782 621340041 /nfs/dbraw/zinc/34/00/41/621340041.db2.gz FKCUFSONGCXTAS-SSDMNJCBSA-N 0 3 263.381 2.902 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@]13C[C@H]1COC31CCC1)CC2 ZINC000903367756 621349228 /nfs/dbraw/zinc/34/92/28/621349228.db2.gz IWLRNDMFUUJSDJ-JJRVBVJISA-N 0 3 285.387 2.928 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC23CCOCC3)c([O-])c1 ZINC000903391624 621351077 /nfs/dbraw/zinc/35/10/77/621351077.db2.gz ZQWTVBRMZAVGEV-CZUORRHYSA-N 0 3 291.391 2.689 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCOC12CCOCC2)c1cc(F)ccc1[O-] ZINC000903389481 621359553 /nfs/dbraw/zinc/35/95/53/621359553.db2.gz LWYNEDJWTPMWJQ-ABAIWWIYSA-N 0 3 295.354 2.520 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC[C@@H](O)C2CC2)c2c1c(F)ccc2[O-] ZINC000903404832 621360525 /nfs/dbraw/zinc/36/05/25/621360525.db2.gz ADWGLUNUXDMJRD-OASPWFOLSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]([NH3+])C(C)(C)C2)c(Cl)c1 ZINC000903987183 621499092 /nfs/dbraw/zinc/49/90/92/621499092.db2.gz YCRZXZUIKLOTIW-CYBMUJFWSA-N 0 3 268.788 2.523 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000904429925 621594559 /nfs/dbraw/zinc/59/45/59/621594559.db2.gz BMSCCDOJTWTHTC-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C2OCCO2)C1 ZINC000905695270 621829159 /nfs/dbraw/zinc/82/91/59/621829159.db2.gz MUSLUWOUSYUDGX-CQSZACIVSA-N 0 3 299.370 2.740 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@H](C2OCCO2)C1 ZINC000905695270 621829167 /nfs/dbraw/zinc/82/91/67/621829167.db2.gz MUSLUWOUSYUDGX-CQSZACIVSA-N 0 3 299.370 2.740 20 10 CFCDHN Cc1cc(C)c(O)c(CN(C)Cc2cccn2C)c1 ZINC000164503259 622958059 /nfs/dbraw/zinc/95/80/59/622958059.db2.gz KPFDXZCVMBKMGG-UHFFFAOYSA-N 0 3 258.365 2.980 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877045915 623020690 /nfs/dbraw/zinc/02/06/90/623020690.db2.gz FZJUQXGDSXIHLX-OAHLLOKOSA-N 0 3 251.370 2.587 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccccc1[O-] ZINC000157817633 623061003 /nfs/dbraw/zinc/06/10/03/623061003.db2.gz JPRVOMIVLCMHQA-IPYPFGDCSA-N 0 3 262.397 2.916 20 10 CFCDHN CN(C)c1ccc(CN[C@@](C)(CO)c2ccccc2)cc1 ZINC000227212424 623100590 /nfs/dbraw/zinc/10/05/90/623100590.db2.gz YAXOGTYXGJPSCM-SFHVURJKSA-N 0 3 284.403 2.750 20 10 CFCDHN COCCOCCCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000168750677 623102645 /nfs/dbraw/zinc/10/26/45/623102645.db2.gz KNFNNRGHAFKHPS-LBPRGKRZSA-N 0 3 285.359 2.625 20 10 CFCDHN CCOc1cccc(CN2CC(CC(F)F)C2)c1O ZINC000822520961 623121087 /nfs/dbraw/zinc/12/10/87/623121087.db2.gz UDUCTFVXMJTBIZ-UHFFFAOYSA-N 0 3 271.307 2.878 20 10 CFCDHN CC[C@H]([NH2+][C@H](C(=O)N(C)CC)C(C)C)c1ccccc1[O-] ZINC000824683674 623545443 /nfs/dbraw/zinc/54/54/43/623545443.db2.gz UHGTUBQBAJSVJP-HOCLYGCPSA-N 0 3 292.423 2.936 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000824820405 623572405 /nfs/dbraw/zinc/57/24/05/623572405.db2.gz FQSQJNSJEDNETR-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000824820405 623572409 /nfs/dbraw/zinc/57/24/09/623572409.db2.gz FQSQJNSJEDNETR-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]([C@H](CO)C2CC2)C2CC2)c1 ZINC000824847392 623577484 /nfs/dbraw/zinc/57/74/84/623577484.db2.gz YQMSUMLUIMHJPP-NVXWUHKLSA-N 0 3 275.392 2.587 20 10 CFCDHN CNC(=O)C[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000825068664 623622442 /nfs/dbraw/zinc/62/24/42/623622442.db2.gz USYJDLZDPZLVDV-ZDUSSCGKSA-N 0 3 298.386 2.673 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@@H]1C[C@@H](OC)C12CCC2 ZINC000825104381 623630957 /nfs/dbraw/zinc/63/09/57/623630957.db2.gz VTDMUJJAYGFZGT-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@@H]1C[C@@H](OC)C12CCC2 ZINC000825104381 623630963 /nfs/dbraw/zinc/63/09/63/623630963.db2.gz VTDMUJJAYGFZGT-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cc(CNCCF)c(O)c(C(C)(C)C)c1 ZINC000825757562 623751108 /nfs/dbraw/zinc/75/11/08/623751108.db2.gz PYBUNZQEMDUWOJ-UHFFFAOYSA-N 0 3 255.333 2.757 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000827006653 623922926 /nfs/dbraw/zinc/92/29/26/623922926.db2.gz RSICXVGNHZHNIW-HAQNSBGRSA-N 0 3 285.771 2.711 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCO[C@@H]2CC2(F)F)c1[O-] ZINC000827072244 623935554 /nfs/dbraw/zinc/93/55/54/623935554.db2.gz HNXKAXWYDFFJAB-LLVKDONJSA-N 0 3 291.725 2.868 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H]3COC[C@]3(C)C2)c1[O-] ZINC000827284704 623981349 /nfs/dbraw/zinc/98/13/49/623981349.db2.gz VNJGMXUTPUWCPH-NHYWBVRUSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1[O-] ZINC000827284704 623981351 /nfs/dbraw/zinc/98/13/51/623981351.db2.gz VNJGMXUTPUWCPH-NHYWBVRUSA-N 0 3 297.782 2.523 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[NH2+][C@H]1C[C@H](O)C1 ZINC000827827049 624103794 /nfs/dbraw/zinc/10/37/94/624103794.db2.gz OKKRPKZRJWITHS-WKILWMFISA-N 0 3 299.370 2.584 20 10 CFCDHN C[C@H](NC(=O)[C@H](C)N1CCCCCC1)c1ccccc1O ZINC000827978288 624145316 /nfs/dbraw/zinc/14/53/16/624145316.db2.gz OBHHKLXPJDPQCN-KBPBESRZSA-N 0 3 290.407 2.834 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000929977466 624340672 /nfs/dbraw/zinc/34/06/72/624340672.db2.gz UVSMBHDELREMHO-WCQYABFASA-N 0 3 289.297 2.934 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000929977466 624340674 /nfs/dbraw/zinc/34/06/74/624340674.db2.gz UVSMBHDELREMHO-WCQYABFASA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC2(CCC2)O1 ZINC000830740465 624833616 /nfs/dbraw/zinc/83/36/16/624833616.db2.gz TXHUKBXQLFXKMA-CQSZACIVSA-N 0 3 274.408 2.896 20 10 CFCDHN CCCC[N@H+](CCOC)Cc1cc(F)ccc1[O-] ZINC000180137552 624999295 /nfs/dbraw/zinc/99/92/95/624999295.db2.gz QFEVXTSVPFGHTI-UHFFFAOYSA-N 0 3 255.333 2.780 20 10 CFCDHN CCCC[N@@H+](CCOC)Cc1cc(F)ccc1[O-] ZINC000180137552 624999296 /nfs/dbraw/zinc/99/92/96/624999296.db2.gz QFEVXTSVPFGHTI-UHFFFAOYSA-N 0 3 255.333 2.780 20 10 CFCDHN C[C@H](C[C@H]1CCOC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834624328 625741118 /nfs/dbraw/zinc/74/11/18/625741118.db2.gz JMNOSUUFOCXRPE-YRGRVCCFSA-N 0 3 261.365 2.784 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834778813 625853130 /nfs/dbraw/zinc/85/31/30/625853130.db2.gz GLDOHGWVSIEKRN-SJORKVTESA-N 0 3 297.398 2.881 20 10 CFCDHN C[C@@H]1COCC[C@@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834798896 625865382 /nfs/dbraw/zinc/86/53/82/625865382.db2.gz RCCVGLMDMCXYNV-BNOWGMLFSA-N 0 3 261.365 2.642 20 10 CFCDHN C[C@@H]([NH2+]CC1(CF)CCOCC1)c1ccccc1[O-] ZINC000834884819 625908985 /nfs/dbraw/zinc/90/89/85/625908985.db2.gz CVBZCAWMGCWSQW-GFCCVEGCSA-N 0 3 267.344 2.809 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-])C(=O)NC ZINC000834913881 625920656 /nfs/dbraw/zinc/92/06/56/625920656.db2.gz QKNFAEDBAPCEBN-CABZTGNLSA-N 0 3 284.787 2.529 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@H]2CCCCN2C1=O)c1ccccc1[O-] ZINC000834914274 625921451 /nfs/dbraw/zinc/92/14/51/625921451.db2.gz LSUNMRUGQPGSOA-SNPRPXQTSA-N 0 3 288.391 2.586 20 10 CFCDHN COc1ccc(O)c(CNCc2cnn(C3CCC3)c2)c1 ZINC000921741157 626103004 /nfs/dbraw/zinc/10/30/04/626103004.db2.gz SOCQAZVNEUJECM-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN c1cc2n(n1)CCC[C@@H]2NCc1ccc2c(c1)CCCO2 ZINC000922319382 626268951 /nfs/dbraw/zinc/26/89/51/626268951.db2.gz BRGUKFDVNOQPBX-HNNXBMFYSA-N 0 3 283.375 2.833 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@H]2[C@@H]2C[C@H]2C)c([O-])c1 ZINC000922510508 626300921 /nfs/dbraw/zinc/30/09/21/626300921.db2.gz HTPAXWRNWMZGKI-QPKOPYBWSA-N 0 3 261.365 2.925 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1ccccc1[O-])c1cccc(F)c1 ZINC000922563422 626311855 /nfs/dbraw/zinc/31/18/55/626311855.db2.gz GYFQXEQQLHERIV-MRXNPFEDSA-N 0 3 275.323 2.529 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@]2(C)CCCCO2)c([O-])c1 ZINC000922819119 626373075 /nfs/dbraw/zinc/37/30/75/626373075.db2.gz ZEZGHTGOBUUNCP-MRXNPFEDSA-N 0 3 279.380 2.840 20 10 CFCDHN COc1cc(O)c(CN2CC3(C2)CCCC3)cc1OC ZINC000839104400 626524987 /nfs/dbraw/zinc/52/49/87/626524987.db2.gz JHHQBOPDTWDDJL-UHFFFAOYSA-N 0 3 277.364 2.785 20 10 CFCDHN C[C@@H](NC1COC(C)(C)OC1)c1ccc(N(C)C)cc1 ZINC000757697774 626558957 /nfs/dbraw/zinc/55/89/57/626558957.db2.gz KZUPWCKSLIWREX-GFCCVEGCSA-N 0 3 278.396 2.555 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C2COC(C)(C)OC2)c2c1c(F)ccc2[O-] ZINC000757698350 626559074 /nfs/dbraw/zinc/55/90/74/626559074.db2.gz PVDBPHANQISWDV-CABZTGNLSA-N 0 3 295.354 2.821 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCc2ccccn2)c([O-])c1 ZINC000757887659 626566405 /nfs/dbraw/zinc/56/64/05/626566405.db2.gz UAJUMXSJFPDODI-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCc2ccccn2)c([O-])c1 ZINC000757887659 626566406 /nfs/dbraw/zinc/56/64/06/626566406.db2.gz UAJUMXSJFPDODI-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCC(C)=O)cc1 ZINC000759641251 626679256 /nfs/dbraw/zinc/67/92/56/626679256.db2.gz CLMCLVOIXOACFI-UHFFFAOYSA-N 0 3 262.397 2.944 20 10 CFCDHN COC[C@@H](C[N@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000851769828 634517554 /nfs/dbraw/zinc/51/75/54/634517554.db2.gz KLYCMNFKTFOKBY-MRXNPFEDSA-N 0 3 293.407 2.798 20 10 CFCDHN COC[C@@H](C[N@@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000851769828 634517560 /nfs/dbraw/zinc/51/75/60/634517560.db2.gz KLYCMNFKTFOKBY-MRXNPFEDSA-N 0 3 293.407 2.798 20 10 CFCDHN COc1cc(Cl)cc(C[NH+]2CCC(CCO)CC2)c1[O-] ZINC000761191411 626814709 /nfs/dbraw/zinc/81/47/09/626814709.db2.gz TWCQPHBHVRYTIC-UHFFFAOYSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H]2OC)c1[O-] ZINC000761216462 626816577 /nfs/dbraw/zinc/81/65/77/626816577.db2.gz SWRWIQSGAIVMMD-GWCFXTLKSA-N 0 3 299.798 2.959 20 10 CFCDHN CCC[N@H+](CCCc1nc(C)no1)Cc1ccccc1[O-] ZINC000763521450 626994490 /nfs/dbraw/zinc/99/44/90/626994490.db2.gz RUUFKCNWVKQNAP-UHFFFAOYSA-N 0 3 289.379 2.928 20 10 CFCDHN CCC[N@@H+](CCCc1nc(C)no1)Cc1ccccc1[O-] ZINC000763521450 626994492 /nfs/dbraw/zinc/99/44/92/626994492.db2.gz RUUFKCNWVKQNAP-UHFFFAOYSA-N 0 3 289.379 2.928 20 10 CFCDHN CC(C)C1CC[NH+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768465827 627345238 /nfs/dbraw/zinc/34/52/38/627345238.db2.gz MGFFKRMXCDHQFY-INIZCTEOSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)C1CC[NH+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768465828 627345418 /nfs/dbraw/zinc/34/54/18/627345418.db2.gz MGFFKRMXCDHQFY-MRXNPFEDSA-N 0 3 291.391 2.686 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])Cc1ccccc1-n1cncn1 ZINC000768873547 627381958 /nfs/dbraw/zinc/38/19/58/627381958.db2.gz PNOHAYNNLSVERN-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])Cc1ccccc1-n1cncn1 ZINC000768873547 627381959 /nfs/dbraw/zinc/38/19/59/627381959.db2.gz PNOHAYNNLSVERN-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000769325919 627424632 /nfs/dbraw/zinc/42/46/32/627424632.db2.gz DFHJMRZFNDDQPG-LBPRGKRZSA-N 0 3 280.799 2.714 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@H]1CC[N@H+](C2CC2)C1 ZINC000769325919 627424636 /nfs/dbraw/zinc/42/46/36/627424636.db2.gz DFHJMRZFNDDQPG-LBPRGKRZSA-N 0 3 280.799 2.714 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC2CCOCC2)c([O-])c1 ZINC000769383304 627432442 /nfs/dbraw/zinc/43/24/42/627432442.db2.gz HAFSSBDCHNDUIG-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC2CCOCC2)c([O-])c1 ZINC000769383304 627432447 /nfs/dbraw/zinc/43/24/47/627432447.db2.gz HAFSSBDCHNDUIG-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H](CO)C(C)(C)C)c([O-])c1 ZINC000769534935 627453035 /nfs/dbraw/zinc/45/30/35/627453035.db2.gz YNYVRVQMGOHMRL-HNNXBMFYSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c([O-])c1 ZINC000769534935 627453039 /nfs/dbraw/zinc/45/30/39/627453039.db2.gz YNYVRVQMGOHMRL-HNNXBMFYSA-N 0 3 281.396 2.630 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2ccccc2[O-])[C@@H](CC)CN1C(C)=O ZINC000770504226 627526111 /nfs/dbraw/zinc/52/61/11/627526111.db2.gz BIPMTZBLVLLMLW-JKSUJKDBSA-N 0 3 290.407 2.614 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2ccccc2[O-])[C@@H](CC)CN1C(C)=O ZINC000770504226 627526115 /nfs/dbraw/zinc/52/61/15/627526115.db2.gz BIPMTZBLVLLMLW-JKSUJKDBSA-N 0 3 290.407 2.614 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1ccccc1[O-])CC1CC1 ZINC000770510904 627526426 /nfs/dbraw/zinc/52/64/26/627526426.db2.gz UYVINCSUOMUGOO-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1ccccc1[O-])CC1CC1 ZINC000770510904 627526428 /nfs/dbraw/zinc/52/64/28/627526428.db2.gz UYVINCSUOMUGOO-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000770506179 627526578 /nfs/dbraw/zinc/52/65/78/627526578.db2.gz WVQWSRNRTKWXQW-ZFWWWQNUSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000770506179 627526582 /nfs/dbraw/zinc/52/65/82/627526582.db2.gz WVQWSRNRTKWXQW-ZFWWWQNUSA-N 0 3 261.365 2.641 20 10 CFCDHN COc1cccc(O)c1CN1CCc2ccccc2C1 ZINC000771927785 627649740 /nfs/dbraw/zinc/64/97/40/627649740.db2.gz PRXVAQXYSSHAKB-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCc2ccccc2C1 ZINC000771927785 627649745 /nfs/dbraw/zinc/64/97/45/627649745.db2.gz PRXVAQXYSSHAKB-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCc2ccccc2C1 ZINC000771927785 627649747 /nfs/dbraw/zinc/64/97/47/627649747.db2.gz PRXVAQXYSSHAKB-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN CC(C)[C@@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N(C)C ZINC000773018929 627769626 /nfs/dbraw/zinc/76/96/26/627769626.db2.gz JKESNTARTHJBIP-CJNGLKHVSA-N 0 3 291.439 2.516 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CC[C@H](C)C1)c1ccccc1[O-] ZINC000775416706 628023963 /nfs/dbraw/zinc/02/39/63/628023963.db2.gz XPEFNCHDJHWSKN-DZGCQCFKSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@H]([NH2+]CCCN1CCCCC1=O)c1ccccc1[O-] ZINC000775501701 628032150 /nfs/dbraw/zinc/03/21/50/628032150.db2.gz KJKILSZFAUNJDT-HNNXBMFYSA-N 0 3 290.407 2.836 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCC(OC)CC1)c1ccccc1[O-] ZINC000775511253 628033326 /nfs/dbraw/zinc/03/33/26/628033326.db2.gz CVPQZFLDINHIKO-INIZCTEOSA-N 0 3 292.423 2.544 20 10 CFCDHN CC[C@@H]([NH2+]C1COC(C)(C)OC1)c1ccccc1[O-] ZINC000775552485 628036420 /nfs/dbraw/zinc/03/64/20/628036420.db2.gz WOJACSQBHCDTGS-CYBMUJFWSA-N 0 3 265.353 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)C(C)(C)O)c1[O-] ZINC000776151661 628107547 /nfs/dbraw/zinc/10/75/47/628107547.db2.gz SADRYTOHDSZGFJ-VIFPVBQESA-N 0 3 257.761 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC[C@H](C)CO)c1[O-] ZINC000776253125 628122775 /nfs/dbraw/zinc/12/27/75/628122775.db2.gz IRILCWWHKMDVGN-JTQLQIEISA-N 0 3 271.788 2.852 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000779025247 628346140 /nfs/dbraw/zinc/34/61/40/628346140.db2.gz FEGFNTJHVWBFHI-MRXNPFEDSA-N 0 3 279.355 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000779025247 628346143 /nfs/dbraw/zinc/34/61/43/628346143.db2.gz FEGFNTJHVWBFHI-MRXNPFEDSA-N 0 3 279.355 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000779028947 628346915 /nfs/dbraw/zinc/34/69/15/628346915.db2.gz LSEYMUZLHDBXQL-RISCZKNCSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000779028947 628346918 /nfs/dbraw/zinc/34/69/18/628346918.db2.gz LSEYMUZLHDBXQL-RISCZKNCSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000779035306 628347934 /nfs/dbraw/zinc/34/79/34/628347934.db2.gz YIGMTEROIZZVHV-QWHCGFSZSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000779035306 628347935 /nfs/dbraw/zinc/34/79/35/628347935.db2.gz YIGMTEROIZZVHV-QWHCGFSZSA-N 0 3 279.355 2.780 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](O)C2(C)C)c2c1c(F)ccc2[O-] ZINC000779066469 628349291 /nfs/dbraw/zinc/34/92/91/628349291.db2.gz XSKMYYAPJQSFDV-RFUOJGKKSA-N 0 3 279.355 2.829 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](O)C2(C)C)c2c1c(F)ccc2[O-] ZINC000779066465 628349550 /nfs/dbraw/zinc/34/95/50/628349550.db2.gz XSKMYYAPJQSFDV-LGOOBZPGSA-N 0 3 279.355 2.829 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2[O-])c(C)c1 ZINC000779094103 628352066 /nfs/dbraw/zinc/35/20/66/628352066.db2.gz WIQPGZWGDYCYOK-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000779154582 628356848 /nfs/dbraw/zinc/35/68/48/628356848.db2.gz WBTBZPOVTLBXTQ-BBRMVZONSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000779154582 628356853 /nfs/dbraw/zinc/35/68/53/628356853.db2.gz WBTBZPOVTLBXTQ-BBRMVZONSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+](CC(C)(C)O)C2CC2)c([O-])c1 ZINC000779194738 628358856 /nfs/dbraw/zinc/35/88/56/628358856.db2.gz YQVBHGIXFUSEMN-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC(C)(C)O)C2CC2)c([O-])c1 ZINC000779194738 628358858 /nfs/dbraw/zinc/35/88/58/628358858.db2.gz YQVBHGIXFUSEMN-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000779188652 628359094 /nfs/dbraw/zinc/35/90/94/628359094.db2.gz WCBQFZMJXMLKSR-AWEZNQCLSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000779188652 628359098 /nfs/dbraw/zinc/35/90/98/628359098.db2.gz WCBQFZMJXMLKSR-AWEZNQCLSA-N 0 3 291.391 2.792 20 10 CFCDHN COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000779605720 628389895 /nfs/dbraw/zinc/38/98/95/628389895.db2.gz XSXLUQJRTQPHCO-CQSZACIVSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000779605720 628389896 /nfs/dbraw/zinc/38/98/96/628389896.db2.gz XSXLUQJRTQPHCO-CQSZACIVSA-N 0 3 291.391 2.803 20 10 CFCDHN COCC[C@@H](NCc1cccc(OC)c1O)c1ccco1 ZINC000779991977 628425452 /nfs/dbraw/zinc/42/54/52/628425452.db2.gz MBTQTJMPFRKHRW-CYBMUJFWSA-N 0 3 291.347 2.861 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)c1ccccc1[O-] ZINC000783508232 628714410 /nfs/dbraw/zinc/71/44/10/628714410.db2.gz HQIJGSCVBXMZLN-MNOVXSKESA-N 0 3 288.313 2.679 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)C[C@H](C)O)c1[O-] ZINC000783602553 628725534 /nfs/dbraw/zinc/72/55/34/628725534.db2.gz PDHMQBOHYZDVPP-UWVGGRQHSA-N 0 3 257.761 2.603 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CCO[C@@H](C)C1 ZINC000784645918 628833793 /nfs/dbraw/zinc/83/37/93/628833793.db2.gz CUEBZWCDPIVDND-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](OC)C2)c([O-])c1 ZINC000784667112 628835905 /nfs/dbraw/zinc/83/59/05/628835905.db2.gz DYKLUDVNNDITOZ-WBMJQRKESA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](OC)C2)c([O-])c1 ZINC000784667112 628835907 /nfs/dbraw/zinc/83/59/07/628835907.db2.gz DYKLUDVNNDITOZ-WBMJQRKESA-N 0 3 279.380 2.648 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCOCC(F)F)c2c1c(F)ccc2[O-] ZINC000788259205 629054035 /nfs/dbraw/zinc/05/40/35/629054035.db2.gz LNTHBFQBKMERQG-WCBMZHEXSA-N 0 3 289.297 2.951 20 10 CFCDHN CCOC(=O)CC1([NH2+]Cc2ccccc2[O-])CCCC1 ZINC000789779955 629187740 /nfs/dbraw/zinc/18/77/40/629187740.db2.gz SJYNTUHFQYWKTO-UHFFFAOYSA-N 0 3 277.364 2.748 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCSC2)c([O-])c1 ZINC000790486630 629242347 /nfs/dbraw/zinc/24/23/47/629242347.db2.gz XIXQUFFTKUWRBS-LLVKDONJSA-N 0 3 267.394 2.634 20 10 CFCDHN CN1CCCC(C)(C)[C@@H]1C[NH2+]Cc1ccccc1[O-] ZINC000790485843 629242646 /nfs/dbraw/zinc/24/26/46/629242646.db2.gz OXWQUBKCKDRZMU-HNNXBMFYSA-N 0 3 262.397 2.602 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000790934132 629272040 /nfs/dbraw/zinc/27/20/40/629272040.db2.gz FZAFHDBCYZGUKN-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000790934132 629272042 /nfs/dbraw/zinc/27/20/42/629272042.db2.gz FZAFHDBCYZGUKN-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1C[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000790949840 629273607 /nfs/dbraw/zinc/27/36/07/629273607.db2.gz PMSWXSSICMODCV-QWHCGFSZSA-N 0 3 298.789 2.901 20 10 CFCDHN Cc1nn(C)c(C)c1CNC/C=C\c1ccc(N(C)C)cc1 ZINC000835038527 629333367 /nfs/dbraw/zinc/33/33/67/629333367.db2.gz VVCDIVADYGOEOU-SREVYHEPSA-N 0 3 298.434 2.906 20 10 CFCDHN Cc1n[nH]cc1CNC/C=C/c1ccc(N(C)C)cc1 ZINC000835039135 629333894 /nfs/dbraw/zinc/33/38/94/629333894.db2.gz BFZYWOGKRMDUPU-SNAWJCMRSA-N 0 3 270.380 2.587 20 10 CFCDHN C[C@@H](NC/C=C/c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000835041614 629336057 /nfs/dbraw/zinc/33/60/57/629336057.db2.gz YFOUTMMBBTVLGL-VBROQKIQSA-N 0 3 284.407 2.850 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCSCC[C@@H]1C ZINC000792196285 629408599 /nfs/dbraw/zinc/40/85/99/629408599.db2.gz HLKBTEBGLCUSQG-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCSCC[C@@H]1C ZINC000792196285 629408602 /nfs/dbraw/zinc/40/86/02/629408602.db2.gz HLKBTEBGLCUSQG-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN CO[C@@]1(C)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000793216498 629506936 /nfs/dbraw/zinc/50/69/36/629506936.db2.gz HVGKWEDQQPGCHJ-INIZCTEOSA-N 0 3 280.387 2.893 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)CC2CCC2)c1[O-] ZINC000793321824 629526599 /nfs/dbraw/zinc/52/65/99/629526599.db2.gz KKRSJYNMKUZYDQ-CQSZACIVSA-N 0 3 283.799 2.995 20 10 CFCDHN CCc1ncc(C[NH2+]Cc2ccc(OC)cc2[O-])s1 ZINC000793386423 629535817 /nfs/dbraw/zinc/53/58/17/629535817.db2.gz PTFRDYDLOWJXJT-UHFFFAOYSA-N 0 3 278.377 2.710 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCCC[C@@H]2CCO)c1 ZINC000793607608 629578139 /nfs/dbraw/zinc/57/81/39/629578139.db2.gz BBAWBZFOLGOWBR-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCCC[C@@H]2CCO)c1 ZINC000793607608 629578143 /nfs/dbraw/zinc/57/81/43/629578143.db2.gz BBAWBZFOLGOWBR-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN COc1cc(C)cc(CN2CCC(F)(F)CC2)c1O ZINC000794689167 629675753 /nfs/dbraw/zinc/67/57/53/629675753.db2.gz YVPMLYFKNGISBV-UHFFFAOYSA-N 0 3 271.307 2.940 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000794809038 629688802 /nfs/dbraw/zinc/68/88/02/629688802.db2.gz PFZSKCNAOXDECV-ZBFHGGJFSA-N 0 3 293.407 2.937 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794812050 629689319 /nfs/dbraw/zinc/68/93/19/629689319.db2.gz BUIRBDQUKADBEL-HLLBOEOZSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)CC1CC1)c1ccc(C)cc1[O-] ZINC000794818645 629690574 /nfs/dbraw/zinc/69/05/74/629690574.db2.gz UKKUPOQCEPOOES-ZFWWWQNUSA-N 0 3 263.381 2.902 20 10 CFCDHN CNC(=O)C[C@H]([NH2+][C@H](C)c1ccccc1[O-])c1ccccc1 ZINC000795849707 629841300 /nfs/dbraw/zinc/84/13/00/629841300.db2.gz QGXAKDXPFFVSOY-CJNGLKHVSA-N 0 3 298.386 2.920 20 10 CFCDHN CCN(CC)c1ccc(CN(C)Cc2cnc[nH]2)cc1 ZINC000796438910 629917962 /nfs/dbraw/zinc/91/79/62/629917962.db2.gz FYCMIIRPXRRVKJ-UHFFFAOYSA-N 0 3 272.396 2.888 20 10 CFCDHN COC(=O)N1CCC(C[NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000797093739 630015641 /nfs/dbraw/zinc/01/56/41/630015641.db2.gz KJLJBVBEUNMBCY-GFCCVEGCSA-N 0 3 292.379 2.521 20 10 CFCDHN CCCCN(Cc1ccccc1O)[C@@H](C(=O)OC)C1CC1 ZINC000801596034 630461247 /nfs/dbraw/zinc/46/12/47/630461247.db2.gz ZVYNZVLDZLMSOR-MRXNPFEDSA-N 0 3 291.391 2.946 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](CO)c1cccnc1)c1ccccc1[O-] ZINC000806179017 630780313 /nfs/dbraw/zinc/78/03/13/630780313.db2.gz NFXLSQBLMXKCFF-GDBMZVCRSA-N 0 3 286.375 2.604 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCOC2)c1[O-] ZINC000808708852 631031702 /nfs/dbraw/zinc/03/17/02/631031702.db2.gz RAQOYVDUGLWKQL-KOLCDFICSA-N 0 3 255.745 2.794 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)C[S@](C)=O)c1[O-] ZINC000808714347 631033793 /nfs/dbraw/zinc/03/37/93/631033793.db2.gz VLDSRTKCRJIHDD-JJQCHNSYSA-N 0 3 289.828 2.772 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccccc1[O-])[C@H](O)C(C)C ZINC000840882079 631250022 /nfs/dbraw/zinc/25/00/22/631250022.db2.gz MAWOQRAKMOBAIC-OSAQELSMSA-N 0 3 251.370 2.838 20 10 CFCDHN Cc1cc(Br)c(O)c(CNc2nccn2C)c1 ZINC000840887129 631252189 /nfs/dbraw/zinc/25/21/89/631252189.db2.gz DPYRJRBETTYBAX-UHFFFAOYSA-N 0 3 296.168 2.809 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1ccccc1[O-] ZINC000840888069 631252996 /nfs/dbraw/zinc/25/29/96/631252996.db2.gz WQYIHEKQDOHJAJ-XWIASGKRSA-N 0 3 271.307 2.592 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)C(=O)NC(C)C)c1[O-] ZINC000840890899 631253756 /nfs/dbraw/zinc/25/37/56/631253756.db2.gz PHQHDAKYSJTBEH-QWRGUYRKSA-N 0 3 298.814 2.918 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@H]1CCn2ccnc21 ZINC000840894304 631254707 /nfs/dbraw/zinc/25/47/07/631254707.db2.gz PXZDAYPPGXVHJW-PBHICJAKSA-N 0 3 298.434 2.923 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH2+]C(C)(C)C2)c(Cl)c1 ZINC000840912924 631262253 /nfs/dbraw/zinc/26/22/53/631262253.db2.gz PLHGRBALOAWASS-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CC2(CC(F)C2)C1 ZINC000840953556 631281048 /nfs/dbraw/zinc/28/10/48/631281048.db2.gz UYGYSFGFRTZBLI-UHFFFAOYSA-N 0 3 262.372 2.995 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000840956357 631282665 /nfs/dbraw/zinc/28/26/65/631282665.db2.gz REPXNQWORFFHHW-CVEARBPZSA-N 0 3 269.344 2.700 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000840956357 631282674 /nfs/dbraw/zinc/28/26/74/631282674.db2.gz REPXNQWORFFHHW-CVEARBPZSA-N 0 3 269.344 2.700 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000840956360 631283209 /nfs/dbraw/zinc/28/32/09/631283209.db2.gz REPXNQWORFFHHW-JKSUJKDBSA-N 0 3 269.344 2.700 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000840956360 631283221 /nfs/dbraw/zinc/28/32/21/631283221.db2.gz REPXNQWORFFHHW-JKSUJKDBSA-N 0 3 269.344 2.700 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@@H](C)O[C@H]2C)c([O-])c1 ZINC000840962642 631285916 /nfs/dbraw/zinc/28/59/16/631285916.db2.gz DXKVGNSZOZLMMG-DYEKYZERSA-N 0 3 279.380 2.694 20 10 CFCDHN COC1([C@@H](C)[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000840970710 631289943 /nfs/dbraw/zinc/28/99/43/631289943.db2.gz WGELJMJFYQZJLF-SNVBAGLBSA-N 0 3 253.317 2.579 20 10 CFCDHN CC(C)[C@H]([NH3+])CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000841028904 631307588 /nfs/dbraw/zinc/30/75/88/631307588.db2.gz KTQMURKVSCNQGI-LLVKDONJSA-N 0 3 277.195 2.772 20 10 CFCDHN CCCC[C@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841029472 631310822 /nfs/dbraw/zinc/31/08/22/631310822.db2.gz BVGQNWYHHJAZCE-SECBINFHSA-N 0 3 274.767 2.792 20 10 CFCDHN CCCC[C@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841029472 631310827 /nfs/dbraw/zinc/31/08/27/631310827.db2.gz BVGQNWYHHJAZCE-SECBINFHSA-N 0 3 274.767 2.792 20 10 CFCDHN CCc1nn(C)c(Cl)c1CNCCc1ccc(N)cc1 ZINC000841033785 631313745 /nfs/dbraw/zinc/31/37/45/631313745.db2.gz BDJVOMRROHBBTA-UHFFFAOYSA-N 0 3 292.814 2.550 20 10 CFCDHN NC1(C[NH2+]Cc2cccc(Cl)c2[O-])CCCCC1 ZINC000841039576 631318327 /nfs/dbraw/zinc/31/83/27/631318327.db2.gz VDVPFBKXZOZNHR-UHFFFAOYSA-N 0 3 268.788 2.797 20 10 CFCDHN [NH3+]C1(CNCc2cc(Cl)cc(Cl)c2[O-])CCC1 ZINC000841051463 631322781 /nfs/dbraw/zinc/32/27/81/631322781.db2.gz QOXZSDLOAGECMR-UHFFFAOYSA-N 0 3 275.179 2.670 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2cncn2C)c2c1c(F)ccc2[O-] ZINC000810243562 631348735 /nfs/dbraw/zinc/34/87/35/631348735.db2.gz QFNKDVKQPBBSHF-JOYOIKCWSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1[O-])CN(C)C ZINC000841756827 631468233 /nfs/dbraw/zinc/46/82/33/631468233.db2.gz KLPRVRHYFXTMJH-QWRGUYRKSA-N 0 3 270.804 2.894 20 10 CFCDHN COc1ccc(C[NH2+]C[C@H](CC(C)C)OC)c([O-])c1 ZINC000841888899 631488170 /nfs/dbraw/zinc/48/81/70/631488170.db2.gz UQXLFOZZIWKEJZ-AWEZNQCLSA-N 0 3 267.369 2.552 20 10 CFCDHN CC(=O)c1cc(Cl)cc(C[NH2+][C@H](CN)C(C)(C)C)c1[O-] ZINC000842475531 631640187 /nfs/dbraw/zinc/64/01/87/631640187.db2.gz RXAZRMIFMQZDND-CYBMUJFWSA-N 0 3 298.814 2.711 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1C[C@@H](OC(C)(C)C)C1 ZINC000842761015 631732144 /nfs/dbraw/zinc/73/21/44/631732144.db2.gz QDVZMJSCOZYBDM-TXEJJXNPSA-N 0 3 279.380 2.837 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(Cl)c1[O-])C1CCNCC1 ZINC000843044666 631812016 /nfs/dbraw/zinc/81/20/16/631812016.db2.gz DXSDLNGZAVBTFU-UHFFFAOYSA-N 0 3 289.206 2.883 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(Cl)c1[O-])C1CCNCC1 ZINC000843044666 631812020 /nfs/dbraw/zinc/81/20/20/631812020.db2.gz DXSDLNGZAVBTFU-UHFFFAOYSA-N 0 3 289.206 2.883 20 10 CFCDHN CC(C)[C@@H]([NH3+])CCN(C)Cc1cc(Cl)cc(F)c1[O-] ZINC000843056756 631820449 /nfs/dbraw/zinc/82/04/49/631820449.db2.gz ZCGVHIQUKGUCTG-ZDUSSCGKSA-N 0 3 288.794 2.990 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@]3(C2)CCC[NH2+]C3)c(Cl)c1 ZINC000843118371 631840301 /nfs/dbraw/zinc/84/03/01/631840301.db2.gz HCHCXHWTYOXNEF-INIZCTEOSA-N 0 3 294.826 2.930 20 10 CFCDHN C=Cn1cc(CN[C@H](C)c2cc(OC)ccc2O)cn1 ZINC000813330712 631903233 /nfs/dbraw/zinc/90/32/33/631903233.db2.gz DVRSTSYSYKWTCI-LLVKDONJSA-N 0 3 273.336 2.549 20 10 CFCDHN COc1cccc(CNCc2ccnn2CC(C)C)c1O ZINC000843409472 631946914 /nfs/dbraw/zinc/94/69/14/631946914.db2.gz SDMJPHGSXOMKFY-UHFFFAOYSA-N 0 3 289.379 2.543 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843417180 631948521 /nfs/dbraw/zinc/94/85/21/631948521.db2.gz QOZWHUWHETYGKE-HUUCEWRRSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843417180 631948525 /nfs/dbraw/zinc/94/85/25/631948525.db2.gz QOZWHUWHETYGKE-HUUCEWRRSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843417075 631949164 /nfs/dbraw/zinc/94/91/64/631949164.db2.gz OWENVHZDHHUAKJ-HIFRSBDPSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843417075 631949166 /nfs/dbraw/zinc/94/91/66/631949166.db2.gz OWENVHZDHHUAKJ-HIFRSBDPSA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419748 631950214 /nfs/dbraw/zinc/95/02/14/631950214.db2.gz SADVGASXQBBKCV-ZDUSSCGKSA-N 0 3 272.323 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419748 631950217 /nfs/dbraw/zinc/95/02/17/631950217.db2.gz SADVGASXQBBKCV-ZDUSSCGKSA-N 0 3 272.323 2.916 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000815081762 632198483 /nfs/dbraw/zinc/19/84/83/632198483.db2.gz NRTJNFUNRARYOA-SWLSCSKDSA-N 0 3 289.350 2.786 20 10 CFCDHN CCc1nocc1CNCCCSc1nccs1 ZINC000815125444 632208277 /nfs/dbraw/zinc/20/82/77/632208277.db2.gz ZURVUFSJVPYKDL-UHFFFAOYSA-N 0 3 283.422 2.966 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC2CC(O)C2)c([O-])c1 ZINC000815621366 632299295 /nfs/dbraw/zinc/29/92/95/632299295.db2.gz SEFJIIHPZSHVEG-HSBZDZAISA-N 0 3 263.381 2.821 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCO[C@@]3(CCOC3)C2)ccc2ccccc21 ZINC000816570640 632487884 /nfs/dbraw/zinc/48/78/84/632487884.db2.gz BDDNYUPJLICHFW-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1c(C[N@H+]2CCO[C@@]3(CCOC3)C2)ccc2ccccc21 ZINC000816570640 632487887 /nfs/dbraw/zinc/48/78/87/632487887.db2.gz BDDNYUPJLICHFW-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN CC[C@H]1CN(C)CCN1Cc1cc(Cl)cc(OC)c1O ZINC000816660700 632506459 /nfs/dbraw/zinc/50/64/59/632506459.db2.gz MQWRIRFXVDXDRF-ZDUSSCGKSA-N 0 3 298.814 2.580 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCO[C@@H](CC)C2)c([O-])c1 ZINC000817415699 632626467 /nfs/dbraw/zinc/62/64/67/632626467.db2.gz WYKZYSZLUPFWHH-KBPBESRZSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc([C@@H](C)NCc2ccc(F)cn2)c1O ZINC000846149550 632648193 /nfs/dbraw/zinc/64/81/93/632648193.db2.gz IUVUGFHNVPSWMM-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000846184061 632655600 /nfs/dbraw/zinc/65/56/00/632655600.db2.gz MHAJJEIWFQSOJD-OUCADQQQSA-N 0 3 251.370 2.840 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000846185831 632656842 /nfs/dbraw/zinc/65/68/42/632656842.db2.gz YMRVPTRTDFUVRS-MISXGVKJSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCNC1)c1ccc2ccccc2c1[O-] ZINC000817940093 632744305 /nfs/dbraw/zinc/74/43/05/632744305.db2.gz DTCJIDQULKBUQH-TZMCWYRMSA-N 0 3 270.376 2.948 20 10 CFCDHN CC[C@H](N[C@H]1CC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817944671 632747671 /nfs/dbraw/zinc/74/76/71/632747671.db2.gz JFMCCNANHZWHMX-JQWIXIFHSA-N 0 3 299.212 2.557 20 10 CFCDHN CNCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817951612 632752015 /nfs/dbraw/zinc/75/20/15/632752015.db2.gz HJRCLYHNSZDNDQ-SSDOTTSWSA-N 0 3 263.168 2.569 20 10 CFCDHN C[C@H](NCC[NH2+]C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817952513 632752350 /nfs/dbraw/zinc/75/23/50/632752350.db2.gz FNEOGEWFULETBO-VIFPVBQESA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](N)C(C)C)c1ccc(F)cc1[O-] ZINC000817957397 632756004 /nfs/dbraw/zinc/75/60/04/632756004.db2.gz BQRWFJXNCFHIBO-OLZOCXBDSA-N 0 3 254.349 2.555 20 10 CFCDHN CC[C@H]([NH2+][C@H](CN)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817961470 632761095 /nfs/dbraw/zinc/76/10/95/632761095.db2.gz ZIFMGLWFKBVHOR-QWHCGFSZSA-N 0 3 268.788 2.824 20 10 CFCDHN CCCC[C@@H](CN)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000817961881 632762158 /nfs/dbraw/zinc/76/21/58/632762158.db2.gz FTBORAAFNRNWER-PWSUYJOCSA-N 0 3 254.349 2.699 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(F)cc1[O-] ZINC000817969298 632767534 /nfs/dbraw/zinc/76/75/34/632767534.db2.gz BBXHPOFAVPJRED-DDTOSNHZSA-N 0 3 266.360 2.570 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-])[C@H](C)N ZINC000817978144 632776036 /nfs/dbraw/zinc/77/60/36/632776036.db2.gz XAYPNTYITAEWOH-YIZRAAEISA-N 0 3 276.302 2.797 20 10 CFCDHN CCC[N@H+](CCCc1cncn1C)Cc1ccccc1[O-] ZINC000846810074 632805746 /nfs/dbraw/zinc/80/57/46/632805746.db2.gz UYEQITNAYWQXPG-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN CCC[N@@H+](CCCc1cncn1C)Cc1ccccc1[O-] ZINC000846810074 632805750 /nfs/dbraw/zinc/80/57/50/632805750.db2.gz UYEQITNAYWQXPG-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c1[O-] ZINC000857060694 635922249 /nfs/dbraw/zinc/92/22/49/635922249.db2.gz DZAHSYONVRGUOC-JQWIXIFHSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c1[O-] ZINC000857060694 635922250 /nfs/dbraw/zinc/92/22/50/635922250.db2.gz DZAHSYONVRGUOC-JQWIXIFHSA-N 0 3 299.798 2.505 20 10 CFCDHN C[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(=O)OC(C)(C)C ZINC000848563342 633290368 /nfs/dbraw/zinc/29/03/68/633290368.db2.gz RTPJLCCAZGBNQQ-WCQYABFASA-N 0 3 291.391 2.947 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCCN3CCCC[C@H]13)CC2 ZINC000848568215 633291416 /nfs/dbraw/zinc/29/14/16/633291416.db2.gz BNWDORSGILIEGA-ARFHVFGLSA-N 0 3 286.419 2.986 20 10 CFCDHN CCc1cccc(CN2CCO[C@](C)(CC)C2)c1O ZINC000848905655 633392727 /nfs/dbraw/zinc/39/27/27/633392727.db2.gz LXQDICCNWIKFAA-MRXNPFEDSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1cccc(CN2CC(C)(C)OC[C@@H]2C)c1O ZINC000848904859 633392770 /nfs/dbraw/zinc/39/27/70/633392770.db2.gz CCURQYABMVDBIC-LBPRGKRZSA-N 0 3 263.381 2.954 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000850393687 633974233 /nfs/dbraw/zinc/97/42/33/633974233.db2.gz DLVKFIFIGCEXNE-LBPRGKRZSA-N 0 3 271.307 2.782 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](OC)C1CCCC1 ZINC000850401090 633978153 /nfs/dbraw/zinc/97/81/53/633978153.db2.gz UNXZKGJEWXLDEB-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000850408600 633980940 /nfs/dbraw/zinc/98/09/40/633980940.db2.gz BNUGHPXRTDCPAG-USXIJHARSA-N 0 3 269.319 2.959 20 10 CFCDHN COC(=O)CC(C)(C)C[C@@H](C)[NH2+]Cc1ccccc1[O-] ZINC000850430388 633989186 /nfs/dbraw/zinc/98/91/86/633989186.db2.gz PHIQOGNZJSQTHR-GFCCVEGCSA-N 0 3 279.380 2.850 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C1CCOCC1 ZINC000850493407 634017804 /nfs/dbraw/zinc/01/78/04/634017804.db2.gz HIHRWQWCSQEJFE-CJNGLKHVSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1Cc2ccccc2N(C)C1=O)c1ccccc1[O-] ZINC000850500742 634020259 /nfs/dbraw/zinc/02/02/59/634020259.db2.gz IYWHATVVVPMUFQ-IUODEOHRSA-N 0 3 296.370 2.631 20 10 CFCDHN CC[C@H](N[C@H](C)c1nccn1C)c1ccccc1O ZINC000850572475 634057108 /nfs/dbraw/zinc/05/71/08/634057108.db2.gz KNHXGUKYZVAZBZ-YPMHNXCESA-N 0 3 259.353 2.928 20 10 CFCDHN COC(=O)c1ccc([C@H](C)N(C)Cc2ccccc2O)o1 ZINC000111235854 634963136 /nfs/dbraw/zinc/96/31/36/634963136.db2.gz GSWCPFHJOSQMQF-NSHDSACASA-N 0 3 289.331 2.965 20 10 CFCDHN C[NH2+]C[C@@H](C)N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000854230892 635268042 /nfs/dbraw/zinc/26/80/42/635268042.db2.gz BGRVQPDQKBCJPZ-SFYZADRCSA-N 0 3 277.195 2.958 20 10 CFCDHN CCC[N@H+](CCOC[C@H]1CCCO1)Cc1ccccc1[O-] ZINC000112683964 635403750 /nfs/dbraw/zinc/40/37/50/635403750.db2.gz SSLFLFLGJNMONR-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN CCC[N@@H+](CCOC[C@H]1CCCO1)Cc1ccccc1[O-] ZINC000112683964 635403757 /nfs/dbraw/zinc/40/37/57/635403757.db2.gz SSLFLFLGJNMONR-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[C@]3([NH3+])C2)c(Cl)c1 ZINC000857226173 635952233 /nfs/dbraw/zinc/95/22/33/635952233.db2.gz GUZKWGVIFLFPLN-ABAIWWIYSA-N 0 3 280.799 2.667 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]3CCC[C@]3([NH3+])C2)c(Cl)c1 ZINC000857226175 635952851 /nfs/dbraw/zinc/95/28/51/635952851.db2.gz GUZKWGVIFLFPLN-NHYWBVRUSA-N 0 3 280.799 2.667 20 10 CFCDHN CC(C)[C@@](C)(O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858133988 636135230 /nfs/dbraw/zinc/13/52/30/636135230.db2.gz FPKMZFROOJIAGT-HNNXBMFYSA-N 0 3 286.366 2.527 20 10 CFCDHN CC[C@H](O)CCCNCc1cc(F)c(N(C)C)cc1F ZINC000858144768 636138114 /nfs/dbraw/zinc/13/81/14/636138114.db2.gz HGDYGPHRKGANKJ-LBPRGKRZSA-N 0 3 286.366 2.672 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@]2(C)CCCOC2)cc1F ZINC000858156376 636143370 /nfs/dbraw/zinc/14/33/70/636143370.db2.gz NXHGKGGNGFJNNL-HNNXBMFYSA-N 0 3 284.350 2.690 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnn2CC(C)C)c1 ZINC000858239629 636160669 /nfs/dbraw/zinc/16/06/69/636160669.db2.gz QSXAUIJKAPHHRK-UHFFFAOYSA-N 0 3 273.380 2.843 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCN1CC(F)F)c1ccccc1[O-] ZINC000858478987 636264626 /nfs/dbraw/zinc/26/46/26/636264626.db2.gz GLPPZLQKAHBUPF-NWDGAFQWSA-N 0 3 284.350 2.772 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000858482239 636266566 /nfs/dbraw/zinc/26/65/66/636266566.db2.gz WJLUDNAROWTOHJ-LOWVWBTDSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)Nc1ccnc(CO)c1 ZINC000858572415 636297335 /nfs/dbraw/zinc/29/73/35/636297335.db2.gz SESOQAPWUWPZNI-CQSZACIVSA-N 0 3 299.418 2.991 20 10 CFCDHN CCC(O)(CC)C[N@H+](C)Cc1cc(F)ccc1[O-] ZINC000862540078 637413591 /nfs/dbraw/zinc/41/35/91/637413591.db2.gz YJMZYWMJQRZVME-UHFFFAOYSA-N 0 3 255.333 2.514 20 10 CFCDHN CCC(O)(CC)C[N@@H+](C)Cc1cc(F)ccc1[O-] ZINC000862540078 637413596 /nfs/dbraw/zinc/41/35/96/637413596.db2.gz YJMZYWMJQRZVME-UHFFFAOYSA-N 0 3 255.333 2.514 20 10 CFCDHN Cc1ccc(O)c(CNC(=O)c2cccc(CN(C)C)c2)c1 ZINC000862760073 637482567 /nfs/dbraw/zinc/48/25/67/637482567.db2.gz KYEAPWKVRTXDFX-UHFFFAOYSA-N 0 3 298.386 2.692 20 10 CFCDHN Cc1ccccc1[C@@H](O)C[N@@H+](C)Cc1ccccc1[O-] ZINC000119528260 637702352 /nfs/dbraw/zinc/70/23/52/637702352.db2.gz IBYQHARMGXNNJN-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccccc1[C@@H](O)C[N@H+](C)Cc1ccccc1[O-] ZINC000119528260 637702355 /nfs/dbraw/zinc/70/23/55/637702355.db2.gz IBYQHARMGXNNJN-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccccc1[C@H](O)C[N@@H+](C)Cc1ccccc1[O-] ZINC000119528122 637702639 /nfs/dbraw/zinc/70/26/39/637702639.db2.gz IBYQHARMGXNNJN-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccccc1[C@H](O)C[N@H+](C)Cc1ccccc1[O-] ZINC000119528122 637702644 /nfs/dbraw/zinc/70/26/44/637702644.db2.gz IBYQHARMGXNNJN-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN COc1cnccc1[C@H](C)NCc1ccccc1O ZINC000189570929 650388884 /nfs/dbraw/zinc/38/88/84/650388884.db2.gz LJNZLTQSZLNUCO-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CN(C)c1ccc(F)cc1C[NH2+]Cc1ccccc1[O-] ZINC000865443201 638339114 /nfs/dbraw/zinc/33/91/14/638339114.db2.gz YYBISSGQADTHMU-UHFFFAOYSA-N 0 3 274.339 2.887 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CCSC1 ZINC000865654673 638491334 /nfs/dbraw/zinc/49/13/34/638491334.db2.gz RHCAIRYSRUYKBV-LLVKDONJSA-N 0 3 267.394 2.634 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)c([O-])c1 ZINC000865753728 638553209 /nfs/dbraw/zinc/55/32/09/638553209.db2.gz QPDSBDDEQOXXQJ-GHMZBOCLSA-N 0 3 275.270 2.831 20 10 CFCDHN CCOc1ccc(C[NH2+][C@]23CCC[C@H]2OCC3)c([O-])c1 ZINC000865859451 638620208 /nfs/dbraw/zinc/62/02/08/638620208.db2.gz OYWHFWTYSYNXKW-CVEARBPZSA-N 0 3 277.364 2.592 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000191590539 650511899 /nfs/dbraw/zinc/51/18/99/650511899.db2.gz LEUMUNIPEADMBV-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN CCCCCCN(C)CC(=O)N1Cc2cccc(O)c2C1 ZINC000871203358 641243093 /nfs/dbraw/zinc/24/30/93/641243093.db2.gz YOTVQLADYBUNJK-UHFFFAOYSA-N 0 3 290.407 2.747 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)c([O-])c1 ZINC000873156730 642039689 /nfs/dbraw/zinc/03/96/89/642039689.db2.gz MTZPTMQDSDGGHT-PVUWLOKVSA-N 0 3 291.391 2.838 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1C[C@H](O)C1 ZINC000873177359 642050033 /nfs/dbraw/zinc/05/00/33/642050033.db2.gz HPQWAOABLOREAI-WJYNOGRTSA-N 0 3 283.371 2.920 20 10 CFCDHN Cc1ccc(O)c(CN2CCOc3cc(N)ccc3C2)c1 ZINC000873220154 642072422 /nfs/dbraw/zinc/07/24/22/642072422.db2.gz QFKAIMAFQAORMR-UHFFFAOYSA-N 0 3 284.359 2.677 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000083422073 650763124 /nfs/dbraw/zinc/76/31/24/650763124.db2.gz GMYVSYBAWCHFMJ-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000876620542 642949127 /nfs/dbraw/zinc/94/91/27/642949127.db2.gz OVLXHFIPTJOLEN-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000876620542 642949128 /nfs/dbraw/zinc/94/91/28/642949128.db2.gz OVLXHFIPTJOLEN-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCC(=O)OC(C)(C)C)c([O-])c1 ZINC000876769416 643002084 /nfs/dbraw/zinc/00/20/84/643002084.db2.gz WSBULWWXNNDLCK-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCC(=O)OC(C)(C)C)c([O-])c1 ZINC000876769416 643002085 /nfs/dbraw/zinc/00/20/85/643002085.db2.gz WSBULWWXNNDLCK-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c([O-])c1 ZINC000876790264 643010671 /nfs/dbraw/zinc/01/06/71/643010671.db2.gz XMVPKVVBZZIROR-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@@H](CO)C(C)(C)C)c([O-])c1 ZINC000876790264 643010677 /nfs/dbraw/zinc/01/06/77/643010677.db2.gz XMVPKVVBZZIROR-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000876807447 643018052 /nfs/dbraw/zinc/01/80/52/643018052.db2.gz DRPZKIANAKJMKJ-GOEBONIOSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000876807447 643018059 /nfs/dbraw/zinc/01/80/59/643018059.db2.gz DRPZKIANAKJMKJ-GOEBONIOSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876807328 643018238 /nfs/dbraw/zinc/01/82/38/643018238.db2.gz BJYHAMGRIGZCKN-GOEBONIOSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876807328 643018245 /nfs/dbraw/zinc/01/82/45/643018245.db2.gz BJYHAMGRIGZCKN-GOEBONIOSA-N 0 3 285.391 2.980 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876917524 643064364 /nfs/dbraw/zinc/06/43/64/643064364.db2.gz UWLHRTLQPRJLIN-KRWDZBQOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]CCN2CCC(C)CC2)c([O-])c1 ZINC000876932141 643069963 /nfs/dbraw/zinc/06/99/63/643069963.db2.gz FJIDZMZRPMVVCY-UHFFFAOYSA-N 0 3 262.397 2.522 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877045356 643118450 /nfs/dbraw/zinc/11/84/50/643118450.db2.gz AQFJAGCAEMEJHD-OAHLLOKOSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2ccc(C)cc2[O-])c(C)o1 ZINC000877060654 643127053 /nfs/dbraw/zinc/12/70/53/643127053.db2.gz MKENPZWCOJRHDP-KRWDZBQOSA-N 0 3 289.375 2.908 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877064945 643130170 /nfs/dbraw/zinc/13/01/70/643130170.db2.gz GKXRKIMXFMHGJS-ZDUSSCGKSA-N 0 3 251.370 2.589 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877065810 643131562 /nfs/dbraw/zinc/13/15/62/643131562.db2.gz WQKBTHCOBZWTAG-GXTWGEPZSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](CCO)CC(C)C)c([O-])c1 ZINC000877068094 643132083 /nfs/dbraw/zinc/13/20/83/643132083.db2.gz QPLQYOVMMGGBNJ-CQSZACIVSA-N 0 3 265.397 2.835 20 10 CFCDHN CCC(CC)(CCO)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877067906 643132259 /nfs/dbraw/zinc/13/22/59/643132259.db2.gz JOPPLLDHMFUCQE-UHFFFAOYSA-N 0 3 265.397 2.979 20 10 CFCDHN COc1ccc2c(c1)OC[C@H]([NH2+]Cc1ccc(C)cc1[O-])C2 ZINC000877127473 643165806 /nfs/dbraw/zinc/16/58/06/643165806.db2.gz HRHUGSBAHIQKFQ-OAHLLOKOSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)C[C@H](O)c2ccco2)c([O-])c1 ZINC000877130202 643167819 /nfs/dbraw/zinc/16/78/19/643167819.db2.gz PTEAHWUEBQGJNO-WFASDCNBSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000877135544 643170896 /nfs/dbraw/zinc/17/08/96/643170896.db2.gz GICMVZJFGADPAZ-GDBMZVCRSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC000877136048 643170993 /nfs/dbraw/zinc/17/09/93/643170993.db2.gz WRURPAYRDLDZII-BBRMVZONSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)CCc1ccccc1 ZINC000877315235 643234301 /nfs/dbraw/zinc/23/43/01/643234301.db2.gz DSBKDUOAJPOISG-MRXNPFEDSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@@H](C3CC3)C2)c([O-])c1 ZINC000877374549 643250217 /nfs/dbraw/zinc/25/02/17/643250217.db2.gz CXOKXTNURXAIHW-GDBMZVCRSA-N 0 3 261.365 2.748 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)CCc2cccnc2)c([O-])c1 ZINC000877493654 643307286 /nfs/dbraw/zinc/30/72/86/643307286.db2.gz NMYNQMXYTDBARA-ZDUSSCGKSA-N 0 3 286.375 2.907 20 10 CFCDHN COc1cccc(CN[C@H](C)c2cnc(C)nc2C)c1O ZINC000877526233 643329994 /nfs/dbraw/zinc/32/99/94/643329994.db2.gz QTEOQLHEBBGMLT-SNVBAGLBSA-N 0 3 287.363 2.658 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877536949 643339702 /nfs/dbraw/zinc/33/97/02/643339702.db2.gz DSUKRLXFISTISQ-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877536949 643339707 /nfs/dbraw/zinc/33/97/07/643339707.db2.gz DSUKRLXFISTISQ-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000877539965 643342951 /nfs/dbraw/zinc/34/29/51/643342951.db2.gz REEYZPANRXQHEF-PKOBYXMFSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)OCC2CC2)c([O-])c1 ZINC000877589186 643383738 /nfs/dbraw/zinc/38/37/38/643383738.db2.gz IXIFYYSYCRCZIM-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)c([O-])c1 ZINC000877640827 643425573 /nfs/dbraw/zinc/42/55/73/643425573.db2.gz STYKWIFLCYXDDX-KSSFIOAISA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)[C@H](C)c2ccccc2)c([O-])c1 ZINC000877640825 643425671 /nfs/dbraw/zinc/42/56/71/643425671.db2.gz STYKWIFLCYXDDX-KDOFPFPSSA-N 0 3 285.387 2.955 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](OCc2ccccn2)C1 ZINC000877645772 643428596 /nfs/dbraw/zinc/42/85/96/643428596.db2.gz WGQOUWQBJYSLLH-MRXNPFEDSA-N 0 3 284.359 2.578 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](OCc2ccccn2)C1 ZINC000877645772 643428599 /nfs/dbraw/zinc/42/85/99/643428599.db2.gz WGQOUWQBJYSLLH-MRXNPFEDSA-N 0 3 284.359 2.578 20 10 CFCDHN COCC1(C2CC2)CN(Cc2ccc(N(C)C)cc2)C1 ZINC000877686758 643455817 /nfs/dbraw/zinc/45/58/17/643455817.db2.gz WSPTWOSQLYIULZ-UHFFFAOYSA-N 0 3 274.408 2.611 20 10 CFCDHN CC(C)([NH2+]Cc1cc(F)ccc1[O-])[C@@H]1CCCCO1 ZINC000877702839 643467160 /nfs/dbraw/zinc/46/71/60/643467160.db2.gz YLEVASSBKRAVMO-AWEZNQCLSA-N 0 3 267.344 2.969 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000877730105 643491068 /nfs/dbraw/zinc/49/10/68/643491068.db2.gz MMHUXHQPUGSHBV-WFASDCNBSA-N 0 3 279.355 2.684 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877736349 643495278 /nfs/dbraw/zinc/49/52/78/643495278.db2.gz WASIYRFIGNWHEX-KGLIPLIRSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877736349 643495286 /nfs/dbraw/zinc/49/52/86/643495286.db2.gz WASIYRFIGNWHEX-KGLIPLIRSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(C(C)(C)O)CC2)c([O-])c1 ZINC000877751672 643527239 /nfs/dbraw/zinc/52/72/39/643527239.db2.gz FTCBRCBIMDHKJS-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccccc1[O-] ZINC000877755665 643535087 /nfs/dbraw/zinc/53/50/87/643535087.db2.gz KUEUYKHNWONHDH-CHWSQXEVSA-N 0 3 262.397 2.916 20 10 CFCDHN CCc1ncc(C[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000877755780 643535740 /nfs/dbraw/zinc/53/57/40/643535740.db2.gz MMKYGFIIMLYTRZ-LLVKDONJSA-N 0 3 257.337 2.595 20 10 CFCDHN C[C@H]([NH2+]Cc1cnn(CC(F)F)c1)c1ccccc1[O-] ZINC000877758341 643538108 /nfs/dbraw/zinc/53/81/08/643538108.db2.gz UMHJOHQBWDGXBC-JTQLQIEISA-N 0 3 281.306 2.705 20 10 CFCDHN COC[C@@H](CC1CCOCC1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877758278 643538670 /nfs/dbraw/zinc/53/86/70/643538670.db2.gz QSOOADXPNHPPLT-DZGCQCFKSA-N 0 3 293.407 2.875 20 10 CFCDHN C[C@@H](O)c1ncc(CN[C@@H](C)c2ccccc2O)s1 ZINC000877758106 643538686 /nfs/dbraw/zinc/53/86/86/643538686.db2.gz JBXOEFZTYKZCES-VHSXEESVSA-N 0 3 278.377 2.753 20 10 CFCDHN C[C@@H](O)c1ncc(C[NH2+][C@@H](C)c2ccccc2[O-])s1 ZINC000877758106 643538693 /nfs/dbraw/zinc/53/86/93/643538693.db2.gz JBXOEFZTYKZCES-VHSXEESVSA-N 0 3 278.377 2.753 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000877806168 643568286 /nfs/dbraw/zinc/56/82/86/643568286.db2.gz OAWOWLURNBTDOW-RIEGTJTDSA-N 0 3 265.328 2.579 20 10 CFCDHN Cc1cccc(O)c1CN1CCO[C@H](C(F)(F)F)CC1 ZINC000877820208 643587510 /nfs/dbraw/zinc/58/75/10/643587510.db2.gz CQHZZEHHORCOQT-ZDUSSCGKSA-N 0 3 289.297 2.854 20 10 CFCDHN C[C@H]1CN(Cc2ccccc2O)CC[C@H](C(F)(F)F)O1 ZINC000877822193 643588689 /nfs/dbraw/zinc/58/86/89/643588689.db2.gz FGWSTVRGYNMBMT-GXFFZTMASA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccccc2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877822193 643588695 /nfs/dbraw/zinc/58/86/95/643588695.db2.gz FGWSTVRGYNMBMT-GXFFZTMASA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccccc2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877822193 643588701 /nfs/dbraw/zinc/58/87/01/643588701.db2.gz FGWSTVRGYNMBMT-GXFFZTMASA-N 0 3 289.297 2.934 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCC2(CCOCC2)O1 ZINC000878241256 643804696 /nfs/dbraw/zinc/80/46/96/643804696.db2.gz CMSJJELMGPOUEP-OAHLLOKOSA-N 0 3 291.391 2.552 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CCC2(CCOCC2)O1 ZINC000878241256 643804700 /nfs/dbraw/zinc/80/47/00/643804700.db2.gz CMSJJELMGPOUEP-OAHLLOKOSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH2+]CCCN1CCCC1 ZINC000127871431 644342420 /nfs/dbraw/zinc/34/24/20/644342420.db2.gz MNORHDMXULUTFG-UHFFFAOYSA-N 0 3 268.788 2.621 20 10 CFCDHN CCOC(=O)CCCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651214 644364197 /nfs/dbraw/zinc/36/41/97/644364197.db2.gz NCELKSLIVWFISE-LBPRGKRZSA-N 0 3 265.353 2.776 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)CC1CCCC1)c1ccccc1[O-] ZINC000879650509 644365025 /nfs/dbraw/zinc/36/50/25/644365025.db2.gz FLGTWYSHQPSPBM-GXTWGEPZSA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@H]([NH2+]Cc1ccnc(N(C)C)c1)c1ccccc1[O-] ZINC000879650902 644365189 /nfs/dbraw/zinc/36/51/89/644365189.db2.gz WDSCQGFKEJALGG-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(C)CCCO1)c1cc(F)ccc1[O-] ZINC000094798225 650964003 /nfs/dbraw/zinc/96/40/03/650964003.db2.gz FASZKKCFJXYHQP-YGRLFVJLSA-N 0 3 253.317 2.751 20 10 CFCDHN CCC[N@H+](Cc1ccc(C(N)=O)cc1)Cc1ccccc1[O-] ZINC000130733293 645562095 /nfs/dbraw/zinc/56/20/95/645562095.db2.gz NNVIWNXQPFBWRY-UHFFFAOYSA-N 0 3 298.386 2.903 20 10 CFCDHN CCC[N@@H+](Cc1ccc(C(N)=O)cc1)Cc1ccccc1[O-] ZINC000130733293 645562096 /nfs/dbraw/zinc/56/20/96/645562096.db2.gz NNVIWNXQPFBWRY-UHFFFAOYSA-N 0 3 298.386 2.903 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)Cc1ccoc1)c1cc(F)ccc1[O-] ZINC000883275913 645717386 /nfs/dbraw/zinc/71/73/86/645717386.db2.gz CLFXJJPEMYTMOD-DGCLKSJQSA-N 0 3 293.338 2.626 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2ccccc2[O-])OCCc2ccccc21 ZINC000883340127 645750543 /nfs/dbraw/zinc/75/05/43/645750543.db2.gz KHYUHNQEASOFOC-SFHVURJKSA-N 0 3 283.371 2.970 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(CO)CCCC2)c([O-])c1 ZINC000135065777 646453182 /nfs/dbraw/zinc/45/31/82/646453182.db2.gz KXOJVMXGJTXXDH-ZDUSSCGKSA-N 0 3 263.381 2.904 20 10 CFCDHN CC[C@H]([NH2+]CCC(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733718 646596613 /nfs/dbraw/zinc/59/66/13/646596613.db2.gz IALUIGUBYRUGAT-ZDUSSCGKSA-N 0 3 278.396 2.738 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC000886282545 646951456 /nfs/dbraw/zinc/95/14/56/646951456.db2.gz MOCMJVDZTXRWAX-VOAKCMCISA-N 0 3 261.365 2.783 20 10 CFCDHN COc1ccc(F)cc1CC[NH2+]Cc1ccccc1[O-] ZINC000886311810 646963929 /nfs/dbraw/zinc/96/39/29/646963929.db2.gz IGIAKKNABZWDCR-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN CC[N@H+](CCN[C@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520997 647027119 /nfs/dbraw/zinc/02/71/19/647027119.db2.gz ROEMCFAPCPVQNP-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520997 647027118 /nfs/dbraw/zinc/02/71/18/647027118.db2.gz ROEMCFAPCPVQNP-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[N@@H+](CCN[C@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520997 647027120 /nfs/dbraw/zinc/02/71/20/647027120.db2.gz ROEMCFAPCPVQNP-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H]([NH2+]CC1CC2(C1)OCCO2)c1ccc(C)cc1[O-] ZINC000927000591 648678218 /nfs/dbraw/zinc/67/82/18/648678218.db2.gz IMSBWEXBUHTYGN-HNNXBMFYSA-N 0 3 291.391 2.894 20 10 CFCDHN Cc1ccc(C)c(CN2CCCC(=O)[C@@H](C)C2)c1O ZINC001140178139 770260021 /nfs/dbraw/zinc/26/00/21/770260021.db2.gz AFUDSIZNIORRLX-ZDUSSCGKSA-N 0 3 261.365 2.810 20 10 CFCDHN C[C@H]([NH2+]CC1SCCS1)c1ccccc1[O-] ZINC000692825143 776347069 /nfs/dbraw/zinc/34/70/69/776347069.db2.gz AMJSZKOHBOWZSJ-VIFPVBQESA-N 0 3 255.408 2.849 20 10 CFCDHN COc1ccc(Br)c(C[NH+]2CCCC2)c1[O-] ZINC001231548181 777257215 /nfs/dbraw/zinc/25/72/15/777257215.db2.gz PAVJCTIKZXZKEM-UHFFFAOYSA-N 0 3 286.169 2.759 20 10 CFCDHN COc1ccc(Br)c(CN2CCCC2)c1O ZINC001231548181 777257211 /nfs/dbraw/zinc/25/72/11/777257211.db2.gz PAVJCTIKZXZKEM-UHFFFAOYSA-N 0 3 286.169 2.759 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001231590558 777270734 /nfs/dbraw/zinc/27/07/34/777270734.db2.gz HJAOWFLFPNZBFP-SUMWQHHRSA-N 0 3 269.344 2.766 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001231590558 777270744 /nfs/dbraw/zinc/27/07/44/777270744.db2.gz HJAOWFLFPNZBFP-SUMWQHHRSA-N 0 3 269.344 2.766 20 10 CFCDHN Cc1cccc(CN2CCc3cccnc3C2)c1O ZINC001231594051 777272976 /nfs/dbraw/zinc/27/29/76/777272976.db2.gz RZUKMXVJJPKCRF-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN COc1cc(CN2CCC(F)(F)[C@@H](C)C2)c(O)cc1O ZINC001231633997 777287465 /nfs/dbraw/zinc/28/74/65/777287465.db2.gz FSCNJNYINGAQRL-VIFPVBQESA-N 0 3 287.306 2.584 20 10 CFCDHN COC[C@H]1CCCCN1Cc1ccc(N(C)C)cc1OC ZINC001231848080 777348354 /nfs/dbraw/zinc/34/83/54/777348354.db2.gz GELYMMFACAZTNM-MRXNPFEDSA-N 0 3 292.423 2.762 20 10 CFCDHN Cc1cc(C)c(CN2CCc3cccnc3C2)c(O)c1 ZINC001231849401 777350242 /nfs/dbraw/zinc/35/02/42/777350242.db2.gz QCOIYYUSWHFFJU-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN COCCN(Cc1ccc(N(C)C)cc1OC)C(C)C ZINC001231853237 777351657 /nfs/dbraw/zinc/35/16/57/777351657.db2.gz UKONHBLNGYCRJQ-UHFFFAOYSA-N 0 3 280.412 2.618 20 10 CFCDHN CCO[C@@H]1CCCN(Cc2ccc(N(C)C)cc2OC)C1 ZINC001231852872 777352751 /nfs/dbraw/zinc/35/27/51/777352751.db2.gz BXYDQFYZWGRUIF-MRXNPFEDSA-N 0 3 292.423 2.762 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@]2(CCO2)C1 ZINC001231854710 777352769 /nfs/dbraw/zinc/35/27/69/777352769.db2.gz LFEJJTJJZLCLID-KRWDZBQOSA-N 0 3 290.407 2.516 20 10 CFCDHN Clc1cc(CN2C[C@@H]3C[C@@H]3C2)ccc1N1CCOCC1 ZINC001232194575 777467813 /nfs/dbraw/zinc/46/78/13/777467813.db2.gz JZPWXLXLQBZWIF-OKILXGFUSA-N 0 3 292.810 2.628 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])Cc1cncc2cnccc21 ZINC001232652004 777631162 /nfs/dbraw/zinc/63/11/62/777631162.db2.gz GOISABFCYODRTP-UHFFFAOYSA-N 0 3 279.343 2.967 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])Cc1cncc2cnccc21 ZINC001232652004 777631168 /nfs/dbraw/zinc/63/11/68/777631168.db2.gz GOISABFCYODRTP-UHFFFAOYSA-N 0 3 279.343 2.967 20 10 CFCDHN CCN(Cc1ccccn1)Cc1ccc(N(C)C)cc1O ZINC001232839339 777688397 /nfs/dbraw/zinc/68/83/97/777688397.db2.gz HCOWCWHWBSBLQI-UHFFFAOYSA-N 0 3 285.391 2.875 20 10 CFCDHN Oc1cc(CN2CC[C@H](c3ccccc3)C2)cc(O)c1O ZINC001233010559 777761495 /nfs/dbraw/zinc/76/14/95/777761495.db2.gz QLPXOVKILMKUAE-AWEZNQCLSA-N 0 3 285.343 2.793 20 10 CFCDHN CN(CCCc1ccccc1)Cc1cc(O)c(O)c(O)c1 ZINC001233012821 777764077 /nfs/dbraw/zinc/76/40/77/777764077.db2.gz NVQBISZJWJLESP-UHFFFAOYSA-N 0 3 287.359 2.868 20 10 CFCDHN C[C@@H]1CN(Cc2cc(O)c(O)cc2O)Cc2ccccc21 ZINC001233483449 777963567 /nfs/dbraw/zinc/96/35/67/777963567.db2.gz ZMTALARYMSDHLK-LLVKDONJSA-N 0 3 285.343 2.923 20 10 CFCDHN CCN(Cc1cccs1)Cc1cc(O)c(O)cc1O ZINC001233486730 777964024 /nfs/dbraw/zinc/96/40/24/777964024.db2.gz ZKROUFIMLQNUEC-UHFFFAOYSA-N 0 3 279.361 2.887 20 10 CFCDHN COc1ccc2ccc([O-])c(C[NH+]3CC4(C3)CCOC4)c2c1 ZINC001234518014 778242591 /nfs/dbraw/zinc/24/25/91/778242591.db2.gz AISROVYFKXNOLF-UHFFFAOYSA-N 0 3 299.370 2.776 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CCC[C@H]3CO)c2c1 ZINC001234526134 778243710 /nfs/dbraw/zinc/24/37/10/778243710.db2.gz QNKXEWOKCVYOKZ-ZDUSSCGKSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CCC[C@H]3CO)c2c1 ZINC001234526134 778243715 /nfs/dbraw/zinc/24/37/15/778243715.db2.gz QNKXEWOKCVYOKZ-ZDUSSCGKSA-N 0 3 287.359 2.511 20 10 CFCDHN CCOCC1CC[NH+](Cc2ccc(OC)cc2[O-])CC1 ZINC000093394489 778298649 /nfs/dbraw/zinc/29/86/49/778298649.db2.gz OTJDXNGUWBIRER-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1c(C[N@H+]2CC[C@@H](CO)C2)cccc1-c1ccccc1 ZINC001234993456 778346834 /nfs/dbraw/zinc/34/68/34/778346834.db2.gz CTVNXIFXJOWAGN-CQSZACIVSA-N 0 3 283.371 2.873 20 10 CFCDHN [O-]c1c(C[N@@H+]2CC[C@@H](CO)C2)cccc1-c1ccccc1 ZINC001234993456 778346842 /nfs/dbraw/zinc/34/68/42/778346842.db2.gz CTVNXIFXJOWAGN-CQSZACIVSA-N 0 3 283.371 2.873 20 10 CFCDHN CNC(=O)CC[N@H+](C)Cc1cccc(-c2ccccc2)c1[O-] ZINC001234995631 778347951 /nfs/dbraw/zinc/34/79/51/778347951.db2.gz OTBOFVRNKYQIHD-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CNC(=O)CC[N@@H+](C)Cc1cccc(-c2ccccc2)c1[O-] ZINC001234995631 778347960 /nfs/dbraw/zinc/34/79/60/778347960.db2.gz OTBOFVRNKYQIHD-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cccc(-c2ccccc2)c1[O-] ZINC001234996916 778348751 /nfs/dbraw/zinc/34/87/51/778348751.db2.gz PTNJDXFPOSCRNU-IRXDYDNUSA-N 0 3 294.398 2.948 20 10 CFCDHN CN1C[C@@H]2C[C@H]1C[N@H+]2Cc1cccc(-c2ccccc2)c1[O-] ZINC001234996916 778348758 /nfs/dbraw/zinc/34/87/58/778348758.db2.gz PTNJDXFPOSCRNU-IRXDYDNUSA-N 0 3 294.398 2.948 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@H]1O ZINC001235676027 778532484 /nfs/dbraw/zinc/53/24/84/778532484.db2.gz NTBIZBSQFQLNDU-XHDPSFHLSA-N 0 3 263.381 2.502 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@H]1O ZINC001235676027 778532487 /nfs/dbraw/zinc/53/24/87/778532487.db2.gz NTBIZBSQFQLNDU-XHDPSFHLSA-N 0 3 263.381 2.502 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]2CO)c([O-])c1 ZINC001235676966 778534402 /nfs/dbraw/zinc/53/44/02/778534402.db2.gz ZAIZXZPTDDOPEP-AWEZNQCLSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@H]2CO)c([O-])c1 ZINC001235676966 778534405 /nfs/dbraw/zinc/53/44/05/778534405.db2.gz ZAIZXZPTDDOPEP-AWEZNQCLSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)C[C@H]1CN(Cc2ccc(Cl)cc2[O-])CC[NH2+]1 ZINC001235880552 778588596 /nfs/dbraw/zinc/58/85/96/778588596.db2.gz BTQXCEFSGBRIGY-AWEZNQCLSA-N 0 3 282.815 2.866 20 10 CFCDHN CN(Cc1ccc(Cl)cc1[O-])[C@@]1(C)CCC[NH2+]C1 ZINC001236205949 778734759 /nfs/dbraw/zinc/73/47/59/778734759.db2.gz HPBXEFGRUUCMJG-AWEZNQCLSA-N 0 3 268.788 2.620 20 10 CFCDHN C[NH2+]C[C@H]1CCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001236422445 778816923 /nfs/dbraw/zinc/81/69/23/778816923.db2.gz WQMWPQALSYARFR-GFCCVEGCSA-N 0 3 268.788 2.538 20 10 CFCDHN C[C@@](CO)(NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000169268319 778865094 /nfs/dbraw/zinc/86/50/94/778865094.db2.gz WGHDTUFQFXVREU-SFHVURJKSA-N 0 3 283.371 2.619 20 10 CFCDHN C[NH+]1CCC2(CN(Cc3cccc(Cl)c3[O-])C2)CC1 ZINC001231914810 778879040 /nfs/dbraw/zinc/87/90/40/778879040.db2.gz QYDCCSDDXCRCEM-UHFFFAOYSA-N 0 3 280.799 2.573 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@@](C)(O)C2)c([O-])c1 ZINC001236782355 778933441 /nfs/dbraw/zinc/93/34/41/778933441.db2.gz ASOQTPMJAVXMIQ-MRXNPFEDSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@@](C)(O)C2)c([O-])c1 ZINC001236782355 778933444 /nfs/dbraw/zinc/93/34/44/778933444.db2.gz ASOQTPMJAVXMIQ-MRXNPFEDSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H](C(=O)OC)CC[C@H]2C)c([O-])c1 ZINC001236791088 778936588 /nfs/dbraw/zinc/93/65/88/778936588.db2.gz DETRXKTTWCSLDR-DOMZBBRYSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H](C(=O)OC)CC[C@H]2C)c([O-])c1 ZINC001236791088 778936593 /nfs/dbraw/zinc/93/65/93/778936593.db2.gz DETRXKTTWCSLDR-DOMZBBRYSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(CN2CCOC[C@@H]2C(C)C)c(O)c1 ZINC001236789594 778937045 /nfs/dbraw/zinc/93/70/45/778937045.db2.gz ZPALVYDDVLWADR-OAHLLOKOSA-N 0 3 263.381 2.811 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC001236787686 778937549 /nfs/dbraw/zinc/93/75/49/778937549.db2.gz JQRUEHBCUZNCAT-OAHLLOKOSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC001236787686 778937551 /nfs/dbraw/zinc/93/75/51/778937551.db2.gz JQRUEHBCUZNCAT-OAHLLOKOSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H]2C(C)(C)O)c([O-])c1 ZINC001236793392 778938629 /nfs/dbraw/zinc/93/86/29/778938629.db2.gz VWERSPUNAZRRHK-OAHLLOKOSA-N 0 3 263.381 2.690 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c([O-])c1 ZINC001236793392 778938633 /nfs/dbraw/zinc/93/86/33/778938633.db2.gz VWERSPUNAZRRHK-OAHLLOKOSA-N 0 3 263.381 2.690 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c([O-])c1 ZINC001236808977 778948601 /nfs/dbraw/zinc/94/86/01/778948601.db2.gz SFTMCCCIKYUCQE-QGZVFWFLSA-N 0 3 291.391 2.854 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@]3(C2)CCCCO3)c([O-])c1 ZINC001236808977 778948603 /nfs/dbraw/zinc/94/86/03/778948603.db2.gz SFTMCCCIKYUCQE-QGZVFWFLSA-N 0 3 291.391 2.854 20 10 CFCDHN COc1cc(C)c(CN2CCOC[C@@H]2C(C)C)c(O)c1 ZINC001236811352 778948827 /nfs/dbraw/zinc/94/88/27/778948827.db2.gz RAOFMCJUAHWGAT-OAHLLOKOSA-N 0 3 279.380 2.566 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236816816 778950774 /nfs/dbraw/zinc/95/07/74/778950774.db2.gz YCPCVMXCUIXIOK-STQMWFEESA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236816816 778950776 /nfs/dbraw/zinc/95/07/76/778950776.db2.gz YCPCVMXCUIXIOK-STQMWFEESA-N 0 3 279.380 2.709 20 10 CFCDHN C[C@H]1CC[C@@H](CO)[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236826815 778954893 /nfs/dbraw/zinc/95/48/93/778954893.db2.gz NEHHLTXIOCJTRN-LRDDRELGSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@H]1CC[C@@H](CO)[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236826815 778954895 /nfs/dbraw/zinc/95/48/95/778954895.db2.gz NEHHLTXIOCJTRN-LRDDRELGSA-N 0 3 271.360 2.891 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCO[C@@]2(CCOC2)C1 ZINC001236826750 778955159 /nfs/dbraw/zinc/95/51/59/778955159.db2.gz MESPWILVJSHSFM-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC001236826750 778955163 /nfs/dbraw/zinc/95/51/63/778955163.db2.gz MESPWILVJSHSFM-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN Oc1cc2ccccc2cc1CN1CCO[C@@]2(CCOC2)C1 ZINC001236826750 778955165 /nfs/dbraw/zinc/95/51/65/778955165.db2.gz MESPWILVJSHSFM-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CCC(CO)CC1 ZINC001236828891 778956603 /nfs/dbraw/zinc/95/66/03/778956603.db2.gz HGBWPDYEINNRFJ-UHFFFAOYSA-N 0 3 271.360 2.750 20 10 CFCDHN COC[C@@H]1CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835062 778959517 /nfs/dbraw/zinc/95/95/17/778959517.db2.gz GZLCWLOWXNTMKM-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN COC[C@@H]1CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835062 778959519 /nfs/dbraw/zinc/95/95/19/778959519.db2.gz GZLCWLOWXNTMKM-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@@]12CCOC2 ZINC001236836433 778961003 /nfs/dbraw/zinc/96/10/03/778961003.db2.gz JGHPGUPTAOUVBD-KRWDZBQOSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@@]12CCOC2 ZINC001236836433 778961006 /nfs/dbraw/zinc/96/10/06/778961006.db2.gz JGHPGUPTAOUVBD-KRWDZBQOSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC[C@H]1CO ZINC001236839579 778962498 /nfs/dbraw/zinc/96/24/98/778962498.db2.gz JEGQCBSNASYXTE-INIZCTEOSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC[C@H]1CO ZINC001236839579 778962503 /nfs/dbraw/zinc/96/25/03/778962503.db2.gz JEGQCBSNASYXTE-INIZCTEOSA-N 0 3 271.360 2.892 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236838688 778962744 /nfs/dbraw/zinc/96/27/44/778962744.db2.gz ZKWKNHKOENYMDG-KRWDZBQOSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236838688 778962749 /nfs/dbraw/zinc/96/27/49/778962749.db2.gz ZKWKNHKOENYMDG-KRWDZBQOSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001237044327 778997096 /nfs/dbraw/zinc/99/70/96/778997096.db2.gz BULCWISMWLTTKD-LSDHHAIUSA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001237044327 778997099 /nfs/dbraw/zinc/99/70/99/778997099.db2.gz BULCWISMWLTTKD-LSDHHAIUSA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@@](C)(O)C2)c([O-])c1 ZINC001237049427 778998205 /nfs/dbraw/zinc/99/82/05/778998205.db2.gz OTPISCZVDBOYFE-MRXNPFEDSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@@](C)(O)C2)c([O-])c1 ZINC001237049427 778998210 /nfs/dbraw/zinc/99/82/10/778998210.db2.gz OTPISCZVDBOYFE-MRXNPFEDSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCCC[C@H]2CO)c([O-])c1 ZINC001237048903 778998807 /nfs/dbraw/zinc/99/88/07/778998807.db2.gz ZQCIBBQGQHZBGA-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCCC[C@H]2CO)c([O-])c1 ZINC001237048903 778998812 /nfs/dbraw/zinc/99/88/12/778998812.db2.gz ZQCIBBQGQHZBGA-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN Oc1cccc(OC(F)(F)F)c1CN1CCCC1 ZINC001237120402 779017949 /nfs/dbraw/zinc/01/79/49/779017949.db2.gz OYTYTWVJPGDOCN-UHFFFAOYSA-N 0 3 261.243 2.887 20 10 CFCDHN Cc1cc(CN2CCNC3=CCCC[C@H]32)ccc1N(C)C ZINC001237226496 779056248 /nfs/dbraw/zinc/05/62/48/779056248.db2.gz XFEOEWZVWCDWPE-GOSISDBHSA-N 0 3 285.435 2.903 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1Cl ZINC001237406361 779100411 /nfs/dbraw/zinc/10/04/11/779100411.db2.gz UMPFPCUXNGPJQM-DOMZBBRYSA-N 0 3 294.826 2.928 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC001237482536 779117689 /nfs/dbraw/zinc/11/76/89/779117689.db2.gz LKWYRIQUMAEUPI-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC001237482536 779117692 /nfs/dbraw/zinc/11/76/92/779117692.db2.gz LKWYRIQUMAEUPI-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@](C)(CO)CC1 ZINC001237484304 779118118 /nfs/dbraw/zinc/11/81/18/779118118.db2.gz BCJZFZDNLYDOPF-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@](C)(CO)CC1 ZINC001237484304 779118122 /nfs/dbraw/zinc/11/81/22/779118122.db2.gz BCJZFZDNLYDOPF-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2cc3c(cc2C1)OCO3 ZINC001237484348 779118202 /nfs/dbraw/zinc/11/82/02/779118202.db2.gz CQICRGMGSMCLIH-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@@H]2CCCC(=O)[C@@H]2C1 ZINC001237491597 779119034 /nfs/dbraw/zinc/11/90/34/779119034.db2.gz PXMCGYJMNUYOGM-GXTWGEPZSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@@H]2CCCC(=O)[C@@H]2C1 ZINC001237491597 779119037 /nfs/dbraw/zinc/11/90/37/779119037.db2.gz PXMCGYJMNUYOGM-GXTWGEPZSA-N 0 3 259.349 2.502 20 10 CFCDHN CCC(=O)N(C)C1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC001237494411 779120303 /nfs/dbraw/zinc/12/03/03/779120303.db2.gz ICCHMTOLANMVNO-UHFFFAOYSA-N 0 3 290.407 2.533 20 10 CFCDHN [O-]c1ccc(-c2ccc(F)cc2)cc1C[N@H+]1CC[C@@H](O)C1 ZINC001237640790 779153187 /nfs/dbraw/zinc/15/31/87/779153187.db2.gz FRYPHWQYOGEQCM-MRXNPFEDSA-N 0 3 287.334 2.765 20 10 CFCDHN [O-]c1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CC[C@@H](O)C1 ZINC001237640790 779153193 /nfs/dbraw/zinc/15/31/93/779153193.db2.gz FRYPHWQYOGEQCM-MRXNPFEDSA-N 0 3 287.334 2.765 20 10 CFCDHN CC[N@H+](Cc1cccc(C(N)=O)c1)Cc1ccccc1[O-] ZINC001237699531 779163805 /nfs/dbraw/zinc/16/38/05/779163805.db2.gz YCQLJHOMLHYLMY-UHFFFAOYSA-N 0 3 284.359 2.513 20 10 CFCDHN CC[N@@H+](Cc1cccc(C(N)=O)c1)Cc1ccccc1[O-] ZINC001237699531 779163808 /nfs/dbraw/zinc/16/38/08/779163808.db2.gz YCQLJHOMLHYLMY-UHFFFAOYSA-N 0 3 284.359 2.513 20 10 CFCDHN C[C@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@H]1C[NH3+] ZINC001205150768 779351834 /nfs/dbraw/zinc/35/18/34/779351834.db2.gz JYULNNRWHQGCNY-WCBMZHEXSA-N 0 3 289.206 2.726 20 10 CFCDHN C[N@H+](Cc1ccc(C(C)(C)C)cc1[O-])[C@@H]1CCOC1 ZINC001235684830 779368739 /nfs/dbraw/zinc/36/87/39/779368739.db2.gz KJGWLLFMVHMWTH-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN C[N@@H+](Cc1ccc(C(C)(C)C)cc1[O-])[C@@H]1CCOC1 ZINC001235684830 779368745 /nfs/dbraw/zinc/36/87/45/779368745.db2.gz KJGWLLFMVHMWTH-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN COc1cc(C)c(CN2C[C@@H](F)C[C@H]2C)c(O)c1 ZINC001236809670 779641790 /nfs/dbraw/zinc/64/17/90/779641790.db2.gz ZOJVWKWPIQTNNH-MNOVXSKESA-N 0 3 253.317 2.642 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@H]1CCCC13CC3)OCO2 ZINC000706270937 781165142 /nfs/dbraw/zinc/16/51/42/781165142.db2.gz WFSAKOGPIDHGDH-GFCCVEGCSA-N 0 3 275.348 2.791 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183507899 282242429 /nfs/dbraw/zinc/24/24/29/282242429.db2.gz RKMOOZRHVWCONV-ABAIWWIYSA-N 0 3 251.370 2.840 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(CCO)CCCC2)c1[O-] ZINC000072925847 346949240 /nfs/dbraw/zinc/94/92/40/346949240.db2.gz XTKZXSFAQWTNME-UHFFFAOYSA-N 0 3 293.407 2.823 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000093482569 347676241 /nfs/dbraw/zinc/67/62/41/347676241.db2.gz XOMWIZZGERBZEH-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000093482569 347676244 /nfs/dbraw/zinc/67/62/44/347676244.db2.gz XOMWIZZGERBZEH-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@@H+](C)C2CCC(OC)CC2)c1[O-] ZINC000093415078 347672958 /nfs/dbraw/zinc/67/29/58/347672958.db2.gz IRVZOQOUIKOLHL-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1cccc(C[N@H+](C)C2CCC(OC)CC2)c1[O-] ZINC000093415078 347672961 /nfs/dbraw/zinc/67/29/61/347672961.db2.gz IRVZOQOUIKOLHL-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295926004 282838529 /nfs/dbraw/zinc/83/85/29/282838529.db2.gz JYVASZFKKGNBLN-KGLIPLIRSA-N 0 3 283.375 2.780 20 10 CFCDHN CC[C@@H](CO)[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000295185227 199394421 /nfs/dbraw/zinc/39/44/21/199394421.db2.gz WLTCZCWSYJASHK-LBPRGKRZSA-N 0 3 257.761 2.557 20 10 CFCDHN CC[C@@H](CO)[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000295185227 199394423 /nfs/dbraw/zinc/39/44/23/199394423.db2.gz WLTCZCWSYJASHK-LBPRGKRZSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000295191841 199398253 /nfs/dbraw/zinc/39/82/53/199398253.db2.gz IZUGYPWTOCFGOR-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000295191841 199398254 /nfs/dbraw/zinc/39/82/54/199398254.db2.gz IZUGYPWTOCFGOR-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N(CC)CC ZINC000174373489 283297294 /nfs/dbraw/zinc/29/72/94/283297294.db2.gz HSKGBIYZJSFXJI-AWEZNQCLSA-N 0 3 292.423 2.861 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N(CC)CC ZINC000174373489 283297299 /nfs/dbraw/zinc/29/72/99/283297299.db2.gz HSKGBIYZJSFXJI-AWEZNQCLSA-N 0 3 292.423 2.861 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N(C)C(C)C ZINC000175284332 283297452 /nfs/dbraw/zinc/29/74/52/283297452.db2.gz LQXJRHGDFUBKNN-CQSZACIVSA-N 0 3 292.423 2.860 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N(C)C(C)C ZINC000175284332 283297456 /nfs/dbraw/zinc/29/74/56/283297456.db2.gz LQXJRHGDFUBKNN-CQSZACIVSA-N 0 3 292.423 2.860 20 10 CFCDHN CC(C)(C)C[C@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297532012 200220491 /nfs/dbraw/zinc/22/04/91/200220491.db2.gz DPVVWFVJSBMELU-QWHCGFSZSA-N 0 3 263.381 2.766 20 10 CFCDHN CCOC(=O)N1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000019965237 372218016 /nfs/dbraw/zinc/21/80/16/372218016.db2.gz UPDKUJNMKJHUJV-GFCCVEGCSA-N 0 3 292.379 2.664 20 10 CFCDHN CC[C@H](C)[C@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880446 372963923 /nfs/dbraw/zinc/96/39/23/372963923.db2.gz ZKMICAGICRMYKU-UWVGGRQHSA-N 0 3 251.326 2.645 20 10 CFCDHN COc1cc(C[NH2+][C@@H](C)c2ccccc2[O-])ccn1 ZINC000062057894 373744598 /nfs/dbraw/zinc/74/45/98/373744598.db2.gz FMBNQCNUWNXOSV-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2nccs2)c1 ZINC000063133391 373786873 /nfs/dbraw/zinc/78/68/73/373786873.db2.gz FXTKRDPDWPZRLU-SNVBAGLBSA-N 0 3 278.377 2.751 20 10 CFCDHN CCOc1ccc(O)c(CN(C)C[C@H]2CCCCO2)c1 ZINC000092428653 375111341 /nfs/dbraw/zinc/11/13/41/375111341.db2.gz NHQUXEPKKIVHQE-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@H]([NH2+]Cc1c(C)nn(C)c1C)c1ccccc1[O-] ZINC000092325921 375101985 /nfs/dbraw/zinc/10/19/85/375101985.db2.gz JLVFGUSLQWVQPA-HNNXBMFYSA-N 0 3 273.380 2.983 20 10 CFCDHN Cc1cc(O)c(CN2CCOC[C@H]2C2CC2)cc1C ZINC000093645437 375283373 /nfs/dbraw/zinc/28/33/73/375283373.db2.gz MTLIVCIEZJKFJY-HNNXBMFYSA-N 0 3 261.365 2.620 20 10 CFCDHN COc1cccc(CN(C)CCC(=O)OC(C)(C)C)c1O ZINC000093686717 375295580 /nfs/dbraw/zinc/29/55/80/375295580.db2.gz VKXKPWMSVNGXEM-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1cccc(C[N@H+](C)CCC(=O)OC(C)(C)C)c1[O-] ZINC000093686717 375295587 /nfs/dbraw/zinc/29/55/87/375295587.db2.gz VKXKPWMSVNGXEM-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCC(=O)OC(C)(C)C)c1[O-] ZINC000093686717 375295595 /nfs/dbraw/zinc/29/55/95/375295595.db2.gz VKXKPWMSVNGXEM-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)c1 ZINC000093691602 375300431 /nfs/dbraw/zinc/30/04/31/375300431.db2.gz NCLHRUXATMKLNP-INIZCTEOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](Oc3cccnc3)C2)c1 ZINC000093691602 375300440 /nfs/dbraw/zinc/30/04/40/375300440.db2.gz NCLHRUXATMKLNP-INIZCTEOSA-N 0 3 284.359 2.749 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCOC2CCCCC2)c1 ZINC000111636183 375860541 /nfs/dbraw/zinc/86/05/41/375860541.db2.gz LIXDFZKOOGMETR-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCCNC(=O)OC(C)(C)C)c1 ZINC000113335421 376011437 /nfs/dbraw/zinc/01/14/37/376011437.db2.gz KTQIANCWYWGKHZ-UHFFFAOYSA-N 0 3 294.395 2.705 20 10 CFCDHN Cc1ccc(O)c(CN2CCC[C@@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741122 376973901 /nfs/dbraw/zinc/97/39/01/376973901.db2.gz HVIQYEKFCBPQSK-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741122 376973907 /nfs/dbraw/zinc/97/39/07/376973907.db2.gz HVIQYEKFCBPQSK-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741122 376973914 /nfs/dbraw/zinc/97/39/14/376973914.db2.gz HVIQYEKFCBPQSK-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCC(=O)N2CCCCC2)c1 ZINC000123770385 376976388 /nfs/dbraw/zinc/97/63/88/376976388.db2.gz TWKIUZHCWIHMSL-CQSZACIVSA-N 0 3 290.407 2.754 20 10 CFCDHN C[C@H](NCc1cccc(C(N)=O)c1)c1ccc(N(C)C)cc1 ZINC000124224583 377028350 /nfs/dbraw/zinc/02/83/50/377028350.db2.gz PMXSOXUNWNIVRY-ZDUSSCGKSA-N 0 3 297.402 2.702 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H]2CSCCS2)c1[O-] ZINC000125227205 377131106 /nfs/dbraw/zinc/13/11/06/377131106.db2.gz ZZCZWCQOVQZPSH-LBPRGKRZSA-N 0 3 299.461 2.729 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCS[C@@H]3COCC[C@@H]32)cc1C ZINC000131068071 377652062 /nfs/dbraw/zinc/65/20/62/377652062.db2.gz UENIJDGBTLFBSU-GOEBONIOSA-N 0 3 293.432 2.715 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)cc1C ZINC000131068071 377652064 /nfs/dbraw/zinc/65/20/64/377652064.db2.gz UENIJDGBTLFBSU-GOEBONIOSA-N 0 3 293.432 2.715 20 10 CFCDHN CN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1 ZINC000132035671 377794793 /nfs/dbraw/zinc/79/47/93/377794793.db2.gz BIJPHVYZNSOHAL-QGZVFWFLSA-N 0 3 274.408 2.898 20 10 CFCDHN COCC[N@@H+](Cc1cc(C)ccc1[O-])CC(C)C ZINC000132641426 377861969 /nfs/dbraw/zinc/86/19/69/377861969.db2.gz GIESWPFSVLQFIF-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN COCC[N@H+](Cc1cc(C)ccc1[O-])CC(C)C ZINC000132641426 377861972 /nfs/dbraw/zinc/86/19/72/377861972.db2.gz GIESWPFSVLQFIF-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN CCOc1cccc(C[N@H+](CCOC)CC(C)C)c1[O-] ZINC000132651717 377863107 /nfs/dbraw/zinc/86/31/07/377863107.db2.gz BGDACJPAHSSZLA-UHFFFAOYSA-N 0 3 281.396 2.895 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCOC)CC(C)C)c1[O-] ZINC000132651717 377863114 /nfs/dbraw/zinc/86/31/14/377863114.db2.gz BGDACJPAHSSZLA-UHFFFAOYSA-N 0 3 281.396 2.895 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCCO[C@@H](C)C2)c([O-])c1 ZINC000134163110 377989568 /nfs/dbraw/zinc/98/95/68/377989568.db2.gz WXYFDGASZJYRPV-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCCO[C@@H](C)C2)c([O-])c1 ZINC000134163110 377989572 /nfs/dbraw/zinc/98/95/72/377989572.db2.gz WXYFDGASZJYRPV-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2CCCSC2)c1[O-] ZINC000135700589 378158382 /nfs/dbraw/zinc/15/83/82/378158382.db2.gz YAAZNCUFBOUQCQ-GFCCVEGCSA-N 0 3 267.394 2.776 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)C2CC(F)(F)C2)c([O-])c1 ZINC000529557335 383729934 /nfs/dbraw/zinc/72/99/34/383729934.db2.gz MJPMJEUYRQFOJV-VIFPVBQESA-N 0 3 271.307 2.924 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1COc2ccccc2O1 ZINC000178856963 380489616 /nfs/dbraw/zinc/48/96/16/380489616.db2.gz LRDRBMDGSDNARJ-CQSZACIVSA-N 0 3 285.343 2.664 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1COc2ccccc2O1 ZINC000178856963 380489623 /nfs/dbraw/zinc/48/96/23/380489623.db2.gz LRDRBMDGSDNARJ-CQSZACIVSA-N 0 3 285.343 2.664 20 10 CFCDHN CC[C@@H]1CN(Cc2ccccc2O)CCN1CC(F)F ZINC000179582043 380560743 /nfs/dbraw/zinc/56/07/43/380560743.db2.gz NDWIAVXPSLXINO-CYBMUJFWSA-N 0 3 284.350 2.554 20 10 CFCDHN C[N@H+](CCc1nccs1)Cc1cc(F)ccc1[O-] ZINC000180243969 380638478 /nfs/dbraw/zinc/63/84/78/380638478.db2.gz MSSQVQAREDEFFX-UHFFFAOYSA-N 0 3 266.341 2.662 20 10 CFCDHN C[N@@H+](CCc1nccs1)Cc1cc(F)ccc1[O-] ZINC000180243969 380638483 /nfs/dbraw/zinc/63/84/83/380638483.db2.gz MSSQVQAREDEFFX-UHFFFAOYSA-N 0 3 266.341 2.662 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1[O-] ZINC000180487856 380667753 /nfs/dbraw/zinc/66/77/53/380667753.db2.gz TWYMBUYYMXFVKG-AWEZNQCLSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1[O-] ZINC000180487856 380667759 /nfs/dbraw/zinc/66/77/59/380667759.db2.gz TWYMBUYYMXFVKG-AWEZNQCLSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c1[O-] ZINC000180719526 380692915 /nfs/dbraw/zinc/69/29/15/380692915.db2.gz MHBURWIVCZGLOK-CZUORRHYSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c1[O-] ZINC000180719526 380692916 /nfs/dbraw/zinc/69/29/16/380692916.db2.gz MHBURWIVCZGLOK-CZUORRHYSA-N 0 3 285.391 2.980 20 10 CFCDHN CN(C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccco1 ZINC000180395243 380651024 /nfs/dbraw/zinc/65/10/24/380651024.db2.gz GHSQGDZVDJVYRF-ZDUSSCGKSA-N 0 3 278.327 2.517 20 10 CFCDHN CC[C@H]([NH2+]CCC1(O)CCOCC1)c1ccc(C)cc1[O-] ZINC000287565398 380868855 /nfs/dbraw/zinc/86/88/55/380868855.db2.gz QHSLUFUXEJCQHX-HNNXBMFYSA-N 0 3 293.407 2.673 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@H](C)c2ccccn2)c1 ZINC000182064686 380980478 /nfs/dbraw/zinc/98/04/78/380980478.db2.gz GSFPBECAMGSXQX-GFCCVEGCSA-N 0 3 272.348 2.989 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)c1[O-] ZINC000182090900 380990530 /nfs/dbraw/zinc/99/05/30/380990530.db2.gz RFVXGFVAJBLHLT-OAHLLOKOSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](Cc3nccn3C)C2)c1[O-] ZINC000182090900 380990535 /nfs/dbraw/zinc/99/05/35/380990535.db2.gz RFVXGFVAJBLHLT-OAHLLOKOSA-N 0 3 299.418 2.889 20 10 CFCDHN CCn1cc([C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000295879839 381134577 /nfs/dbraw/zinc/13/45/77/381134577.db2.gz GXWAHYREPQDZMN-FZMZJTMJSA-N 0 3 271.364 2.947 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc3c(c1)OCCO3)CC2 ZINC000295944960 381171850 /nfs/dbraw/zinc/17/18/50/381171850.db2.gz LDWVRFSHGKWQJT-AWEZNQCLSA-N 0 3 297.354 2.941 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCOC[C@H]1CCCO1)CC2 ZINC000295969619 381188170 /nfs/dbraw/zinc/18/81/70/381188170.db2.gz MQOPSPGBNYWSMI-CABCVRRESA-N 0 3 291.391 2.555 20 10 CFCDHN C[C@H]([NH2+]Cc1cccnc1-n1cccn1)c1ccccc1[O-] ZINC000183409846 381270235 /nfs/dbraw/zinc/27/02/35/381270235.db2.gz UOCTXMBQEJDUMB-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](C3(C)OCCO3)C2)c1[O-] ZINC000183241014 381240934 /nfs/dbraw/zinc/24/09/34/381240934.db2.gz ABOVBSZWQSCRJS-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c1[O-] ZINC000183241014 381240939 /nfs/dbraw/zinc/24/09/39/381240939.db2.gz ABOVBSZWQSCRJS-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN CCc1nn(C)c(OC)c1CN[C@@H](C)c1ccccc1O ZINC000183590506 381291003 /nfs/dbraw/zinc/29/10/03/381291003.db2.gz XHOPBRGXDULKBE-NSHDSACASA-N 0 3 289.379 2.548 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183436213 381272198 /nfs/dbraw/zinc/27/21/98/381272198.db2.gz AGQIBNCQEWRLKN-LRDDRELGSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@](C)(OC)CC2)c1 ZINC000369529250 381281392 /nfs/dbraw/zinc/28/13/92/381281392.db2.gz DLDSDPDRHXRNBX-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@](C)(OC)CC2)c1 ZINC000369529250 381281401 /nfs/dbraw/zinc/28/14/01/381281401.db2.gz DLDSDPDRHXRNBX-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccccc1[O-] ZINC000183544922 381286132 /nfs/dbraw/zinc/28/61/32/381286132.db2.gz NACKIHOXALDXRF-RDBSUJKOSA-N 0 3 262.397 2.916 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CO)CC1CCC1)CC2 ZINC000296294465 381336788 /nfs/dbraw/zinc/33/67/88/381336788.db2.gz DFKDAJUAELIDJZ-ZIAGYGMSSA-N 0 3 261.365 2.520 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCO[C@@H](C3CC3)C1)CC2 ZINC000296247073 381317688 /nfs/dbraw/zinc/31/76/88/381317688.db2.gz BBBWXBFDKGGHAZ-SQWLQELKSA-N 0 3 273.376 2.927 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)CO)c([O-])c1 ZINC000296508217 381426606 /nfs/dbraw/zinc/42/66/06/381426606.db2.gz PJKRVMYYBRSJDY-GFCCVEGCSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(C)(C)CO)c([O-])c1 ZINC000296508222 381427168 /nfs/dbraw/zinc/42/71/68/381427168.db2.gz PJKRVMYYBRSJDY-LBPRGKRZSA-N 0 3 251.370 2.760 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(O)CCCCC2)c1[O-] ZINC000184707098 381464699 /nfs/dbraw/zinc/46/46/99/381464699.db2.gz JNQNLIGQTZENRJ-UHFFFAOYSA-N 0 3 299.798 2.839 20 10 CFCDHN C[C@H](NCc1cnn(C)c1)c1cc2c(cc1O)CCCC2 ZINC000185113218 381538978 /nfs/dbraw/zinc/53/89/78/381538978.db2.gz YKIQNMVZJDIPJF-LBPRGKRZSA-N 0 3 285.391 2.855 20 10 CFCDHN Cc1noc(C)c1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297877766 381573035 /nfs/dbraw/zinc/57/30/35/381573035.db2.gz UVVLMEGZQWLMGN-AWEZNQCLSA-N 0 3 272.348 2.817 20 10 CFCDHN CC(C)(O)C1CN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000297424812 381561346 /nfs/dbraw/zinc/56/13/46/381561346.db2.gz NTQCNODNQWQXMN-UHFFFAOYSA-N 0 3 288.435 2.880 20 10 CFCDHN C[C@@H](COCC(F)(F)F)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297710083 381569593 /nfs/dbraw/zinc/56/95/93/381569593.db2.gz MRWHBDKGNWFPRM-ONGXEEELSA-N 0 3 289.297 2.937 20 10 CFCDHN CCCN(CC)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297664098 381570178 /nfs/dbraw/zinc/57/01/78/381570178.db2.gz KSJXFTKZEBYLTC-AWEZNQCLSA-N 0 3 262.397 2.701 20 10 CFCDHN COCCCCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185233397 381572395 /nfs/dbraw/zinc/57/23/95/381572395.db2.gz AGPQKANWGAVKAW-NSHDSACASA-N 0 3 255.333 2.999 20 10 CFCDHN C[C@@H]([NH2+]CCCc1cnn(C)c1)c1cc(F)ccc1[O-] ZINC000185313509 381595604 /nfs/dbraw/zinc/59/56/04/381595604.db2.gz MIXZPGHSQQYPDN-LLVKDONJSA-N 0 3 277.343 2.548 20 10 CFCDHN CC(C)[C@@H](O)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185463521 381640261 /nfs/dbraw/zinc/64/02/61/381640261.db2.gz KGTKXCLBZOFQKW-SJCJKPOMSA-N 0 3 277.408 2.939 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c1[O-] ZINC000371488989 381641953 /nfs/dbraw/zinc/64/19/53/381641953.db2.gz MMPWAYXZSSCXGI-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@@H]3CC[N@H+](C)[C@H]3C2)c1[O-] ZINC000371488989 381641960 /nfs/dbraw/zinc/64/19/60/381641960.db2.gz MMPWAYXZSSCXGI-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@]2(C)CCCC[C@@H]2O)c1 ZINC000185644184 381691448 /nfs/dbraw/zinc/69/14/48/381691448.db2.gz ANPVKUUBMRBLHJ-OAUYIBNBSA-N 0 3 293.407 2.993 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000185672724 381700005 /nfs/dbraw/zinc/70/00/05/381700005.db2.gz SZWNYUYLTWINGZ-GVXVVHGQSA-N 0 3 278.371 2.807 20 10 CFCDHN CN(Cc1cccs1)Cc1cc2c(cc1O)OCO2 ZINC000298807750 381753328 /nfs/dbraw/zinc/75/33/28/381753328.db2.gz NSTAAHYGDADUDC-UHFFFAOYSA-N 0 3 277.345 2.814 20 10 CFCDHN CCOCCN(Cc1ccc(N(C)C)cc1)C1CC1 ZINC000298724856 381726789 /nfs/dbraw/zinc/72/67/89/381726789.db2.gz PSZSICIJOMGTJM-UHFFFAOYSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c([O-])c1 ZINC000186115497 381825938 /nfs/dbraw/zinc/82/59/38/381825938.db2.gz VMTVZZIRJSAWII-YPMHNXCESA-N 0 3 271.364 2.632 20 10 CFCDHN C[C@@H]([NH2+]CC1(C)OCCO1)c1cc2c(cc1[O-])CCCC2 ZINC000186211910 381853718 /nfs/dbraw/zinc/85/37/18/381853718.db2.gz RAQHQPDLBKVRHG-GFCCVEGCSA-N 0 3 291.391 2.685 20 10 CFCDHN C[C@@H]([NH2+]CCCCCCO)c1cc(F)ccc1[O-] ZINC000186231632 381859257 /nfs/dbraw/zinc/85/92/57/381859257.db2.gz JCSOMIAIBNEMLC-LLVKDONJSA-N 0 3 255.333 2.735 20 10 CFCDHN C[C@@H]([NH2+]CC1(O)Cc2ccccc2C1)c1ccccc1[O-] ZINC000374713557 382052719 /nfs/dbraw/zinc/05/27/19/382052719.db2.gz WDJVRFMYTPDEKK-CYBMUJFWSA-N 0 3 283.371 2.573 20 10 CFCDHN CC[C@H]([NH2+]CCCCCS(C)(=O)=O)c1ccccc1[O-] ZINC000186852819 382029547 /nfs/dbraw/zinc/02/95/47/382029547.db2.gz MHZJPTHDRYUYQP-AWEZNQCLSA-N 0 3 299.436 2.648 20 10 CFCDHN COc1ccc(O)c(CN2CCC[C@H](OCC3CC3)C2)c1 ZINC000375287785 382077210 /nfs/dbraw/zinc/07/72/10/382077210.db2.gz ORUCLGLNLDGLAY-INIZCTEOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000375287785 382077215 /nfs/dbraw/zinc/07/72/15/382077215.db2.gz ORUCLGLNLDGLAY-INIZCTEOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000375287785 382077219 /nfs/dbraw/zinc/07/72/19/382077219.db2.gz ORUCLGLNLDGLAY-INIZCTEOSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC000375315659 382079649 /nfs/dbraw/zinc/07/96/49/382079649.db2.gz BQQMKMRHPBFNTM-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c1[O-] ZINC000375315659 382079659 /nfs/dbraw/zinc/07/96/59/382079659.db2.gz BQQMKMRHPBFNTM-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1[O-] ZINC000375407599 382085561 /nfs/dbraw/zinc/08/55/61/382085561.db2.gz XMMMQIDPDSJGSW-CQSZACIVSA-N 0 3 299.374 2.951 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1[O-] ZINC000375407599 382085571 /nfs/dbraw/zinc/08/55/71/382085571.db2.gz XMMMQIDPDSJGSW-CQSZACIVSA-N 0 3 299.374 2.951 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c1[O-] ZINC000375407594 382086890 /nfs/dbraw/zinc/08/68/90/382086890.db2.gz XMMMQIDPDSJGSW-AWEZNQCLSA-N 0 3 299.374 2.951 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c1[O-] ZINC000375407594 382086891 /nfs/dbraw/zinc/08/68/91/382086891.db2.gz XMMMQIDPDSJGSW-AWEZNQCLSA-N 0 3 299.374 2.951 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C2CCC3(CCCO3)CC2)c1 ZINC000376401513 382134685 /nfs/dbraw/zinc/13/46/85/382134685.db2.gz PNOLIJGUMNZFHT-UHFFFAOYSA-N 0 3 291.391 2.982 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c([O-])c1 ZINC000187306348 382151888 /nfs/dbraw/zinc/15/18/88/382151888.db2.gz AKWQWURUGGNZMA-ADSMDIBLSA-N 0 3 261.365 2.919 20 10 CFCDHN COc1cccc(CN[C@@H]2C[C@H](CO)c3ccccc32)c1O ZINC000376958359 382197328 /nfs/dbraw/zinc/19/73/28/382197328.db2.gz PKIYFTVEPNGFAN-CZUORRHYSA-N 0 3 299.370 2.711 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccccc1[O-] ZINC000377121138 382220303 /nfs/dbraw/zinc/22/03/03/382220303.db2.gz SNDFINURUGAIII-BXUZGUMPSA-N 0 3 271.364 2.854 20 10 CFCDHN C[C@]1(C[NH2+]Cc2ccccc2[O-])CCO[C@H]1C1CC1 ZINC000364070134 382258149 /nfs/dbraw/zinc/25/81/49/382258149.db2.gz BGJORNHCPDBMCQ-JKSUJKDBSA-N 0 3 261.365 2.687 20 10 CFCDHN CCCN1CCC[N@@H+]([C@H](CC)c2ccccc2[O-])CC1=O ZINC000377618238 382303829 /nfs/dbraw/zinc/30/38/29/382303829.db2.gz BWSBPEQZVYDHKP-OAHLLOKOSA-N 0 3 290.407 2.788 20 10 CFCDHN CCCN1CCC[N@H+]([C@H](CC)c2ccccc2[O-])CC1=O ZINC000377618238 382303832 /nfs/dbraw/zinc/30/38/32/382303832.db2.gz BWSBPEQZVYDHKP-OAHLLOKOSA-N 0 3 290.407 2.788 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000377755926 382336564 /nfs/dbraw/zinc/33/65/64/382336564.db2.gz MBIAXMHPXJATKN-GXSJLCMTSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1cc(Cl)ccc1[O-] ZINC000377755926 382336567 /nfs/dbraw/zinc/33/65/67/382336567.db2.gz MBIAXMHPXJATKN-GXSJLCMTSA-N 0 3 291.782 2.977 20 10 CFCDHN COc1cccc(C[NH+]2CCC(c3c[nH]cn3)CC2)c1[O-] ZINC000378341515 382440524 /nfs/dbraw/zinc/44/05/24/382440524.db2.gz LBOHVGCWBLHZPD-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000378126761 382403078 /nfs/dbraw/zinc/40/30/78/382403078.db2.gz CGWMWHZFAXIDKS-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000378126761 382403081 /nfs/dbraw/zinc/40/30/81/382403081.db2.gz CGWMWHZFAXIDKS-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@](CO)(C(C)C)C2)cc1C ZINC000378126825 382403159 /nfs/dbraw/zinc/40/31/59/382403159.db2.gz COGBMKSQGHIMJN-KRWDZBQOSA-N 0 3 277.408 2.849 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@](CO)(C(C)C)C2)cc1C ZINC000378126825 382403161 /nfs/dbraw/zinc/40/31/61/382403161.db2.gz COGBMKSQGHIMJN-KRWDZBQOSA-N 0 3 277.408 2.849 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000378126759 382403263 /nfs/dbraw/zinc/40/32/63/382403263.db2.gz CGWMWHZFAXIDKS-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000378126759 382403267 /nfs/dbraw/zinc/40/32/67/382403267.db2.gz CGWMWHZFAXIDKS-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000378371892 382449462 /nfs/dbraw/zinc/44/94/62/382449462.db2.gz AIBBFVNHBRACCI-BPLDGKMQSA-N 0 3 261.365 2.638 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000378371892 382449465 /nfs/dbraw/zinc/44/94/65/382449465.db2.gz AIBBFVNHBRACCI-BPLDGKMQSA-N 0 3 261.365 2.638 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000294223450 382467103 /nfs/dbraw/zinc/46/71/03/382467103.db2.gz LZZYSVKYFMOKOC-KGLIPLIRSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000294223450 382467104 /nfs/dbraw/zinc/46/71/04/382467104.db2.gz LZZYSVKYFMOKOC-KGLIPLIRSA-N 0 3 298.789 2.901 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cc(OC)ccc1[O-])OC ZINC000294269887 382488190 /nfs/dbraw/zinc/48/81/90/382488190.db2.gz RSQWYKRPVKZGCX-ABAIWWIYSA-N 0 3 267.369 2.552 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cc(OC)ccc1[O-])OC ZINC000294269911 382488284 /nfs/dbraw/zinc/48/82/84/382488284.db2.gz RSQWYKRPVKZGCX-XHDPSFHLSA-N 0 3 267.369 2.552 20 10 CFCDHN CCn1cc([C@@H](C)NCc2cccc(C)c2O)cn1 ZINC000294738062 382526749 /nfs/dbraw/zinc/52/67/49/382526749.db2.gz CEKHFXKBLHEMSY-GFCCVEGCSA-N 0 3 259.353 2.768 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCOC2(C)C)c([O-])c1 ZINC000294798974 382528740 /nfs/dbraw/zinc/52/87/40/382528740.db2.gz MSAYYSQDBAYLJQ-OAHLLOKOSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)cc1C ZINC000366651566 382539347 /nfs/dbraw/zinc/53/93/47/382539347.db2.gz IIDJAJJMOZHUOT-GJZGRUSLSA-N 0 3 275.392 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)cc1C ZINC000366651566 382539351 /nfs/dbraw/zinc/53/93/51/382539351.db2.gz IIDJAJJMOZHUOT-GJZGRUSLSA-N 0 3 275.392 2.867 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)[C@](C)(C(=O)OC)C1 ZINC000367317560 382564102 /nfs/dbraw/zinc/56/41/02/382564102.db2.gz LKGVSVNBNVNLIA-SUYBPPKGSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)[C@](C)(C(=O)OC)C1 ZINC000367317560 382564106 /nfs/dbraw/zinc/56/41/06/382564106.db2.gz LKGVSVNBNVNLIA-SUYBPPKGSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2CCN(C)C[C@@H]21 ZINC000367356654 382565807 /nfs/dbraw/zinc/56/58/07/382565807.db2.gz OYAROLZODOVTOM-BMFZPTHFSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H]2CCN(C)C[C@@H]21 ZINC000367356654 382565813 /nfs/dbraw/zinc/56/58/13/382565813.db2.gz OYAROLZODOVTOM-BMFZPTHFSA-N 0 3 274.408 2.869 20 10 CFCDHN COc1cccc(C[N@H+](C)CC2(O)CCCCCC2)c1[O-] ZINC000190138848 382654286 /nfs/dbraw/zinc/65/42/86/382654286.db2.gz HKHCMECNLBATJG-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1cccc(C[N@@H+](C)CC2(O)CCCCCC2)c1[O-] ZINC000190138848 382654288 /nfs/dbraw/zinc/65/42/88/382654288.db2.gz HKHCMECNLBATJG-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000190235123 382658070 /nfs/dbraw/zinc/65/80/70/382658070.db2.gz UXMFDOWNYVEKFD-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000190235123 382658071 /nfs/dbraw/zinc/65/80/71/382658071.db2.gz UXMFDOWNYVEKFD-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@@H]2O)c1[O-] ZINC000190264983 382659837 /nfs/dbraw/zinc/65/98/37/382659837.db2.gz GIRHXBRLUPKCCD-STQMWFEESA-N 0 3 269.772 2.747 20 10 CFCDHN CC[C@@H](N[C@H]1CC[NH2+]C12CCC2)c1ccc(F)cc1[O-] ZINC000530215903 383768599 /nfs/dbraw/zinc/76/85/99/383768599.db2.gz KDGVPNIYRWGAQJ-HIFRSBDPSA-N 0 3 278.371 2.857 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCNC12CCC2)c1ccc(F)cc1[O-] ZINC000530215903 383768603 /nfs/dbraw/zinc/76/86/03/383768603.db2.gz KDGVPNIYRWGAQJ-HIFRSBDPSA-N 0 3 278.371 2.857 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(CCO)CCCC2)c1 ZINC000266609382 384207064 /nfs/dbraw/zinc/20/70/64/384207064.db2.gz HISGKRBPJVXQHY-UHFFFAOYSA-N 0 3 293.407 2.823 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCCSC2)cc1C ZINC000267195344 384319937 /nfs/dbraw/zinc/31/99/37/384319937.db2.gz NMHIHHMHRZUIEK-CYBMUJFWSA-N 0 3 251.395 2.994 20 10 CFCDHN CCOc1cccc(CN[C@H]2CCCc3c[nH]nc32)c1O ZINC000268813754 384665661 /nfs/dbraw/zinc/66/56/61/384665661.db2.gz FMLUCXKWYHIGKF-ZDUSSCGKSA-N 0 3 287.363 2.681 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])c1ccc([S@](C)=O)cc1 ZINC000268824193 384671193 /nfs/dbraw/zinc/67/11/93/384671193.db2.gz KUEXXWTUFBFREW-YUNKPMOVSA-N 0 3 289.400 2.980 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC[C@@H](CO)C2)cc1F ZINC000269347036 384750170 /nfs/dbraw/zinc/75/01/70/384750170.db2.gz INSJIHRUWJFWCQ-OAHLLOKOSA-N 0 3 294.414 2.876 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)CC2CCC2)c1 ZINC000281203119 385186354 /nfs/dbraw/zinc/18/63/54/385186354.db2.gz SENXCGIUQKWOSS-DGCLKSJQSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)CC2CCC2)c1 ZINC000281203113 385187645 /nfs/dbraw/zinc/18/76/45/385187645.db2.gz SENXCGIUQKWOSS-AAEUAGOBSA-N 0 3 279.380 2.603 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(COC)CCC2)c1 ZINC000282094246 385209773 /nfs/dbraw/zinc/20/97/73/385209773.db2.gz SAIHBFQJQFIUEC-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CC[C@H]([NH2+]CC1([S@@](C)=O)CC1)c1ccc(C)cc1[O-] ZINC000282411502 385303698 /nfs/dbraw/zinc/30/36/98/385303698.db2.gz SDTYSTDNZIABCR-ORAYPTAESA-N 0 3 281.421 2.652 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCCC23CCOCC3)c1[O-] ZINC000282545803 385338402 /nfs/dbraw/zinc/33/84/02/385338402.db2.gz CNAPANKYPMHVQB-OAHLLOKOSA-N 0 3 291.391 2.840 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@]2(C)CCOC2)c1[O-] ZINC000271832684 385393887 /nfs/dbraw/zinc/39/38/87/385393887.db2.gz PALNLZACSIFUPP-CYBMUJFWSA-N 0 3 255.745 2.623 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@](C)(O)c2ccsc2)c1[O-] ZINC000271840879 385394033 /nfs/dbraw/zinc/39/40/33/385394033.db2.gz QUTOWFOONCBAAD-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)C2CCC(OC)CC2)c1 ZINC000271891985 385395185 /nfs/dbraw/zinc/39/51/85/385395185.db2.gz XHOUZGVMQOSEAT-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)C2CCC(OC)CC2)c1 ZINC000271891985 385395191 /nfs/dbraw/zinc/39/51/91/385395191.db2.gz XHOUZGVMQOSEAT-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN COCC[C@@H](NCc1ccccc1O)c1ccco1 ZINC000272417009 385532576 /nfs/dbraw/zinc/53/25/76/385532576.db2.gz CTJWCSUYALUKRZ-CYBMUJFWSA-N 0 3 261.321 2.853 20 10 CFCDHN COCC[C@H](NCc1ccccc1O)c1ccco1 ZINC000272417011 385532976 /nfs/dbraw/zinc/53/29/76/385532976.db2.gz CTJWCSUYALUKRZ-ZDUSSCGKSA-N 0 3 261.321 2.853 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284299844 385547253 /nfs/dbraw/zinc/54/72/53/385547253.db2.gz BORBAIMIUCYXFG-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284299844 385547258 /nfs/dbraw/zinc/54/72/58/385547258.db2.gz BORBAIMIUCYXFG-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(C(N)=O)c2)c([O-])c1 ZINC000284242632 385547513 /nfs/dbraw/zinc/54/75/13/385547513.db2.gz VDUKOLHJCDBGHV-CYBMUJFWSA-N 0 3 298.386 2.959 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC(=O)N(C(C)C)C2)c([O-])c1 ZINC000285159857 385552618 /nfs/dbraw/zinc/55/26/18/385552618.db2.gz MOGPXJGIPIXDKR-UONOGXRCSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c1 ZINC000272593350 385571984 /nfs/dbraw/zinc/57/19/84/385571984.db2.gz ICFHSEATBLFFAZ-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c1 ZINC000272593350 385571986 /nfs/dbraw/zinc/57/19/86/385571986.db2.gz ICFHSEATBLFFAZ-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c1[O-] ZINC000272683494 385588513 /nfs/dbraw/zinc/58/85/13/385588513.db2.gz VVPSSNXOTRTXMT-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c1[O-] ZINC000272683494 385588518 /nfs/dbraw/zinc/58/85/18/385588518.db2.gz VVPSSNXOTRTXMT-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1[O-] ZINC000272824582 385625005 /nfs/dbraw/zinc/62/50/05/385625005.db2.gz GLEKJVDOQWZJSL-HUBLWGQQSA-N 0 3 260.381 2.526 20 10 CFCDHN CCOc1cccc(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000273188423 385673282 /nfs/dbraw/zinc/67/32/82/385673282.db2.gz YUNUTWDSXLCLQW-DLBZAZTESA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C2CCN(C)CC2)c([O-])c1C ZINC000273297585 385675107 /nfs/dbraw/zinc/67/51/07/385675107.db2.gz AMZOGWBLGLEWGP-CYBMUJFWSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@H]2C)c([O-])c1 ZINC000273368884 385678505 /nfs/dbraw/zinc/67/85/05/385678505.db2.gz CANHCWJABDTMPK-DVOMOZLQSA-N 0 3 274.408 2.834 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000273540947 385687675 /nfs/dbraw/zinc/68/76/75/385687675.db2.gz YICZVWPQUQSROK-JFGNBEQYSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2O)c([O-])c1C ZINC000273574746 385689261 /nfs/dbraw/zinc/68/92/61/385689261.db2.gz LPLTZFXUXDOQPH-NWANDNLSSA-N 0 3 263.381 2.963 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273619981 385692934 /nfs/dbraw/zinc/69/29/34/385692934.db2.gz YSYUZZAPGNKUFQ-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000186154239 285240500 /nfs/dbraw/zinc/24/05/00/285240500.db2.gz CZDHXJRDQBPGEA-TVQRCGJNSA-N 0 3 253.317 2.607 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000374158017 393485771 /nfs/dbraw/zinc/48/57/71/393485771.db2.gz JPLNKTYVIMNFTI-IMJJTQAJSA-N 0 3 275.392 2.994 20 10 CFCDHN [O-]c1ccccc1CN1CCC([NH2+]C2CCCC2)CC1 ZINC000374284857 393491453 /nfs/dbraw/zinc/49/14/53/393491453.db2.gz WGYIZBWMMOWEQG-UHFFFAOYSA-N 0 3 274.408 2.889 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC3(CCO3)CC2)c([O-])c1 ZINC000374375841 393495246 /nfs/dbraw/zinc/49/52/46/393495246.db2.gz ASUKQPGKIBCRFY-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1ccccc1[O-] ZINC000183549558 393521673 /nfs/dbraw/zinc/52/16/73/393521673.db2.gz JMGXMHLSBCWUOK-GOPGUHFVSA-N 0 3 269.344 2.701 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@H]2CCCOC2)cc1C ZINC000107671916 393871007 /nfs/dbraw/zinc/87/10/07/393871007.db2.gz VBLRTJLHOXQMMI-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@H]2CCCOC2)cc1C ZINC000107671916 393871009 /nfs/dbraw/zinc/87/10/09/393871009.db2.gz VBLRTJLHOXQMMI-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C[C@@H]2CCCOC2)c1 ZINC000119802304 393925906 /nfs/dbraw/zinc/92/59/06/393925906.db2.gz VOSFAFOVUKYLLA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C[C@@H]2CCCOC2)c1 ZINC000119802304 393925910 /nfs/dbraw/zinc/92/59/10/393925910.db2.gz VOSFAFOVUKYLLA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CC[C@@H]([NH2+]CC1CCN(C(C)=O)CC1)c1ccccc1[O-] ZINC000121092119 393947824 /nfs/dbraw/zinc/94/78/24/393947824.db2.gz CFZBSMCSVPFDMX-MRXNPFEDSA-N 0 3 290.407 2.691 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)cc1C ZINC000131067866 394125271 /nfs/dbraw/zinc/12/52/71/394125271.db2.gz UENIJDGBTLFBSU-HOCLYGCPSA-N 0 3 293.432 2.715 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCS[C@H]3COCC[C@@H]32)cc1C ZINC000131067866 394125273 /nfs/dbraw/zinc/12/52/73/394125273.db2.gz UENIJDGBTLFBSU-HOCLYGCPSA-N 0 3 293.432 2.715 20 10 CFCDHN c1cc(N2CCOCC2)ccc1CN1[C@H]2C=CC[C@@H]1CC2 ZINC000367536636 394257698 /nfs/dbraw/zinc/25/76/98/394257698.db2.gz WLBFXUYLUNNEEP-ZWKOTPCHSA-N 0 3 284.403 2.816 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2COc3ccccc3[C@@H]2O)c1 ZINC000290300941 394228546 /nfs/dbraw/zinc/22/85/46/394228546.db2.gz NPNJNCYEAKUFDH-QITLCBANSA-N 0 3 299.370 2.846 20 10 CFCDHN COC(C)(C)C[C@H](C)[NH2+]Cc1cccc(C)c1[O-] ZINC000182478036 292075956 /nfs/dbraw/zinc/07/59/56/292075956.db2.gz ZGFUEGIPXJQWJJ-LBPRGKRZSA-N 0 3 251.370 2.994 20 10 CFCDHN C[C@@H](NCC1(C)OCCCO1)c1ccc(N(C)C)cc1 ZINC000190661262 287016746 /nfs/dbraw/zinc/01/67/46/287016746.db2.gz GNMNBNYYSJDFSM-CYBMUJFWSA-N 0 3 278.396 2.556 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccccc1[O-] ZINC000020146669 171033182 /nfs/dbraw/zinc/03/31/82/171033182.db2.gz IYPIURACBXOYPA-UONOGXRCSA-N 0 3 279.380 2.629 20 10 CFCDHN COc1cccc(C[NH2+]CCCOCC(C)C)c1[O-] ZINC000020147239 171033724 /nfs/dbraw/zinc/03/37/24/171033724.db2.gz RWABLNZSHZYBQY-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN COc1ccc(CNCc2ccc3c(c2)CCO3)cc1 ZINC000037362527 173151515 /nfs/dbraw/zinc/15/15/15/173151515.db2.gz BBEBYWFLZBLJJE-UHFFFAOYSA-N 0 3 269.344 2.920 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)N2CCCCC2)c1 ZINC000038028448 174017005 /nfs/dbraw/zinc/01/70/05/174017005.db2.gz MMTZDPRJZYZADQ-UONOGXRCSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[C@H]2CCCO2)c1 ZINC000038095583 174109485 /nfs/dbraw/zinc/10/94/85/174109485.db2.gz JZOHKJGXGZVWBP-VXGBXAGGSA-N 0 3 265.353 2.621 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(CC)CC1)c1ccccc1[O-] ZINC000038097942 174112866 /nfs/dbraw/zinc/11/28/66/174112866.db2.gz PHZCILRTIUOCBS-OAHLLOKOSA-N 0 3 262.397 2.917 20 10 CFCDHN C[C@H]([NH2+]CCN(C)C1CCCC1)c1ccccc1[O-] ZINC000071376735 176141194 /nfs/dbraw/zinc/14/11/94/176141194.db2.gz VSCOKMDJRSYWOM-ZDUSSCGKSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC2(O)Cc3ccccc3C2)cc1C ZINC000363558652 260942759 /nfs/dbraw/zinc/94/27/59/260942759.db2.gz PPSZCRWPQMWQFA-UHFFFAOYSA-N 0 3 297.398 2.629 20 10 CFCDHN COc1cccc(C[NH2+][C@@](C)(CO)C2CCCCC2)c1[O-] ZINC000152764659 261069235 /nfs/dbraw/zinc/06/92/35/261069235.db2.gz MPSRTMXOYBYUFT-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN Cn1nccc1[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368404077 267170361 /nfs/dbraw/zinc/17/03/61/267170361.db2.gz UIFSFLCFVCGAMI-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1nccc1[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368404077 267170363 /nfs/dbraw/zinc/17/03/63/267170363.db2.gz UIFSFLCFVCGAMI-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000368657260 267195274 /nfs/dbraw/zinc/19/52/74/267195274.db2.gz AQOGTGDSLMYFQD-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000368657260 267195275 /nfs/dbraw/zinc/19/52/75/267195275.db2.gz AQOGTGDSLMYFQD-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@]3(CCOC3)C2)cc1F ZINC000374256649 267769099 /nfs/dbraw/zinc/76/90/99/267769099.db2.gz WWBPREBDNRMWIH-MRXNPFEDSA-N 0 3 278.371 2.504 20 10 CFCDHN CC1(C)C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)CCO1 ZINC000296979726 275862416 /nfs/dbraw/zinc/86/24/16/275862416.db2.gz RWNZFOBKFUQUQQ-STQMWFEESA-N 0 3 261.365 2.927 20 10 CFCDHN COC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCO1 ZINC000278623332 277262960 /nfs/dbraw/zinc/26/29/60/277262960.db2.gz CGOIIRWZCWZTSA-JQFCIGGWSA-N 0 3 292.423 2.597 20 10 CFCDHN CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297648977 277283521 /nfs/dbraw/zinc/28/35/21/277283521.db2.gz KBEHGIWUDKXZTF-GZBFAFLISA-N 0 3 261.365 2.927 20 10 CFCDHN CC(C)C[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)N(C)C ZINC000296101340 277440851 /nfs/dbraw/zinc/44/08/51/277440851.db2.gz UITSQHBUSBYSAL-LSDHHAIUSA-N 0 3 276.424 2.945 20 10 CFCDHN COc1cccc(CN[C@H]2CN(C)Cc3ccccc32)c1O ZINC000378268643 278013154 /nfs/dbraw/zinc/01/31/54/278013154.db2.gz GJJILRHUPDHPRB-INIZCTEOSA-N 0 3 298.386 2.677 20 10 CFCDHN C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1O)c1ccccc1[O-] ZINC000248385665 278285644 /nfs/dbraw/zinc/28/56/44/278285644.db2.gz JMGXMHLSBCWUOK-JECHBYEQSA-N 0 3 269.344 2.701 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(F)cc1[O-] ZINC000293670311 288046948 /nfs/dbraw/zinc/04/69/48/288046948.db2.gz MNCRUTDPEHHLFN-FZMZJTMJSA-N 0 3 268.376 2.770 20 10 CFCDHN CC[C@H](N[C@H](C)C[S@](C)=O)c1ccc(N(C)C)cc1 ZINC000184297951 288078398 /nfs/dbraw/zinc/07/83/98/288078398.db2.gz XGCCFZBYUUZGNK-YFROIQMUSA-N 0 3 282.453 2.560 20 10 CFCDHN CC(C)C[C@@H](CN(C)C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297634834 278975322 /nfs/dbraw/zinc/97/53/22/278975322.db2.gz JNADMNMUNCYYAK-LSDHHAIUSA-N 0 3 276.424 2.945 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCOC[C@H]1[C@H]1CCCO1 ZINC000377703811 288167506 /nfs/dbraw/zinc/16/75/06/288167506.db2.gz RCDKORXJSAHZJG-HLLBOEOZSA-N 0 3 291.391 2.723 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@]2(CO)CC(C)C)c1 ZINC000188037591 295166183 /nfs/dbraw/zinc/16/61/83/295166183.db2.gz QKXQPTYYRLAVDV-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@]2(CO)CC(C)C)c1 ZINC000188037591 295166184 /nfs/dbraw/zinc/16/61/84/295166184.db2.gz QKXQPTYYRLAVDV-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000375096392 329000215 /nfs/dbraw/zinc/00/02/15/329000215.db2.gz GRZBARHHYFTJPS-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000375096392 329000217 /nfs/dbraw/zinc/00/02/17/329000217.db2.gz GRZBARHHYFTJPS-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC1(C)CC[NH+](Cc2cccc(OC)c2[O-])CC1 ZINC000292767091 329685319 /nfs/dbraw/zinc/68/53/19/329685319.db2.gz JXZHOLZAUDGOIR-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000527978669 330302290 /nfs/dbraw/zinc/30/22/90/330302290.db2.gz LEBBHXZOWNUSJE-FZZIBODNSA-N 0 3 253.317 2.749 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1c2ccccc2C(=O)N1C)c1ccccc1[O-] ZINC000528008722 330303685 /nfs/dbraw/zinc/30/36/85/330303685.db2.gz XBLKSHCIMUMRLS-MLGOLLRUSA-N 0 3 296.370 2.870 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C)C2CC(F)(F)C2)c1 ZINC000529550720 333496896 /nfs/dbraw/zinc/49/68/96/333496896.db2.gz PKTGXJKRYMKAHZ-SECBINFHSA-N 0 3 271.307 2.924 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H]2CCN2C2CCCC2)c1 ZINC000529668526 333504914 /nfs/dbraw/zinc/50/49/14/333504914.db2.gz GQGYKJYRMRZDFK-OAHLLOKOSA-N 0 3 290.407 2.507 20 10 CFCDHN CC(C)[N@H+](C)CCCNCc1c([O-])cccc1Cl ZINC000226645887 519617009 /nfs/dbraw/zinc/61/70/09/519617009.db2.gz PWQCJVOLZHLFGQ-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN CC(C)[N@@H+](C)CCCNCc1c([O-])cccc1Cl ZINC000226645887 519617018 /nfs/dbraw/zinc/61/70/18/519617018.db2.gz PWQCJVOLZHLFGQ-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN CCN(CCO)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000279678466 521121445 /nfs/dbraw/zinc/12/14/45/521121445.db2.gz PQGYPJNSVAIVQA-UHFFFAOYSA-N 0 3 290.329 2.586 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2CC(F)(F)C2)c1[O-] ZINC000277514729 522539167 /nfs/dbraw/zinc/53/91/67/522539167.db2.gz OUPOHLSHBORGGE-UHFFFAOYSA-N 0 3 277.698 2.942 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(C)CCOCC2)c1[O-] ZINC000230935122 522539268 /nfs/dbraw/zinc/53/92/68/522539268.db2.gz LDVJGWBKPUIACA-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN CC(C)(CO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000265199177 519281151 /nfs/dbraw/zinc/28/11/51/519281151.db2.gz AFQKNZLOYGXHKS-UHFFFAOYSA-N 0 3 271.360 2.920 20 10 CFCDHN CC(C)CCOCCNCc1ccc2c(c1)CCO2 ZINC000045094335 519669007 /nfs/dbraw/zinc/66/90/07/519669007.db2.gz HGZGPYODFVCOEO-UHFFFAOYSA-N 0 3 263.381 2.774 20 10 CFCDHN CC(=O)Nc1ccc(CN[C@H](C)c2cc(C)ccc2O)cn1 ZINC000278980009 519718097 /nfs/dbraw/zinc/71/80/97/519718097.db2.gz CXNXCNXUVREUGF-GFCCVEGCSA-N 0 3 299.374 2.905 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2[O-])cn1 ZINC000278980009 519718098 /nfs/dbraw/zinc/71/80/98/519718098.db2.gz CXNXCNXUVREUGF-GFCCVEGCSA-N 0 3 299.374 2.905 20 10 CFCDHN CC(C)C[C@@H](CN(C)C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000226606754 519775930 /nfs/dbraw/zinc/77/59/30/519775930.db2.gz DQNNUXSDGPPSEM-AWEZNQCLSA-N 0 3 268.376 2.597 20 10 CFCDHN CC(C)[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000276918191 519821664 /nfs/dbraw/zinc/82/16/64/519821664.db2.gz QIFPCNVTYWQEIE-YGRLFVJLSA-N 0 3 269.360 2.977 20 10 CFCDHN CC[N@H+](C)Cc1cc(Br)cc(C)c1[O-] ZINC000157753284 520259113 /nfs/dbraw/zinc/25/91/13/520259113.db2.gz HHVNYFLLVWFOBE-UHFFFAOYSA-N 0 3 258.159 2.915 20 10 CFCDHN CC[N@@H+](C)Cc1cc(Br)cc(C)c1[O-] ZINC000157753284 520259123 /nfs/dbraw/zinc/25/91/23/520259123.db2.gz HHVNYFLLVWFOBE-UHFFFAOYSA-N 0 3 258.159 2.915 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)[C@H](CC)N(C)C ZINC000298489211 520546755 /nfs/dbraw/zinc/54/67/55/520546755.db2.gz FYLRKSKTGJLMDQ-HNNXBMFYSA-N 0 3 292.423 2.861 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2ccccc2[O-])[C@H]2CCCO[C@H]21 ZINC000229319473 520669554 /nfs/dbraw/zinc/66/95/54/520669554.db2.gz XLTUCQRIDOESNW-BPLDGKMQSA-N 0 3 261.365 2.685 20 10 CFCDHN CCCCNC(=O)[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179566180 520676712 /nfs/dbraw/zinc/67/67/12/520676712.db2.gz NJQOMDUWKPXGQY-HNNXBMFYSA-N 0 3 290.407 2.521 20 10 CFCDHN CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179566180 520676723 /nfs/dbraw/zinc/67/67/23/520676723.db2.gz NJQOMDUWKPXGQY-HNNXBMFYSA-N 0 3 290.407 2.521 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000080524196 520701315 /nfs/dbraw/zinc/70/13/15/520701315.db2.gz PVKCLYFYNDWWRW-ZDUSSCGKSA-N 0 3 251.370 2.589 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](O)C[C@@H]2C)cc1 ZINC000292756008 520896347 /nfs/dbraw/zinc/89/63/47/520896347.db2.gz IZPZVNAPEHAMFZ-YOEHRIQHSA-N 0 3 276.424 2.878 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cccc(OC)c1[O-] ZINC000278604752 520959246 /nfs/dbraw/zinc/95/92/46/520959246.db2.gz FWOUIDQGPYMYJE-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cccc(OC)c1[O-] ZINC000278604752 520959257 /nfs/dbraw/zinc/95/92/57/520959257.db2.gz FWOUIDQGPYMYJE-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H](OC)C(C)C)c1 ZINC000266623557 521151134 /nfs/dbraw/zinc/15/11/34/521151134.db2.gz MFGNJJFNYZXVPA-OAHLLOKOSA-N 0 3 267.369 2.552 20 10 CFCDHN CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 ZINC000276280966 521221851 /nfs/dbraw/zinc/22/18/51/521221851.db2.gz FGWBGNJYDDTFPG-CHWSQXEVSA-N 0 3 279.380 2.681 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000290065100 521319942 /nfs/dbraw/zinc/31/99/42/521319942.db2.gz FMOIPRUGFZDGPZ-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000290065100 521319947 /nfs/dbraw/zinc/31/99/47/521319947.db2.gz FMOIPRUGFZDGPZ-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C2CC(OCC)C2)c1[O-] ZINC000290461635 521329975 /nfs/dbraw/zinc/32/99/75/521329975.db2.gz NCUKEZFDBAARSU-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C2CC(OCC)C2)c1[O-] ZINC000290461635 521329985 /nfs/dbraw/zinc/32/99/85/521329985.db2.gz NCUKEZFDBAARSU-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H]2CCO[C@@H](C)C2)c1[O-] ZINC000271591064 521364619 /nfs/dbraw/zinc/36/46/19/521364619.db2.gz ZUQNTENNXRIMCI-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](C)N(CC)CC)c1[O-] ZINC000236883456 521366356 /nfs/dbraw/zinc/36/63/56/521366356.db2.gz AWCZMZPPMRDZPG-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN CCOc1cccc(CNCc2cccc(CO)c2)c1O ZINC000222112114 521369493 /nfs/dbraw/zinc/36/94/93/521369493.db2.gz GDZIAFZVVYOVMA-UHFFFAOYSA-N 0 3 287.359 2.573 20 10 CFCDHN CCOc1cccc(C[NH2+]Cc2cccc(CO)c2)c1[O-] ZINC000222112114 521369501 /nfs/dbraw/zinc/36/95/01/521369501.db2.gz GDZIAFZVVYOVMA-UHFFFAOYSA-N 0 3 287.359 2.573 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000290920857 521375597 /nfs/dbraw/zinc/37/55/97/521375597.db2.gz NUXCBVUCUBZWLR-MRXNPFEDSA-N 0 3 293.407 2.678 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)COCC(C)C ZINC000174374597 521689724 /nfs/dbraw/zinc/68/97/24/521689724.db2.gz UDLVITFQHKYLPT-MRXNPFEDSA-N 0 3 295.423 2.638 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)COCC(C)C ZINC000174374597 521689727 /nfs/dbraw/zinc/68/97/27/521689727.db2.gz UDLVITFQHKYLPT-MRXNPFEDSA-N 0 3 295.423 2.638 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@@H](C)[C@@H](OC)C2)c1O ZINC000188309349 522538479 /nfs/dbraw/zinc/53/84/79/522538479.db2.gz YYXNKIKVXSUWAO-YGRLFVJLSA-N 0 3 299.798 2.911 20 10 CFCDHN CC[C@@H](C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000290789276 522547956 /nfs/dbraw/zinc/54/79/56/522547956.db2.gz DMHIDPYLZHJTLF-NSHDSACASA-N 0 3 273.760 2.569 20 10 CFCDHN CC[C@H]([NH2+]CC1(O)Cc2ccccc2C1)c1ccccc1[O-] ZINC000363710440 522574947 /nfs/dbraw/zinc/57/49/47/522574947.db2.gz FJMLZEYQOSKTRS-KRWDZBQOSA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@H]([NH2+]CCc1cn[nH]c1)c1ccc(C)cc1[O-] ZINC000289967115 522603861 /nfs/dbraw/zinc/60/38/61/522603861.db2.gz XGUJJYATFJSPGK-AWEZNQCLSA-N 0 3 259.353 2.707 20 10 CFCDHN CC[C@H]([NH2+]CCc1nnc(C)s1)c1ccccc1[O-] ZINC000289902016 522603982 /nfs/dbraw/zinc/60/39/82/522603982.db2.gz TZHUKUGKDNBTKJ-LBPRGKRZSA-N 0 3 277.393 2.836 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000280040331 522626937 /nfs/dbraw/zinc/62/69/37/522626937.db2.gz IUGADNPSAIUXSM-RDJZCZTQSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)c(C)cc1[O-])C(C)(C)O ZINC000293229051 522637307 /nfs/dbraw/zinc/63/73/07/522637307.db2.gz ZFDGVLQPUMVUJF-AWEZNQCLSA-N 0 3 251.370 2.648 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cnn(C)c1)c1ccccc1[O-] ZINC000156005039 522741415 /nfs/dbraw/zinc/74/14/15/522741415.db2.gz OUUOHWOSCMUWJB-RISCZKNCSA-N 0 3 259.353 2.928 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC(=O)N(C(C)C)C1)c1ccc(C)cc1[O-] ZINC000280038496 522751120 /nfs/dbraw/zinc/75/11/20/522751120.db2.gz IRIOTJCIACMDFP-ZFWWWQNUSA-N 0 3 290.407 2.751 20 10 CFCDHN COc1cc([O-])c(C[NH+]2CCCCCC2)cc1OC ZINC000159454924 522772404 /nfs/dbraw/zinc/77/24/04/522772404.db2.gz KZLNEECYJLNSHU-UHFFFAOYSA-N 0 3 265.353 2.785 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCC2(C)CC2)cc1OC ZINC000280547140 522777179 /nfs/dbraw/zinc/77/71/79/522777179.db2.gz JUJSPTWTIOCMPI-UHFFFAOYSA-N 0 3 265.353 2.689 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCSC[C@H](C)C2)cc1OC ZINC000192178802 522777878 /nfs/dbraw/zinc/77/78/78/522777878.db2.gz WYKYJSBTLMZOCF-LLVKDONJSA-N 0 3 297.420 2.594 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCSC[C@H](C)C2)cc1OC ZINC000192178802 522777892 /nfs/dbraw/zinc/77/78/92/522777892.db2.gz WYKYJSBTLMZOCF-LLVKDONJSA-N 0 3 297.420 2.594 20 10 CFCDHN COc1cc([O-])c(C[NH2+][C@H]2CCC2(C)C)cc1OC ZINC000289664527 522781378 /nfs/dbraw/zinc/78/13/78/522781378.db2.gz DAVNUVYDBPBACF-AWEZNQCLSA-N 0 3 265.353 2.688 20 10 CFCDHN COCC(C)(C)CCC[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000290133714 522807904 /nfs/dbraw/zinc/80/79/04/522807904.db2.gz NFWRCRPFGMQJES-UHFFFAOYSA-N 0 3 295.379 2.663 20 10 CFCDHN COCCC[N@H+](Cc1ccncc1)Cc1ccccc1[O-] ZINC000289569527 523266813 /nfs/dbraw/zinc/26/68/13/523266813.db2.gz ZMOHEGSKOWQMLZ-UHFFFAOYSA-N 0 3 286.375 2.826 20 10 CFCDHN COCCC[N@@H+](Cc1ccncc1)Cc1ccccc1[O-] ZINC000289569527 523266820 /nfs/dbraw/zinc/26/68/20/523266820.db2.gz ZMOHEGSKOWQMLZ-UHFFFAOYSA-N 0 3 286.375 2.826 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)cc1F ZINC000264755140 523383458 /nfs/dbraw/zinc/38/34/58/523383458.db2.gz XOPMOAFUYZDXBW-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)cc1F ZINC000264755140 523383465 /nfs/dbraw/zinc/38/34/65/523383465.db2.gz XOPMOAFUYZDXBW-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000293607618 523541149 /nfs/dbraw/zinc/54/11/49/523541149.db2.gz DVBIABFYFUBZRY-XPTSAGLGSA-N 0 3 253.317 2.607 20 10 CFCDHN CN1CCCc2cc(CNCc3cc[nH]c3)ccc21 ZINC000086252259 523863181 /nfs/dbraw/zinc/86/31/81/523863181.db2.gz MYZNBFOQZCFCNA-UHFFFAOYSA-N 0 3 255.365 2.687 20 10 CFCDHN COc1ccc(CNC[C@@](C)(O)c2ccco2)cc1C ZINC000266155285 524072148 /nfs/dbraw/zinc/07/21/48/524072148.db2.gz LREAUJAKVAJSBA-MRXNPFEDSA-N 0 3 275.348 2.594 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCOCC(F)F)c([O-])c1 ZINC000285045549 524329068 /nfs/dbraw/zinc/32/90/68/524329068.db2.gz IEVQXTPJXBELAL-LLVKDONJSA-N 0 3 273.323 2.941 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(c3c[nH]cn3)CC2)c1[O-] ZINC000361049908 524390483 /nfs/dbraw/zinc/39/04/83/524390483.db2.gz SXLCMKLYYJVNAL-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H]2CSCCS2)c1[O-] ZINC000164752385 524433617 /nfs/dbraw/zinc/43/36/17/524433617.db2.gz QYHDFFVXXCNTMG-GFCCVEGCSA-N 0 3 269.435 2.639 20 10 CFCDHN C[C@@H](CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000265674753 524514920 /nfs/dbraw/zinc/51/49/20/524514920.db2.gz XPLJFUODGUNRAC-ZDUSSCGKSA-N 0 3 271.360 2.920 20 10 CFCDHN Cc1cc(CN2CCSCC2)ccc1N(C)C ZINC000293345496 524704692 /nfs/dbraw/zinc/70/46/92/524704692.db2.gz DIZUJNIIRKIBNI-UHFFFAOYSA-N 0 3 250.411 2.610 20 10 CFCDHN C[C@@H](CNCc1c([O-])cccc1Cl)C[NH+]1CCCC1 ZINC000083551988 524739933 /nfs/dbraw/zinc/73/99/33/524739933.db2.gz WTQARPFREGKSBJ-LBPRGKRZSA-N 0 3 282.815 2.867 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCSCC[C@@H]2C)c1 ZINC000191817462 524745318 /nfs/dbraw/zinc/74/53/18/524745318.db2.gz SDJQYSCQTFTZBI-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCSCC[C@@H]2C)c1 ZINC000191817462 524745331 /nfs/dbraw/zinc/74/53/31/524745331.db2.gz SDJQYSCQTFTZBI-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCSC(C)C)c1 ZINC000289743135 524748946 /nfs/dbraw/zinc/74/89/46/524748946.db2.gz IQAHNOCNVHGWME-UHFFFAOYSA-N 0 3 255.383 2.632 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2cccc(O)c2)c1 ZINC000037150614 524752031 /nfs/dbraw/zinc/75/20/31/524752031.db2.gz YAEZIIRRUNYRAL-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H](C)c2nccs2)c1 ZINC000230694067 524752417 /nfs/dbraw/zinc/75/24/17/524752417.db2.gz YURFNQJMHUWKMH-SNVBAGLBSA-N 0 3 278.377 2.751 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H]2CSCCS2)c1 ZINC000168819004 524761830 /nfs/dbraw/zinc/76/18/30/524761830.db2.gz QSXLNBKRCJAJMY-PWSUYJOCSA-N 0 3 299.461 2.900 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)SC)c1 ZINC000168850973 524772689 /nfs/dbraw/zinc/77/26/89/524772689.db2.gz OSKAUDJWFCPLHN-UWVGGRQHSA-N 0 3 255.383 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCSC2)c1[O-] ZINC000271866016 524873970 /nfs/dbraw/zinc/87/39/70/524873970.db2.gz WBEHCFHWLYGZSG-NSHDSACASA-N 0 3 257.786 2.949 20 10 CFCDHN COc1ncccc1CN[C@@H](C)c1cc(C)ccc1O ZINC000037650319 525061507 /nfs/dbraw/zinc/06/15/07/525061507.db2.gz LIHTVZOUHROTAK-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)CCOCC2CC2)cc1C ZINC000088507505 525312469 /nfs/dbraw/zinc/31/24/69/525312469.db2.gz QSKHCHKGQINGSA-UHFFFAOYSA-N 0 3 263.381 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)CCOCC2CC2)cc1C ZINC000088507505 525312481 /nfs/dbraw/zinc/31/24/81/525312481.db2.gz QSKHCHKGQINGSA-UHFFFAOYSA-N 0 3 263.381 2.867 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@](C)(O)c2ccco2)cc1C ZINC000266179602 525321975 /nfs/dbraw/zinc/32/19/75/525321975.db2.gz UYPUWQFOQCYGSA-INIZCTEOSA-N 0 3 275.348 2.599 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@]2(O)CCc3ccccc32)cc1C ZINC000305232957 525322287 /nfs/dbraw/zinc/32/22/87/525322287.db2.gz UDNLODNVZPIOOQ-LJQANCHMSA-N 0 3 297.398 2.933 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094616947 525341803 /nfs/dbraw/zinc/34/18/03/525341803.db2.gz LBNZOBSQWWKTBX-GXTWGEPZSA-N 0 3 297.370 2.768 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3nccn3C)C2)c1 ZINC000365830311 525344071 /nfs/dbraw/zinc/34/40/71/525344071.db2.gz KDIYFXHDCHKVQZ-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3nccn3C)C2)c1 ZINC000365830311 525344074 /nfs/dbraw/zinc/34/40/74/525344074.db2.gz KDIYFXHDCHKVQZ-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c1 ZINC000291018913 525346974 /nfs/dbraw/zinc/34/69/74/525346974.db2.gz ABMWMAKDRLLKLX-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c1 ZINC000291018913 525346979 /nfs/dbraw/zinc/34/69/79/525346979.db2.gz ABMWMAKDRLLKLX-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](O)CC(C)(C)C)c1 ZINC000227374534 525348940 /nfs/dbraw/zinc/34/89/40/525348940.db2.gz UYAYYJHIEFKGIN-CYBMUJFWSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@](C)(O)c2ccsc2)c1 ZINC000265871022 525348965 /nfs/dbraw/zinc/34/89/65/525348965.db2.gz MIACYLDZVUDLRK-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CCN(C)C)c1 ZINC000049553874 525361435 /nfs/dbraw/zinc/36/14/35/525361435.db2.gz GKQBPAZUCDEVNY-QWHCGFSZSA-N 0 3 250.386 2.691 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c1 ZINC000281067646 525361701 /nfs/dbraw/zinc/36/17/01/525361701.db2.gz NWHPFXFGRXRAQK-HXPMCKFVSA-N 0 3 281.421 2.652 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)c1 ZINC000037649021 525363074 /nfs/dbraw/zinc/36/30/74/525363074.db2.gz UQVBBUDVRYXAIR-ZIAGYGMSSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2COc3ccccc3[C@@H]2O)c1 ZINC000290300939 525364750 /nfs/dbraw/zinc/36/47/50/525364750.db2.gz NPNJNCYEAKUFDH-PNPHSEOMSA-N 0 3 299.370 2.846 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000062747650 525416112 /nfs/dbraw/zinc/41/61/12/525416112.db2.gz NJONNSWYGJGYBT-NWDGAFQWSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@@H]([NH2+]CC1(O)CCCCC1)c1cc(F)ccc1[O-] ZINC000094618383 525421403 /nfs/dbraw/zinc/42/14/03/525421403.db2.gz NRUYWIALZGRWTR-LLVKDONJSA-N 0 3 267.344 2.877 20 10 CFCDHN C[C@H](NCc1cc2c(cc1O)OCO2)c1cccc(O)c1 ZINC000042880064 525433520 /nfs/dbraw/zinc/43/35/20/525433520.db2.gz FGIYZLSGMZMZTJ-JTQLQIEISA-N 0 3 287.315 2.677 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1ccccc1[O-] ZINC000062077559 525491324 /nfs/dbraw/zinc/49/13/24/525491324.db2.gz DOPAMAJBKGHAMK-UONOGXRCSA-N 0 3 262.397 2.775 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000278952784 525506865 /nfs/dbraw/zinc/50/68/65/525506865.db2.gz LONCYBWFWRGQJP-CHWSQXEVSA-N 0 3 271.364 2.502 20 10 CFCDHN C[C@@H](NCc1cccn1C)c1ccc(N2CCOCC2)cc1 ZINC000161812327 525541558 /nfs/dbraw/zinc/54/15/58/525541558.db2.gz LSPUHMKSMFLXHE-OAHLLOKOSA-N 0 3 299.418 2.713 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])c1cnn(C)c1 ZINC000273370963 525603489 /nfs/dbraw/zinc/60/34/89/525603489.db2.gz CJQZOMYEBDBKQT-ZJUUUORDSA-N 0 3 263.316 2.677 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2nccnc2C)c([O-])c1 ZINC000294914745 525728833 /nfs/dbraw/zinc/72/88/33/525728833.db2.gz GMDRCCZGMXYNLM-GFCCVEGCSA-N 0 3 271.364 2.692 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2O)c([O-])c1C ZINC000274783643 525744083 /nfs/dbraw/zinc/74/40/83/525744083.db2.gz LPLTZFXUXDOQPH-BPLDGKMQSA-N 0 3 263.381 2.963 20 10 CFCDHN Cc1ccc([C@@H](O)CNCc2ccc3c(c2)CCO3)cc1 ZINC000237899272 525780345 /nfs/dbraw/zinc/78/03/45/525780345.db2.gz LFSGYCOISBKAIC-KRWDZBQOSA-N 0 3 283.371 2.753 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000280583987 525935617 /nfs/dbraw/zinc/93/56/17/525935617.db2.gz WVUZQEUYHBQUDZ-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000280583987 525935618 /nfs/dbraw/zinc/93/56/18/525935618.db2.gz WVUZQEUYHBQUDZ-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[NH+]2CCC3(CCOCC3)CC2)c1[O-] ZINC000285126358 525936265 /nfs/dbraw/zinc/93/62/65/525936265.db2.gz OAXTWDGUZLYPHG-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H](CSC)C2)c1[O-] ZINC000292821807 525938332 /nfs/dbraw/zinc/93/83/32/525938332.db2.gz QCGSCYOYWYBYED-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H](CSC)C2)c1[O-] ZINC000292821807 525938343 /nfs/dbraw/zinc/93/83/43/525938343.db2.gz QCGSCYOYWYBYED-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN Cc1ccc([C@H](O)CNCc2ccc(N(C)C)c(F)c2)o1 ZINC000266054022 525976012 /nfs/dbraw/zinc/97/60/12/525976012.db2.gz VLZMEBVVQWNGTN-OAHLLOKOSA-N 0 3 292.354 2.616 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])o1 ZINC000272901895 525977023 /nfs/dbraw/zinc/97/70/23/525977023.db2.gz VDVSARKEXKHSRP-SMDDNHRTSA-N 0 3 261.321 2.678 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cccc(C)c2[O-])c1O ZINC000289562316 526026133 /nfs/dbraw/zinc/02/61/33/526026133.db2.gz YUPKUSQWALHHAW-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]1C1CCC1)OCO2 ZINC000102886011 526334777 /nfs/dbraw/zinc/33/47/77/526334777.db2.gz QAJVIQQNRLAXFP-CYBMUJFWSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCC1)OCO2 ZINC000102886011 526334782 /nfs/dbraw/zinc/33/47/82/526334782.db2.gz QAJVIQQNRLAXFP-CYBMUJFWSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CCC(F)(F)C1)OCO2 ZINC000280882469 526337010 /nfs/dbraw/zinc/33/70/10/526337010.db2.gz FAZOTDHYQBEKGH-SECBINFHSA-N 0 3 285.290 2.646 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](n2cccn2)C1 ZINC000361066659 526348772 /nfs/dbraw/zinc/34/87/72/526348772.db2.gz KZIFKGMNPXIKLV-CQSZACIVSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](n2cccn2)C1 ZINC000361066659 526348774 /nfs/dbraw/zinc/34/87/74/526348774.db2.gz KZIFKGMNPXIKLV-CQSZACIVSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000278357569 526372115 /nfs/dbraw/zinc/37/21/15/526372115.db2.gz JHZUJZWSIOKRND-DGCLKSJQSA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000278357569 526372119 /nfs/dbraw/zinc/37/21/19/526372119.db2.gz JHZUJZWSIOKRND-DGCLKSJQSA-N 0 3 289.297 2.527 20 10 CFCDHN c1csc(CNCc2ccc(N3CCOCC3)cc2)c1 ZINC000020139538 526581843 /nfs/dbraw/zinc/58/18/43/526581843.db2.gz FZGYTHQUBZSPFN-UHFFFAOYSA-N 0 3 288.416 2.875 20 10 CFCDHN Cc1nccn1CCC[N@@H+](C)Cc1cccc(C)c1[O-] ZINC000290572706 527409129 /nfs/dbraw/zinc/40/91/29/527409129.db2.gz TYZNMKCJURSTQD-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN Cc1nccn1CCC[N@H+](C)Cc1cccc(C)c1[O-] ZINC000290572706 527409132 /nfs/dbraw/zinc/40/91/32/527409132.db2.gz TYZNMKCJURSTQD-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)Cc2ccoc2)c1[O-] ZINC000754046348 574065323 /nfs/dbraw/zinc/06/53/23/574065323.db2.gz KUNHSMXISMSVCX-NSHDSACASA-N 0 3 261.321 2.715 20 10 CFCDHN CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2cc([O-])cs2)C1 ZINC000746301856 574144052 /nfs/dbraw/zinc/14/40/52/574144052.db2.gz UZPGDONSIFKNDH-GFCCVEGCSA-N 0 3 296.436 2.552 20 10 CFCDHN CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc([O-])cs2)C1 ZINC000746301856 574144055 /nfs/dbraw/zinc/14/40/55/574144055.db2.gz UZPGDONSIFKNDH-GFCCVEGCSA-N 0 3 296.436 2.552 20 10 CFCDHN CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2cc([O-])cs2)C1 ZINC000746301857 574144157 /nfs/dbraw/zinc/14/41/57/574144157.db2.gz UZPGDONSIFKNDH-LBPRGKRZSA-N 0 3 296.436 2.552 20 10 CFCDHN CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2cc([O-])cs2)C1 ZINC000746301857 574144159 /nfs/dbraw/zinc/14/41/59/574144159.db2.gz UZPGDONSIFKNDH-LBPRGKRZSA-N 0 3 296.436 2.552 20 10 CFCDHN CC[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H](C)O1 ZINC000732185177 574144987 /nfs/dbraw/zinc/14/49/87/574144987.db2.gz LSAPXOGHYBHKFY-WBMJQRKESA-N 0 3 275.392 2.880 20 10 CFCDHN CN(C)CCOc1ccc(N(C)Cc2cccnc2)cc1 ZINC000732410561 574156470 /nfs/dbraw/zinc/15/64/70/574156470.db2.gz DENNFJJWTSNTAN-UHFFFAOYSA-N 0 3 285.391 2.658 20 10 CFCDHN CC(C)CN(C)c1ccc(OCCN(C)C)cc1 ZINC000732411224 574156714 /nfs/dbraw/zinc/15/67/14/574156714.db2.gz WCCCJWNGKCOEAR-UHFFFAOYSA-N 0 3 250.386 2.719 20 10 CFCDHN CCOCc1cc(CN[C@H](CC)COC)ccc1OC ZINC000738440565 574168922 /nfs/dbraw/zinc/16/89/22/574168922.db2.gz VOMRZXQTNILVMB-OAHLLOKOSA-N 0 3 281.396 2.746 20 10 CFCDHN CCOCc1cc(CNC[C@@H]2CCCO2)ccc1OC ZINC000747854951 574215418 /nfs/dbraw/zinc/21/54/18/574215418.db2.gz VUEQHRYHFJCGOW-HNNXBMFYSA-N 0 3 279.380 2.500 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C2CCN(C)CC2)c2c1c(F)ccc2[O-] ZINC000756364601 574229974 /nfs/dbraw/zinc/22/99/74/574229974.db2.gz VEYUKARVBMBWQR-ZWNOBZJWSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000756401397 574234168 /nfs/dbraw/zinc/23/41/68/574234168.db2.gz OYQCEIDIQUCNBS-CABZTGNLSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756445262 574238037 /nfs/dbraw/zinc/23/80/37/574238037.db2.gz ZMAWXHZYRSEQOM-GXFFZTMASA-N 0 3 289.354 2.645 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756455768 574238876 /nfs/dbraw/zinc/23/88/76/574238876.db2.gz KQURDJXZXCTCCF-ZYHUDNBSSA-N 0 3 294.370 2.538 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@](C)(CC)CC(=O)OC)c([O-])c1 ZINC000748247339 574242951 /nfs/dbraw/zinc/24/29/51/574242951.db2.gz UIHIWQLWNYRIEG-INIZCTEOSA-N 0 3 295.379 2.612 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c([O-])c1 ZINC000756555574 574247285 /nfs/dbraw/zinc/24/72/85/574247285.db2.gz SLFHAOJXZOSRBZ-DZGCQCFKSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC2(C)COC2)c2c1c(F)ccc2[O-] ZINC000756570570 574248837 /nfs/dbraw/zinc/24/88/37/574248837.db2.gz ALLSPWMTQOTDLR-GXSJLCMTSA-N 0 3 265.328 2.706 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@](C)(O)C2CC2)c2c1c(F)ccc2[O-] ZINC000756568624 574248907 /nfs/dbraw/zinc/24/89/07/574248907.db2.gz GYJVSQLAZHSCMP-RCAYSMOQSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000756576733 574250102 /nfs/dbraw/zinc/25/01/02/574250102.db2.gz ODUNNQYMVFMHEE-MQIPJXDCSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@H]2CCCO2)c([O-])c1C ZINC000756582341 574250386 /nfs/dbraw/zinc/25/03/86/574250386.db2.gz HMGUIAFKKHGFML-LSDHHAIUSA-N 0 3 293.407 2.855 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756605179 574252046 /nfs/dbraw/zinc/25/20/46/574252046.db2.gz RCKOWZLSSYLUDL-UMNHJUIQSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCC[C@@H]2C)c1 ZINC000756615685 574252517 /nfs/dbraw/zinc/25/25/17/574252517.db2.gz FNTSEXDWDWOXQH-UONOGXRCSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CCC[C@H]2C)c([O-])c1 ZINC000756616100 574252671 /nfs/dbraw/zinc/25/26/71/574252671.db2.gz IAPANBPVDJTSSR-KGLIPLIRSA-N 0 3 262.397 2.836 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCC[C@H]2C)c1 ZINC000756619761 574252690 /nfs/dbraw/zinc/25/26/90/574252690.db2.gz ZSJMVYYEYMZCFX-CHWSQXEVSA-N 0 3 278.396 2.536 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCC[C@@H]2C)c1 ZINC000756619770 574252714 /nfs/dbraw/zinc/25/27/14/574252714.db2.gz ZSJMVYYEYMZCFX-QWHCGFSZSA-N 0 3 278.396 2.536 20 10 CFCDHN Cc1n[nH]cc1CN[C@H](C)c1ccc(C)c(C)c1O ZINC000756740332 574260725 /nfs/dbraw/zinc/26/07/25/574260725.db2.gz QSIKVCVNFJUXAH-GFCCVEGCSA-N 0 3 259.353 2.891 20 10 CFCDHN C[C@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)[S@](C)=O ZINC000756761281 574261173 /nfs/dbraw/zinc/26/11/73/574261173.db2.gz MKCKFGLQQKYSSF-RDBNXMJASA-N 0 3 299.411 2.826 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2(CCO)CCC2)c1 ZINC000756765011 574261203 /nfs/dbraw/zinc/26/12/03/574261203.db2.gz LSEQZYQIQMGVRN-ZDUSSCGKSA-N 0 3 263.381 2.904 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)CO)c1cc2c(cc1[O-])CCCC2 ZINC000756761611 574261388 /nfs/dbraw/zinc/26/13/88/574261388.db2.gz UJNMSNDZSCOEER-GFCCVEGCSA-N 0 3 277.408 2.940 20 10 CFCDHN CC1(C)C[N@H+](Cc2cc3c(cc2[O-])CCC3)CCCO1 ZINC000735298781 574319405 /nfs/dbraw/zinc/31/94/05/574319405.db2.gz SWPHKPYOLPNKID-UHFFFAOYSA-N 0 3 275.392 2.882 20 10 CFCDHN CC1(C)C[N@@H+](Cc2cc3c(cc2[O-])CCC3)CCCO1 ZINC000735298781 574319407 /nfs/dbraw/zinc/31/94/07/574319407.db2.gz SWPHKPYOLPNKID-UHFFFAOYSA-N 0 3 275.392 2.882 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)CN2CCCCC2)cc1C ZINC000742366817 574324678 /nfs/dbraw/zinc/32/46/78/574324678.db2.gz UPTOFFKIVXXRNY-OAHLLOKOSA-N 0 3 276.424 2.973 20 10 CFCDHN CCOc1ccc(O)c(CNCc2ccoc2C)c1 ZINC000725848744 574328868 /nfs/dbraw/zinc/32/88/68/574328868.db2.gz GCQWQKMFRXDBHR-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN COc1cccc(C[NH2+]CCN2CCc3ccccc32)c1[O-] ZINC000725849086 574329316 /nfs/dbraw/zinc/32/93/16/574329316.db2.gz GFLITMXCYRQBTP-UHFFFAOYSA-N 0 3 298.386 2.553 20 10 CFCDHN CCN(C)C[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743398348 574362750 /nfs/dbraw/zinc/36/27/50/574362750.db2.gz DGFDWFOUUTXZKY-AWEZNQCLSA-N 0 3 299.418 2.714 20 10 CFCDHN CCN(C)C[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743398348 574362751 /nfs/dbraw/zinc/36/27/51/574362751.db2.gz DGFDWFOUUTXZKY-AWEZNQCLSA-N 0 3 299.418 2.714 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(CO)CCCCC2)c1 ZINC000751508991 574378040 /nfs/dbraw/zinc/37/80/40/574378040.db2.gz FGQWEIHKBRZNPO-UHFFFAOYSA-N 0 3 293.407 2.823 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000044685420 618028603 /nfs/dbraw/zinc/02/86/03/618028603.db2.gz RPKRBMKUHODIJN-STQMWFEESA-N 0 3 260.381 2.588 20 10 CFCDHN CC(C)[C@@H](CO)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806170259 617816391 /nfs/dbraw/zinc/81/63/91/617816391.db2.gz YMBVSEGXMOINSQ-WZRBSPASSA-N 0 3 281.371 2.934 20 10 CFCDHN COc1cc(CN2CCSC[C@@H]2C)c(O)cc1C ZINC000179444627 618276234 /nfs/dbraw/zinc/27/62/34/618276234.db2.gz MDCBIGYTEHSFHP-NSHDSACASA-N 0 3 267.394 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H](CO)C2)c1[O-] ZINC000312448496 618280949 /nfs/dbraw/zinc/28/09/49/618280949.db2.gz OCFNUMHJUYHRME-ZWNOBZJWSA-N 0 3 299.798 2.695 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCCn1ccnc1)CC2 ZINC000312653601 618407951 /nfs/dbraw/zinc/40/79/51/618407951.db2.gz FXOJCHWBUNNQKQ-AWEZNQCLSA-N 0 3 271.364 2.646 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CC[C@H]3COCC[C@H]3C2)c([O-])c1 ZINC000894184551 618431823 /nfs/dbraw/zinc/43/18/23/618431823.db2.gz BETHKCUWXUNPER-AEGPPILISA-N 0 3 291.391 2.696 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1COCc2ccccc21 ZINC000841889848 618580552 /nfs/dbraw/zinc/58/05/52/618580552.db2.gz DRAJTWXTTVPLHE-HNNXBMFYSA-N 0 3 273.307 2.892 20 10 CFCDHN Oc1ccc(F)cc1CN[C@H]1COCc2ccccc21 ZINC000841889848 618580553 /nfs/dbraw/zinc/58/05/53/618580553.db2.gz DRAJTWXTTVPLHE-HNNXBMFYSA-N 0 3 273.307 2.892 20 10 CFCDHN CCN(CC)c1ccc(CNc2nccn2C)cc1 ZINC000840887920 618697295 /nfs/dbraw/zinc/69/72/95/618697295.db2.gz QSEDJRKAODAAGH-UHFFFAOYSA-N 0 3 258.369 2.878 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000185524207 618927303 /nfs/dbraw/zinc/92/73/03/618927303.db2.gz MVHAPKAVDIKINU-CHWSQXEVSA-N 0 3 297.370 2.625 20 10 CFCDHN C[C@H](c1ccccc1[O-])[N@@H+]1CCOc2ccc(N)cc2C1 ZINC000925752210 619055923 /nfs/dbraw/zinc/05/59/23/619055923.db2.gz HCUBFGYXUXGVQS-GFCCVEGCSA-N 0 3 284.359 2.930 20 10 CFCDHN C[C@H](c1ccccc1[O-])[N@H+]1CCOc2ccc(N)cc2C1 ZINC000925752210 619055925 /nfs/dbraw/zinc/05/59/25/619055925.db2.gz HCUBFGYXUXGVQS-GFCCVEGCSA-N 0 3 284.359 2.930 20 10 CFCDHN CCc1ncc(CN[C@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000840938180 619077681 /nfs/dbraw/zinc/07/76/81/619077681.db2.gz LPDUNDLPFGDGRA-CYBMUJFWSA-N 0 3 284.407 2.956 20 10 CFCDHN CCn1cncc1CNCc1ccc2c(c1)CCCN2C ZINC000841858541 619367708 /nfs/dbraw/zinc/36/77/08/619367708.db2.gz BSKHURUICWFXFX-UHFFFAOYSA-N 0 3 284.407 2.575 20 10 CFCDHN C[N@@H+]1CCC[C@@]2(CCN(Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859897 619486599 /nfs/dbraw/zinc/48/65/99/619486599.db2.gz QFBJSOQRAUBNBE-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN C[N@H+]1CCC[C@@]2(CCN(Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859897 619486600 /nfs/dbraw/zinc/48/66/00/619486600.db2.gz QFBJSOQRAUBNBE-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@@]2(CC[N@H+](Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859897 619486604 /nfs/dbraw/zinc/48/66/04/619486604.db2.gz QFBJSOQRAUBNBE-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@@]2(CC[N@@H+](Cc3cc(F)cc(F)c3[O-])C2)C1 ZINC000894859897 619486607 /nfs/dbraw/zinc/48/66/07/619486607.db2.gz QFBJSOQRAUBNBE-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895584077 619560356 /nfs/dbraw/zinc/56/03/56/619560356.db2.gz PBQOLGZYNZLAMH-LLVKDONJSA-N 0 3 290.388 2.847 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895584077 619560358 /nfs/dbraw/zinc/56/03/58/619560358.db2.gz PBQOLGZYNZLAMH-LLVKDONJSA-N 0 3 290.388 2.847 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CC3(CCC3)CO2)c([O-])c1 ZINC000895789027 619607194 /nfs/dbraw/zinc/60/71/94/619607194.db2.gz KHUABOZZROWCDS-CQSZACIVSA-N 0 3 261.365 2.749 20 10 CFCDHN CN(C)[C@@H](CC[NH2+]Cc1cc(F)ccc1[O-])C(F)(F)F ZINC000896878449 619854461 /nfs/dbraw/zinc/85/44/61/619854461.db2.gz HFUPAJKROHKQEL-LBPRGKRZSA-N 0 3 294.292 2.504 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H](N(C)C)C(F)(F)F)c([O-])c1 ZINC000896879632 619855794 /nfs/dbraw/zinc/85/57/94/619855794.db2.gz XRVKQHSQVXYRLV-ZDUSSCGKSA-N 0 3 290.329 2.673 20 10 CFCDHN Cc1ccc(NCC[NH2+]Cc2c(C)cccc2[O-])nc1 ZINC000897181398 619945598 /nfs/dbraw/zinc/94/55/98/619945598.db2.gz ZZWSIOBJXACTOM-UHFFFAOYSA-N 0 3 271.364 2.606 20 10 CFCDHN COC(=O)c1ccccc1CC[NH2+]Cc1c(C)cccc1[O-] ZINC000897310960 619977648 /nfs/dbraw/zinc/97/76/48/619977648.db2.gz MGKAXAIMCGNDCQ-UHFFFAOYSA-N 0 3 299.370 2.820 20 10 CFCDHN Cc1noc(C[C@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n1 ZINC000897579452 620250932 /nfs/dbraw/zinc/25/09/32/620250932.db2.gz WSWRWQPOTNPMRC-CYBMUJFWSA-N 0 3 287.363 2.538 20 10 CFCDHN Cc1noc(C[C@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n1 ZINC000897579452 620250933 /nfs/dbraw/zinc/25/09/33/620250933.db2.gz WSWRWQPOTNPMRC-CYBMUJFWSA-N 0 3 287.363 2.538 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(CC(F)F)C1)c1ccccc1[O-] ZINC000841765150 620264587 /nfs/dbraw/zinc/26/45/87/620264587.db2.gz NHVPIXRMYCPGBC-WCQYABFASA-N 0 3 284.350 2.772 20 10 CFCDHN CN(Cc1ccc(F)c(F)c1[O-])CC(C)(C)C[NH+](C)C ZINC000898306847 620369994 /nfs/dbraw/zinc/36/99/94/620369994.db2.gz OWGACFSKTAMJON-UHFFFAOYSA-N 0 3 286.366 2.690 20 10 CFCDHN CCCNC(=O)CN(CCC)Cc1cc(C)c(C)cc1O ZINC000054567844 620407820 /nfs/dbraw/zinc/40/78/20/620407820.db2.gz MNLSUOCKMONYGO-UHFFFAOYSA-N 0 3 292.423 2.747 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(C)cc1[O-] ZINC000926949803 620430299 /nfs/dbraw/zinc/43/02/99/620430299.db2.gz QISPXDMHQJBZKH-RMRKRWHISA-N 0 3 291.391 2.545 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H]1CC(=O)N(C)C1)c1ccc(C)cc1[O-] ZINC000903211011 621289021 /nfs/dbraw/zinc/28/90/21/621289021.db2.gz AGIVOSFMQJRAEH-UKRRQHHQSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@H]([NH2+]CC1(C2(O)CCC2)CC1)c1ccccc1[O-] ZINC000903258220 621301862 /nfs/dbraw/zinc/30/18/62/621301862.db2.gz SJDCCLFKHFBYJS-LBPRGKRZSA-N 0 3 261.365 2.738 20 10 CFCDHN C[C@H]1CC2(CC([NH2+][C@H]3CCc4cccc([O-])c43)C2)CO1 ZINC000903277889 621311145 /nfs/dbraw/zinc/31/11/45/621311145.db2.gz ANNDIFUNJDFIBW-MZYOMISDSA-N 0 3 273.376 2.927 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC23CCOCC3)c([O-])c1 ZINC000903391625 621351296 /nfs/dbraw/zinc/35/12/96/621351296.db2.gz ZQWTVBRMZAVGEV-XJKSGUPXSA-N 0 3 291.391 2.689 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCCN(CC)C1=O)c1ccc(C)cc1[O-] ZINC000903387782 621358975 /nfs/dbraw/zinc/35/89/75/621358975.db2.gz JBJSTNVSYWUFBO-CABCVRRESA-N 0 3 290.407 2.752 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC[C@H](O)C2CC2)c2c1c(F)ccc2[O-] ZINC000903404828 621360694 /nfs/dbraw/zinc/36/06/94/621360694.db2.gz ADWGLUNUXDMJRD-ICCXJUOJSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H](O)C1CC1)c1ccc(C)cc1[O-] ZINC000903408529 621364090 /nfs/dbraw/zinc/36/40/90/621364090.db2.gz SBLFYSUKJOEKDR-HUUCEWRRSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(CCO)cc1)c1cc(F)ccc1[O-] ZINC000903402253 621368712 /nfs/dbraw/zinc/36/87/12/621368712.db2.gz AJCDSAZLAFCZHV-GFCCVEGCSA-N 0 3 289.350 2.917 20 10 CFCDHN C[C@H]([NH2+][C@H]1COC[C@@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000903438630 621375500 /nfs/dbraw/zinc/37/55/00/621375500.db2.gz WEKMTAWHHJRLLM-FZZIBODNSA-N 0 3 265.328 2.607 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCC[C@H](O)C1)c1ccccc1[O-] ZINC000155998962 622614336 /nfs/dbraw/zinc/61/43/36/622614336.db2.gz BEOXBAKEHHIWOL-IPYPFGDCSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877045914 623020279 /nfs/dbraw/zinc/02/02/79/623020279.db2.gz FZJUQXGDSXIHLX-HNNXBMFYSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ncsc1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000226606506 623083871 /nfs/dbraw/zinc/08/38/71/623083871.db2.gz HEHAGYRYOGBYRX-UHFFFAOYSA-N 0 3 252.314 2.586 20 10 CFCDHN Cc1noc(C)c1[C@@H](C)NCc1cc(F)ccc1O ZINC000226610064 623084016 /nfs/dbraw/zinc/08/40/16/623084016.db2.gz WWMGDTCMQNTHFX-MRVPVSSYSA-N 0 3 264.300 2.987 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1cc(F)ccc1[O-] ZINC000227372894 623108247 /nfs/dbraw/zinc/10/82/47/623108247.db2.gz ZSIXSXGSVIBYSQ-GLQYFDAESA-N 0 3 278.371 2.809 20 10 CFCDHN Nc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccccc1[O-] ZINC000228408714 623143055 /nfs/dbraw/zinc/14/30/55/623143055.db2.gz RLNWFBJYDSXWDV-OAHLLOKOSA-N 0 3 254.333 2.752 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1=O)c1ccccc1[O-] ZINC000822817902 623181391 /nfs/dbraw/zinc/18/13/91/623181391.db2.gz BLABQQOMUBETAN-KGLIPLIRSA-N 0 3 290.407 2.832 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCC[C@@H](CO)C1)CC2 ZINC000312013517 623487737 /nfs/dbraw/zinc/48/77/37/623487737.db2.gz JJRXBEMAWFNASZ-KWCYVHTRSA-N 0 3 261.365 2.520 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](OC)[C@@H](C)C2)c1[O-] ZINC000824814516 623569492 /nfs/dbraw/zinc/56/94/92/623569492.db2.gz ATRFUUUPCLZQCK-GXFFZTMASA-N 0 3 299.798 2.911 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](OC)[C@@H](C)C2)c1[O-] ZINC000824814516 623569496 /nfs/dbraw/zinc/56/94/96/623569496.db2.gz ATRFUUUPCLZQCK-GXFFZTMASA-N 0 3 299.798 2.911 20 10 CFCDHN C[C@@H](NC(=O)C(C)(C)N1CCCCC1)c1ccccc1O ZINC000913763870 623581492 /nfs/dbraw/zinc/58/14/92/623581492.db2.gz UFLUULZVEUVYEP-CYBMUJFWSA-N 0 3 290.407 2.834 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H](CO)CC(C)(C)C ZINC000825040308 623613775 /nfs/dbraw/zinc/61/37/75/623613775.db2.gz GAOAYMZJEVHYJW-CYBMUJFWSA-N 0 3 251.370 2.621 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H](CO)CC(C)(C)C ZINC000825040308 623613781 /nfs/dbraw/zinc/61/37/81/623613781.db2.gz GAOAYMZJEVHYJW-CYBMUJFWSA-N 0 3 251.370 2.621 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC2(CO)CC2)c1[O-] ZINC000825041030 623614476 /nfs/dbraw/zinc/61/44/76/623614476.db2.gz ZEQJNYVTHYQYRL-UHFFFAOYSA-N 0 3 269.772 2.606 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2C[C@H](OC)C23CCC3)c1[O-] ZINC000825103374 623629398 /nfs/dbraw/zinc/62/93/98/623629398.db2.gz DGLDPIOSOZQLQL-CABCVRRESA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2C[C@H](OC)C23CCC3)c1[O-] ZINC000825103374 623629404 /nfs/dbraw/zinc/62/94/04/623629404.db2.gz DGLDPIOSOZQLQL-CABCVRRESA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)CSCCF)c([O-])c1 ZINC000825753642 623751391 /nfs/dbraw/zinc/75/13/91/623751391.db2.gz SUEQZECDHYDXEA-JTQLQIEISA-N 0 3 273.373 2.582 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@@H](O)C2)c1[O-] ZINC000834905045 623903555 /nfs/dbraw/zinc/90/35/55/623903555.db2.gz FBUCWTNCUOHEHH-IEBDPFPHSA-N 0 3 255.745 2.528 20 10 CFCDHN COCCC1CN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000826893904 623904405 /nfs/dbraw/zinc/90/44/05/623904405.db2.gz GNSVTKNTSWRCPO-PLNGDYQASA-N 0 3 274.408 2.734 20 10 CFCDHN CCN(CC)c1ccc(CNC(=O)[C@H](N)CC(C)C)cc1 ZINC000827341226 623990918 /nfs/dbraw/zinc/99/09/18/623990918.db2.gz XERJRJWNPWESGR-MRXNPFEDSA-N 0 3 291.439 2.522 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](CO)CC2CC2)c1[O-] ZINC000827358713 623992562 /nfs/dbraw/zinc/99/25/62/623992562.db2.gz DWWRXYFFPUPOAT-NSHDSACASA-N 0 3 299.798 2.552 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3COC[C@H]3C2)c1[O-] ZINC000827596130 624041539 /nfs/dbraw/zinc/04/15/39/624041539.db2.gz VGKADSLGPUHXKD-WCQYABFASA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c1[O-] ZINC000827596130 624041542 /nfs/dbraw/zinc/04/15/42/624041542.db2.gz VGKADSLGPUHXKD-WCQYABFASA-N 0 3 281.783 2.822 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827698923 624069533 /nfs/dbraw/zinc/06/95/33/624069533.db2.gz CXWAQPNGZCYDAT-BMIGLBTASA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827698923 624069534 /nfs/dbraw/zinc/06/95/34/624069534.db2.gz CXWAQPNGZCYDAT-BMIGLBTASA-N 0 3 299.798 2.505 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](CO)Cc1ccccc1)CC2 ZINC000834531313 625702549 /nfs/dbraw/zinc/70/25/49/625702549.db2.gz VUOFQRZLMQHDNB-DOTOQJQBSA-N 0 3 297.398 2.820 20 10 CFCDHN C[C@@H](C[C@H](O)c1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180900897 625047402 /nfs/dbraw/zinc/04/74/02/625047402.db2.gz OYXIEXQZABNQMA-HZMBPMFUSA-N 0 3 279.311 2.726 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)C(C)C)c([O-])c1 ZINC000185434354 625725631 /nfs/dbraw/zinc/72/56/31/625725631.db2.gz TZPFRQIYVDUGLH-DOMZBBRYSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834602768 625733903 /nfs/dbraw/zinc/73/39/03/625733903.db2.gz UVXFNWCAKMQCSC-BDJLRTHQSA-N 0 3 299.418 2.951 20 10 CFCDHN COc1ccccc1[C@@H](CO)N[C@H]1CCc2cccc(O)c21 ZINC000834654537 625759328 /nfs/dbraw/zinc/75/93/28/625759328.db2.gz OTXRXTXTHCHQIG-LSDHHAIUSA-N 0 3 299.370 2.711 20 10 CFCDHN CO[C@@H](CC[NH2+][C@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834779569 625852289 /nfs/dbraw/zinc/85/22/89/625852289.db2.gz NKGDKBOKZKXGFS-JQWIXIFHSA-N 0 3 289.297 2.937 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2cccc([O-])c21)c1cc[nH]c(=O)c1 ZINC000834810225 625871646 /nfs/dbraw/zinc/87/16/46/625871646.db2.gz ALOKAZSMIAKIBS-MFKMUULPSA-N 0 3 270.332 2.831 20 10 CFCDHN Cn1nc2c(c1C[NH2+][C@@H]1CCc3cccc([O-])c31)CCCC2 ZINC000834808211 625871787 /nfs/dbraw/zinc/87/17/87/625871787.db2.gz YDOBGRRNKIRQFE-OAHLLOKOSA-N 0 3 297.402 2.782 20 10 CFCDHN CNC(=O)C[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834900185 625915753 /nfs/dbraw/zinc/91/57/53/625915753.db2.gz NCHRCEULVYOVAU-VHSXEESVSA-N 0 3 284.787 2.529 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCC[C@H]1O)c1ccc(C)cc1[O-] ZINC000834905792 625918328 /nfs/dbraw/zinc/91/83/28/625918328.db2.gz LIFYDDYRIKVURI-NWANDNLSSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H](O)C2CCC2)c2c1c(F)ccc2[O-] ZINC000834905566 625918466 /nfs/dbraw/zinc/91/84/66/625918466.db2.gz ITBRUIDCQCURPH-LJWDBELGSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]([NH2+][C@@H](CN)C1CC1)c1cc(Br)ccc1[O-] ZINC000817960761 625964867 /nfs/dbraw/zinc/96/48/67/625964867.db2.gz RDDCOCCCHGPLLB-UFBFGSQYSA-N 0 3 299.212 2.543 20 10 CFCDHN COc1ccc(CNCc2ccc3c(c2)CCCO3)cn1 ZINC000921520050 625972308 /nfs/dbraw/zinc/97/23/08/625972308.db2.gz JIBVXVCQQLDPET-UHFFFAOYSA-N 0 3 284.359 2.705 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1c2c(nn1C)CCC2 ZINC000921747474 626104628 /nfs/dbraw/zinc/10/46/28/626104628.db2.gz PCZRTFWTDBEOFP-UHFFFAOYSA-N 0 3 298.434 2.573 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnn2C2CCC2)c1 ZINC000922283705 626259798 /nfs/dbraw/zinc/25/97/98/626259798.db2.gz HCPXHDZKVQWIOF-UHFFFAOYSA-N 0 3 271.364 2.912 20 10 CFCDHN CN(C)c1ccc(CNCc2cc(N(C)C)ccn2)cc1 ZINC000922479870 626296063 /nfs/dbraw/zinc/29/60/63/626296063.db2.gz FJSQNORJHOCSJO-UHFFFAOYSA-N 0 3 284.407 2.503 20 10 CFCDHN COC(C)(C)[C@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000922583285 626317757 /nfs/dbraw/zinc/31/77/57/626317757.db2.gz OPBFNFFJHNJEBJ-JTQLQIEISA-N 0 3 286.366 2.934 20 10 CFCDHN COc1cccc(CN[C@@H]2CCCc3cccnc32)c1O ZINC000922882822 626386760 /nfs/dbraw/zinc/38/67/60/626386760.db2.gz PPFCFLYZWJTDPU-CQSZACIVSA-N 0 3 284.359 2.963 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc3c(n2)CCC3)c1 ZINC000838946322 626515128 /nfs/dbraw/zinc/51/51/28/626515128.db2.gz DQTASKHXDRMWRK-UHFFFAOYSA-N 0 3 284.359 2.574 20 10 CFCDHN CCCCN(Cc1cnccn1)Cc1ccccc1O ZINC000839078816 626523121 /nfs/dbraw/zinc/52/31/21/626523121.db2.gz UXVVSANOJGSXBO-UHFFFAOYSA-N 0 3 271.364 2.985 20 10 CFCDHN COc1cccc(CNCc2ccc3c(n2)CCC3)c1O ZINC000839097006 626524453 /nfs/dbraw/zinc/52/44/53/626524453.db2.gz QYOSGRUJAQXEKZ-UHFFFAOYSA-N 0 3 284.359 2.574 20 10 CFCDHN CN(Cc1ccccc1)C1CN(Cc2ccccc2O)C1 ZINC000839134918 626528066 /nfs/dbraw/zinc/52/80/66/626528066.db2.gz BUBFBZBKHJDAMD-UHFFFAOYSA-N 0 3 282.387 2.708 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C2COC(C)(C)OC2)c2c1c(F)ccc2[O-] ZINC000757698351 626559014 /nfs/dbraw/zinc/55/90/14/626559014.db2.gz PVDBPHANQISWDV-JOYOIKCWSA-N 0 3 295.354 2.821 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NC2COC(C)(C)OC2)cc1 ZINC000757706023 626559622 /nfs/dbraw/zinc/55/96/22/626559622.db2.gz TVDVMKGPBPFWBV-CYBMUJFWSA-N 0 3 292.423 2.945 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H](CO)CC(F)F)c2c1c(F)ccc2[O-] ZINC000760037106 626711019 /nfs/dbraw/zinc/71/10/19/626711019.db2.gz HKIDFKHQPBLVRB-MRTMQBJTSA-N 0 3 289.297 2.685 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C[C@H](C)O)C(C)C)c1[O-] ZINC000761200581 626815182 /nfs/dbraw/zinc/81/51/82/626815182.db2.gz WZAPLNDGONELKV-JTQLQIEISA-N 0 3 287.787 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C[C@H](C)O)C(C)C)c1[O-] ZINC000761200581 626815184 /nfs/dbraw/zinc/81/51/84/626815184.db2.gz WZAPLNDGONELKV-JTQLQIEISA-N 0 3 287.787 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CC[C@@H](CO)CC2)c1[O-] ZINC000761215274 626816413 /nfs/dbraw/zinc/81/64/13/626816413.db2.gz IWKYVFUBWYVLSS-GSJFWJNXSA-N 0 3 299.798 2.695 20 10 CFCDHN C[C@H]([NH2+]CCOCC1CCC1)c1cc(F)ccc1[O-] ZINC000765808317 627159058 /nfs/dbraw/zinc/15/90/58/627159058.db2.gz JHSDEBYGERHGKD-NSHDSACASA-N 0 3 267.344 2.999 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000766223712 627186031 /nfs/dbraw/zinc/18/60/31/627186031.db2.gz JEFOGYKWMVLIEG-AWEZNQCLSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCO[C@H]1C1CC1 ZINC000767195172 627238700 /nfs/dbraw/zinc/23/87/00/627238700.db2.gz IXYXEGZBZVKMBT-DLBZAZTESA-N 0 3 291.391 2.696 20 10 CFCDHN CCOc1ccc(C[N@H+](CCO)C2CCCC2)c([O-])c1 ZINC000768137424 627319714 /nfs/dbraw/zinc/31/97/14/627319714.db2.gz KRHLBOKHNVAOBD-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCO)C2CCCC2)c([O-])c1 ZINC000768137424 627319716 /nfs/dbraw/zinc/31/97/16/627319716.db2.gz KRHLBOKHNVAOBD-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768446525 627343836 /nfs/dbraw/zinc/34/38/36/627343836.db2.gz YTGWINWBSGGQKY-BBRMVZONSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768446525 627343840 /nfs/dbraw/zinc/34/38/40/627343840.db2.gz YTGWINWBSGGQKY-BBRMVZONSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)C[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768465290 627345479 /nfs/dbraw/zinc/34/54/79/627345479.db2.gz FRDDXVLUXHDMTF-LRDDRELGSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768465290 627345481 /nfs/dbraw/zinc/34/54/81/627345481.db2.gz FRDDXVLUXHDMTF-LRDDRELGSA-N 0 3 291.391 2.686 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H](CO)c2ccsc2)c1 ZINC000769932617 627488678 /nfs/dbraw/zinc/48/86/78/627488678.db2.gz GJCVTHGDBMHGEQ-ZDUSSCGKSA-N 0 3 263.362 2.585 20 10 CFCDHN CCOc1cccc(CN[C@@H](CO)c2ccsc2)c1O ZINC000769935099 627488996 /nfs/dbraw/zinc/48/89/96/627488996.db2.gz QIFBOEXPSOCOPD-ZDUSSCGKSA-N 0 3 293.388 2.676 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1ccsc1)c1cc(F)ccc1[O-] ZINC000769990585 627494848 /nfs/dbraw/zinc/49/48/48/627494848.db2.gz UVXCBACOIREFKL-TVQRCGJNSA-N 0 3 281.352 2.977 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC[C@H]2OC)c([O-])c1 ZINC000774834051 627969071 /nfs/dbraw/zinc/96/90/71/627969071.db2.gz XUSAQKFUSMLGSP-XJKSGUPXSA-N 0 3 279.380 2.696 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000775174152 627997647 /nfs/dbraw/zinc/99/76/47/627997647.db2.gz WKTARQJOCHWEEF-HNNXBMFYSA-N 0 3 287.334 2.884 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000776700215 628169194 /nfs/dbraw/zinc/16/91/94/628169194.db2.gz KFSGEAJRLKNJJQ-SECBINFHSA-N 0 3 257.280 2.678 20 10 CFCDHN CC[N@H+](CCc1ccccn1)Cc1ccccc1[O-] ZINC000778998980 628343715 /nfs/dbraw/zinc/34/37/15/628343715.db2.gz IKZMBMYJGCZBRW-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN CC[N@@H+](CCc1ccccn1)Cc1ccccc1[O-] ZINC000778998980 628343717 /nfs/dbraw/zinc/34/37/17/628343717.db2.gz IKZMBMYJGCZBRW-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000779084392 628350534 /nfs/dbraw/zinc/35/05/34/628350534.db2.gz VFLMTYAUSGJZHW-MGAJPHDKSA-N 0 3 279.355 2.973 20 10 CFCDHN COC1CCC(C[NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000779091731 628351776 /nfs/dbraw/zinc/35/17/76/628351776.db2.gz VGPFUMPQVJTPCP-UHFFFAOYSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H](CO)c1ccccc1 ZINC000779349039 628375935 /nfs/dbraw/zinc/37/59/35/628375935.db2.gz UXYHGPXUVUSIOE-GOSISDBHSA-N 0 3 284.403 2.884 20 10 CFCDHN COC1(C)CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000779599676 628389503 /nfs/dbraw/zinc/38/95/03/628389503.db2.gz WKWIMPXZQYDRMX-UHFFFAOYSA-N 0 3 280.387 2.893 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC000783602293 628725776 /nfs/dbraw/zinc/72/57/76/628725776.db2.gz CMDZBYFZWJWXNM-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC000783602293 628725780 /nfs/dbraw/zinc/72/57/80/628725780.db2.gz CMDZBYFZWJWXNM-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CC1(C)CCC[C@@](O)(C[NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000783735557 628739908 /nfs/dbraw/zinc/73/99/08/628739908.db2.gz QZTWBLZHDZQNKY-INIZCTEOSA-N 0 3 281.371 2.952 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCCS1 ZINC000784616327 628831324 /nfs/dbraw/zinc/83/13/24/628831324.db2.gz KGRGNCSDIAOQQU-LLVKDONJSA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCCCCO)c2c1c(F)ccc2[O-] ZINC000790499457 629243204 /nfs/dbraw/zinc/24/32/04/629243204.db2.gz WWTOCIBGHNYZKW-ZYHUDNBSSA-N 0 3 267.344 2.832 20 10 CFCDHN CN1CCCC(C)(C)[C@@H]1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000790928794 629272248 /nfs/dbraw/zinc/27/22/48/629272248.db2.gz XWKKUHRQHWXRFI-HNNXBMFYSA-N 0 3 280.387 2.741 20 10 CFCDHN CC[NH+]1CCC(NCc2c([O-])ccc(Cl)c2F)CC1 ZINC000790946700 629272969 /nfs/dbraw/zinc/27/29/69/629272969.db2.gz GZZVTSHHDASFFJ-UHFFFAOYSA-N 0 3 286.778 2.759 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CCN(C3CC3)CC2)cc1 ZINC000835025777 629320768 /nfs/dbraw/zinc/32/07/68/629320768.db2.gz NIOIQTHWOJJGDY-ONEGZZNKSA-N 0 3 285.435 2.546 20 10 CFCDHN C[C@H](NC/C=C\c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000835041612 629335080 /nfs/dbraw/zinc/33/50/80/629335080.db2.gz YFOUTMMBBTVLGL-GXMNPTEKSA-N 0 3 284.407 2.850 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CC([C@@H]3CCOC3)C2)cc1 ZINC000835054395 629356472 /nfs/dbraw/zinc/35/64/72/629356472.db2.gz ORTOEZLKAHBWQA-QDLOVBKTSA-N 0 3 286.419 2.734 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCOCC1CCCC1 ZINC000835058810 629362453 /nfs/dbraw/zinc/36/24/53/629362453.db2.gz JMRVXTZRVSTBPM-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN COCCC1([NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000793328745 629525758 /nfs/dbraw/zinc/52/57/58/629525758.db2.gz DRZCZNVAOFPXGU-UHFFFAOYSA-N 0 3 253.317 2.580 20 10 CFCDHN Cc1ccc(CN(CCO)Cc2cc(C)c(C)cc2O)o1 ZINC000793364672 629532072 /nfs/dbraw/zinc/53/20/72/629532072.db2.gz FTCGRIUDJODJHK-UHFFFAOYSA-N 0 3 289.375 2.905 20 10 CFCDHN COc1ccc(CNCc2cccc(F)c2F)c(O)c1 ZINC000793387333 629536124 /nfs/dbraw/zinc/53/61/24/629536124.db2.gz DIVKMQFLUMEOIK-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H](C2CC2)O1 ZINC000794660721 629672080 /nfs/dbraw/zinc/67/20/80/629672080.db2.gz UGJKRMKLQAZOHO-XIKOKIGWSA-N 0 3 287.403 2.880 20 10 CFCDHN CC[C@H]([NH2+]CCCOCCOC)c1ccc(C)cc1[O-] ZINC000794791283 629686182 /nfs/dbraw/zinc/68/61/82/629686182.db2.gz HLWZCEMYERUXPK-HNNXBMFYSA-N 0 3 281.396 2.794 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794805156 629687560 /nfs/dbraw/zinc/68/75/60/629687560.db2.gz FYCZBKWWPGECBQ-CJNGLKHVSA-N 0 3 274.408 2.978 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794801300 629687613 /nfs/dbraw/zinc/68/76/13/629687613.db2.gz JIOINHGFPWJKQI-OCCSQVGLSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@](C)(O)C1CC1)c1ccc(C)cc1[O-] ZINC000794805458 629688031 /nfs/dbraw/zinc/68/80/31/629688031.db2.gz GSVFMJFWIZOKIK-GDBMZVCRSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000794809295 629688880 /nfs/dbraw/zinc/68/88/80/629688880.db2.gz FROOEFUELONKGI-TZMCWYRMSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCn2ccnc2C1)c1ccc(C)cc1[O-] ZINC000794812381 629689551 /nfs/dbraw/zinc/68/95/51/629689551.db2.gz CDUHLXBKNFFTBV-HIFRSBDPSA-N 0 3 285.391 2.953 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCO)C1CC1)c1ccc(C)cc1[O-] ZINC000794818668 629690360 /nfs/dbraw/zinc/69/03/60/629690360.db2.gz UVOCLAHKRPLFAZ-GJZGRUSLSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@@H](O)[C@@H](C)[NH2+]Cc2ccccc2[O-])cc1 ZINC000796484014 629925684 /nfs/dbraw/zinc/92/56/84/629925684.db2.gz MUCRTTPAVNPNCB-DYVFJYSZSA-N 0 3 271.360 2.912 20 10 CFCDHN CCN(C)C(=O)[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808716763 630418400 /nfs/dbraw/zinc/41/84/00/630418400.db2.gz VGXKXJWNLJLXNY-WDEREUQCSA-N 0 3 298.814 2.871 20 10 CFCDHN C[C@H]1CCC[C@@](C[NH2+]Cc2ccccc2[O-])(N(C)C)C1 ZINC000040668242 649985639 /nfs/dbraw/zinc/98/56/39/649985639.db2.gz VGWRIMLRSNKILX-WMLDXEAASA-N 0 3 276.424 2.992 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCCCNC2=O)c1[O-] ZINC000808675415 631026438 /nfs/dbraw/zinc/02/64/38/631026438.db2.gz GEPPQBBFZDPNLT-MFKMUULPSA-N 0 3 296.798 2.673 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](C)N(C)C)c1[O-] ZINC000808690942 631029146 /nfs/dbraw/zinc/02/91/46/631029146.db2.gz HGNDGWPDLFJRMV-GHMZBOCLSA-N 0 3 270.804 2.955 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2(CO)CC2)c1[O-] ZINC000808701111 631031028 /nfs/dbraw/zinc/03/10/28/631031028.db2.gz WIWJGLGMFUIEQW-SNVBAGLBSA-N 0 3 269.772 2.777 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCN2CCC2)c1[O-] ZINC000808708100 631031978 /nfs/dbraw/zinc/03/19/78/631031978.db2.gz HGCULEGDCVSPTJ-LLVKDONJSA-N 0 3 268.788 2.710 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@]2(O)CCO[C@H]2C)c1[O-] ZINC000808716230 631034787 /nfs/dbraw/zinc/03/47/87/631034787.db2.gz KCEYDELHMMSDGW-ZIBATOQPSA-N 0 3 299.798 2.545 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@@H](O)C(C)C ZINC000840881266 631249731 /nfs/dbraw/zinc/24/97/31/631249731.db2.gz HCUHQRMWTDGEQH-ZENOOKHLSA-N 0 3 263.381 2.765 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@H](O)C(C)C ZINC000840882997 631250240 /nfs/dbraw/zinc/25/02/40/631250240.db2.gz RCCHNWYIVZUVHS-RIEGTJTDSA-N 0 3 269.360 2.977 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000840891931 631254477 /nfs/dbraw/zinc/25/44/77/631254477.db2.gz WFQPTFSBYWCHMF-OCCSQVGLSA-N 0 3 278.396 2.654 20 10 CFCDHN C[C@H](CO)[N@@H+](Cc1cc(F)ccc1[O-])CC1CCC1 ZINC000809664228 631259676 /nfs/dbraw/zinc/25/96/76/631259676.db2.gz CCUPWFWLUNHOOD-LLVKDONJSA-N 0 3 267.344 2.514 20 10 CFCDHN C[C@H](CO)[N@H+](Cc1cc(F)ccc1[O-])CC1CCC1 ZINC000809664228 631259680 /nfs/dbraw/zinc/25/96/80/631259680.db2.gz CCUPWFWLUNHOOD-LLVKDONJSA-N 0 3 267.344 2.514 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCOC[C@H]1C1CC1 ZINC000840916966 631264776 /nfs/dbraw/zinc/26/47/76/631264776.db2.gz MGXOSJKTEAXOGW-KRWDZBQOSA-N 0 3 274.408 2.672 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccccc1CO ZINC000840930648 631266923 /nfs/dbraw/zinc/26/69/23/631266923.db2.gz NOXAXRAVDVBHCR-UHFFFAOYSA-N 0 3 284.403 2.843 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1c2ccccc2C[C@@H]1O ZINC000840935763 631268580 /nfs/dbraw/zinc/26/85/80/631268580.db2.gz CSOTYSPGEWIYSE-OALUTQOASA-N 0 3 296.414 2.809 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@H](O)C(F)(F)F)c1[O-] ZINC000809743577 631276226 /nfs/dbraw/zinc/27/62/26/631276226.db2.gz WABZKVKMYHIBOT-JTQLQIEISA-N 0 3 297.704 2.757 20 10 CFCDHN COc1cccc(O)c1CN(C)Cc1ccc(O)cc1 ZINC000809753595 631281424 /nfs/dbraw/zinc/28/14/24/631281424.db2.gz MFLCWKAAAQFQEP-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN Cc1cccc(CN2CCO[C@H](C3CCC3)C2)c1O ZINC000840954956 631283836 /nfs/dbraw/zinc/28/38/36/631283836.db2.gz NVPRSRSVFMVZLT-HNNXBMFYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cc([O-])c(CNC[C@H]2CCCC[NH2+]2)c(Cl)c1 ZINC000841033087 631313981 /nfs/dbraw/zinc/31/39/81/631313981.db2.gz KGYWDIADSGRQTO-LLVKDONJSA-N 0 3 268.788 2.586 20 10 CFCDHN CC(C)(C)[C@@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841088101 631335003 /nfs/dbraw/zinc/33/50/03/631335003.db2.gz XIYLKBYAURRWGU-LLVKDONJSA-N 0 3 274.767 2.648 20 10 CFCDHN CC(C)(C)[C@@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841088101 631335007 /nfs/dbraw/zinc/33/50/07/631335007.db2.gz XIYLKBYAURRWGU-LLVKDONJSA-N 0 3 274.767 2.648 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(CC(N)=O)cc1)c1ccccc1[O-] ZINC000810242459 631348435 /nfs/dbraw/zinc/34/84/35/631348435.db2.gz CVQSHFUIMXYNAB-INIZCTEOSA-N 0 3 298.386 2.661 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2cncn2C)c2c1c(F)ccc2[O-] ZINC000810243563 631348858 /nfs/dbraw/zinc/34/88/58/631348858.db2.gz QFNKDVKQPBBSHF-SKDRFNHKSA-N 0 3 275.327 2.603 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2COCc3ccccc32)c1 ZINC000841891792 631489357 /nfs/dbraw/zinc/48/93/57/631489357.db2.gz VDUWRVIZZLJYBD-INIZCTEOSA-N 0 3 285.343 2.762 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000842761695 631732475 /nfs/dbraw/zinc/73/24/75/631732475.db2.gz TWFOPLVOCYBQSN-NVXWUHKLSA-N 0 3 284.359 2.797 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCS[C@H]2C)c([O-])c1 ZINC000842777714 631737799 /nfs/dbraw/zinc/73/77/99/631737799.db2.gz CNKZAWINULFSJH-GXFFZTMASA-N 0 3 267.394 2.775 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)[C@@]1(O)CCOC1)c1ccccc1[O-] ZINC000842918250 631781754 /nfs/dbraw/zinc/78/17/54/631781754.db2.gz DXLYBDUIXQKHFM-WMLDXEAASA-N 0 3 293.407 2.611 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2[O-])[C@@H]1SC ZINC000842925554 631783021 /nfs/dbraw/zinc/78/30/21/631783021.db2.gz YHMIDDJEMIHARF-LTZCYQRMSA-N 0 3 281.421 2.952 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)C[C@H](C)OC)c([O-])c1 ZINC000812807965 631786651 /nfs/dbraw/zinc/78/66/51/631786651.db2.gz MYXSILBRERHQOA-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)C[C@H](C)OC)c([O-])c1 ZINC000812807965 631786656 /nfs/dbraw/zinc/78/66/56/631786656.db2.gz MYXSILBRERHQOA-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CN(Cc1cc(Cl)cc(F)c1[O-])C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000843046997 631813314 /nfs/dbraw/zinc/81/33/14/631813314.db2.gz KFIQSTKQKFIXJL-FUNVUKJBSA-N 0 3 298.789 2.900 20 10 CFCDHN CC[C@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@H]1[NH3+] ZINC000843053133 631818064 /nfs/dbraw/zinc/81/80/64/631818064.db2.gz XQPIYTGNMKBFTE-GXFFZTMASA-N 0 3 268.788 2.605 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@]3(CC[NH2+]C3)C2)c(Cl)c1 ZINC000843123942 631842977 /nfs/dbraw/zinc/84/29/77/631842977.db2.gz SLRCNHPOQMAYSL-INIZCTEOSA-N 0 3 294.826 2.930 20 10 CFCDHN NC1(c2nc(-c3ccc(O)c(O)c3)cs2)CCCC1 ZINC000843289854 631919639 /nfs/dbraw/zinc/91/96/39/631919639.db2.gz YZJREKTXFHJQRW-UHFFFAOYSA-N 0 3 276.361 2.949 20 10 CFCDHN COCC1(CC[NH2+]Cc2cc(Cl)cc(OC)c2[O-])CC1 ZINC000843419553 631949883 /nfs/dbraw/zinc/94/98/83/631949883.db2.gz XPEGAUXEZZYVBT-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN C[C@H]1CC2(C[N@@H+]1Cc1cc(F)ccc1[O-])CCOCC2 ZINC000843431594 631957452 /nfs/dbraw/zinc/95/74/52/631957452.db2.gz IOZWLGXKTKKSTO-LBPRGKRZSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@H]1CC2(C[N@H+]1Cc1cc(F)ccc1[O-])CCOCC2 ZINC000843431594 631957456 /nfs/dbraw/zinc/95/74/56/631957456.db2.gz IOZWLGXKTKKSTO-LBPRGKRZSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C1COCCOC1 ZINC000813789162 631959398 /nfs/dbraw/zinc/95/93/98/631959398.db2.gz KTNPMHPQXLRJPF-UHFFFAOYSA-N 0 3 299.370 2.564 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1[O-])CN(C)C ZINC000813877175 631971423 /nfs/dbraw/zinc/97/14/23/631971423.db2.gz NIYJIVAFWFSATA-UWVGGRQHSA-N 0 3 272.339 2.519 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000815081760 632198298 /nfs/dbraw/zinc/19/82/98/632198298.db2.gz NRTJNFUNRARYOA-DOMZBBRYSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2(CCO)CC2)c([O-])c1 ZINC000815618796 632298837 /nfs/dbraw/zinc/29/88/37/632298837.db2.gz UPPFJNVXVISCPO-CYBMUJFWSA-N 0 3 263.381 2.822 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H](CO)C(C)C)c([O-])c1 ZINC000815626118 632301005 /nfs/dbraw/zinc/30/10/05/632301005.db2.gz WDJGKIQFTRXVOM-UONOGXRCSA-N 0 3 265.397 2.924 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCO[C@]3(CCOC3)C2)ccc2ccccc21 ZINC000816570639 632487535 /nfs/dbraw/zinc/48/75/35/632487535.db2.gz BDDNYUPJLICHFW-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1c(C[N@H+]2CCO[C@]3(CCOC3)C2)ccc2ccccc21 ZINC000816570639 632487540 /nfs/dbraw/zinc/48/75/40/632487540.db2.gz BDDNYUPJLICHFW-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN Oc1ccccc1CN1CCOC[C@H]1CC1CCC1 ZINC000816667225 632508897 /nfs/dbraw/zinc/50/88/97/632508897.db2.gz HDDAZQUHZLTRHK-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOC[C@H]1CC1CCC1 ZINC000816667225 632508899 /nfs/dbraw/zinc/50/88/99/632508899.db2.gz HDDAZQUHZLTRHK-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOC[C@H]1CC1CCC1 ZINC000816667225 632508901 /nfs/dbraw/zinc/50/89/01/632508901.db2.gz HDDAZQUHZLTRHK-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](OC(C)C)C1 ZINC000846016981 632615631 /nfs/dbraw/zinc/61/56/31/632615631.db2.gz ZXKDEKTXXBBDMK-ZDUSSCGKSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000846016981 632615633 /nfs/dbraw/zinc/61/56/33/632615633.db2.gz ZXKDEKTXXBBDMK-ZDUSSCGKSA-N 0 3 279.380 2.790 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1[O-] ZINC000817411777 632623411 /nfs/dbraw/zinc/62/34/11/632623411.db2.gz ZARAPUGXTZJSOS-UMVBOHGHSA-N 0 3 290.407 2.725 20 10 CFCDHN COc1cccc([C@@H](C)NCc2cccc(F)n2)c1O ZINC000846157615 632650118 /nfs/dbraw/zinc/65/01/18/632650118.db2.gz MZWZJPDFCRICDV-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCN2CCCC2=O)c1[O-] ZINC000846204724 632659783 /nfs/dbraw/zinc/65/97/83/632659783.db2.gz AZOOAZGFSINRFA-NSHDSACASA-N 0 3 296.798 2.627 20 10 CFCDHN Cc1cc([O-])c(CN2CCC3(CC[NH2+]3)CC2)c(Cl)c1 ZINC000817865886 632715432 /nfs/dbraw/zinc/71/54/32/632715432.db2.gz OBGMNDMZKDRJLY-UHFFFAOYSA-N 0 3 280.799 2.682 20 10 CFCDHN C[C@@H]([NH2+]CCCNCc1cccnc1)c1ccccc1[O-] ZINC000817939351 632743186 /nfs/dbraw/zinc/74/31/86/632743186.db2.gz DIEINYUMSGOHQX-CQSZACIVSA-N 0 3 285.391 2.618 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1[O-] ZINC000817943572 632746733 /nfs/dbraw/zinc/74/67/33/632746733.db2.gz VPPWIOVZISHHEO-DYVFJYSZSA-N 0 3 299.418 2.809 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCCN1)c1ccc(F)cc1[O-] ZINC000817949834 632750092 /nfs/dbraw/zinc/75/00/92/632750092.db2.gz NSMGGYUEXUMYMQ-GXTWGEPZSA-N 0 3 266.360 2.714 20 10 CFCDHN CC(C)C[C@H](CN)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000817958078 632756894 /nfs/dbraw/zinc/75/68/94/632756894.db2.gz HGGVZODQCDTWKF-CMPLNLGQSA-N 0 3 254.349 2.555 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N)CCC1)c1cc(Cl)ccc1[O-] ZINC000817964646 632763355 /nfs/dbraw/zinc/76/33/55/632763355.db2.gz HAXFOJMIPUMXCE-GFCCVEGCSA-N 0 3 268.788 2.968 20 10 CFCDHN C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1[O-] ZINC000817978000 632774962 /nfs/dbraw/zinc/77/49/62/632774962.db2.gz SUHSKYNDGKQXIA-HLTSFMKQSA-N 0 3 287.201 2.541 20 10 CFCDHN Nc1ccc(NC(=O)[C@@H](N)CC2CCCCC2)cc1 ZINC000818556293 632865338 /nfs/dbraw/zinc/86/53/38/632865338.db2.gz JELSUCRBDBHUIC-AWEZNQCLSA-N 0 3 261.369 2.505 20 10 CFCDHN COc1cc(Br)cc([C@H](C)[NH2+]C2CC2)c1[O-] ZINC000848514391 633270190 /nfs/dbraw/zinc/27/01/90/633270190.db2.gz NIAFFMXBKNFBJH-ZETCQYMHSA-N 0 3 286.169 2.976 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCCN3CCCC[C@H]13)CC2 ZINC000848568216 633291200 /nfs/dbraw/zinc/29/12/00/633291200.db2.gz BNWDORSGILIEGA-BZUAXINKSA-N 0 3 286.419 2.986 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000848576361 633294764 /nfs/dbraw/zinc/29/47/64/633294764.db2.gz NVEOBIIYEKXDPF-ZDUSSCGKSA-N 0 3 291.391 2.982 20 10 CFCDHN CCc1cccc(CN(C)Cc2cccc(C(N)=O)c2)c1O ZINC000848882594 633358412 /nfs/dbraw/zinc/35/84/12/633358412.db2.gz VLEADXNYJVTOHY-UHFFFAOYSA-N 0 3 298.386 2.686 20 10 CFCDHN CCc1cccc(CN(CC)C[C@@H](O)C(F)(F)F)c1O ZINC000848903947 633390554 /nfs/dbraw/zinc/39/05/54/633390554.db2.gz HHLJVFTVLZNIPG-GFCCVEGCSA-N 0 3 291.313 2.700 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](C1CC1)[C@@H]1CCCCO1 ZINC000848921965 633403986 /nfs/dbraw/zinc/40/39/86/633403986.db2.gz KMAUTBCYHCTKHI-HOTGVXAUSA-N 0 3 279.355 2.969 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848925481 633408788 /nfs/dbraw/zinc/40/87/88/633408788.db2.gz WKYBSPIHQAJUEM-OAHLLOKOSA-N 0 3 261.365 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848925481 633408789 /nfs/dbraw/zinc/40/87/89/633408789.db2.gz WKYBSPIHQAJUEM-OAHLLOKOSA-N 0 3 261.365 2.926 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000848928140 633411006 /nfs/dbraw/zinc/41/10/06/633411006.db2.gz WPZSLTVKYAOGCA-HUUCEWRRSA-N 0 3 278.371 2.638 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C[C@@H](C)O)C2CC2)c1[O-] ZINC000848929540 633411894 /nfs/dbraw/zinc/41/18/94/633411894.db2.gz XZKADUZWRIFPNO-SNVBAGLBSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C[C@@H](C)O)C2CC2)c1[O-] ZINC000848929540 633411897 /nfs/dbraw/zinc/41/18/97/633411897.db2.gz XZKADUZWRIFPNO-SNVBAGLBSA-N 0 3 269.772 2.699 20 10 CFCDHN NC1(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])CCCC1 ZINC000849350039 633625707 /nfs/dbraw/zinc/62/57/07/633625707.db2.gz NZRUXGASBWJLBN-UHFFFAOYSA-N 0 3 272.751 2.546 20 10 CFCDHN Nc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1cc(F)ccc1[O-] ZINC000849351726 633625895 /nfs/dbraw/zinc/62/58/95/633625895.db2.gz CDBZIYHUFQMWTH-HNNXBMFYSA-N 0 3 272.323 2.891 20 10 CFCDHN Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccccc1[O-] ZINC000850113320 633845181 /nfs/dbraw/zinc/84/51/81/633845181.db2.gz CCTMGWMUULMTAX-UHFFFAOYSA-N 0 3 271.364 2.683 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccoc3)C2)cc1 ZINC000850345896 633947946 /nfs/dbraw/zinc/94/79/46/633947946.db2.gz NHJRCNPXFYUUQV-AWEZNQCLSA-N 0 3 272.348 2.657 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3occc3C)C2)cc1 ZINC000850347770 633948536 /nfs/dbraw/zinc/94/85/36/633948536.db2.gz XBPCUCRZPOAYKL-AWEZNQCLSA-N 0 3 286.375 2.965 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCN(C(C)(C)C)C2)c([O-])c1 ZINC000850350270 633949549 /nfs/dbraw/zinc/94/95/49/633949549.db2.gz AFFQDCVPDNLAJJ-AWEZNQCLSA-N 0 3 292.423 2.753 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@]2(C)CC2(F)F)c([O-])c1 ZINC000850379492 633966653 /nfs/dbraw/zinc/96/66/53/633966653.db2.gz RFNNJSSGHNDYCD-ZDUSSCGKSA-N 0 3 271.307 2.926 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC[C@H](C)O2)c([O-])c1 ZINC000850379249 633966892 /nfs/dbraw/zinc/96/68/92/633966892.db2.gz IUUNPSBOHYCBGG-WFASDCNBSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(O)CCC(C)(C)CC1 ZINC000850394256 633974681 /nfs/dbraw/zinc/97/46/81/633974681.db2.gz NWGNPPQYHJLRDV-UHFFFAOYSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](OC)C1CCCC1 ZINC000850401088 633977893 /nfs/dbraw/zinc/97/78/93/633977893.db2.gz UNXZKGJEWXLDEB-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2(CC(N)=O)CCCCC2)c1 ZINC000850413211 633982719 /nfs/dbraw/zinc/98/27/19/633982719.db2.gz OOBQDBQBWCJTTA-UHFFFAOYSA-N 0 3 290.407 2.616 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCn3nccc32)cc1 ZINC000850422012 633986684 /nfs/dbraw/zinc/98/66/84/633986684.db2.gz CECKOXOFJVVJCJ-HNNXBMFYSA-N 0 3 270.380 2.574 20 10 CFCDHN COC[C@H](CC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)OC ZINC000850486006 634014971 /nfs/dbraw/zinc/01/49/71/634014971.db2.gz QDZCHAWXYQMQOK-NTZNESFSSA-N 0 3 297.370 2.721 20 10 CFCDHN COC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C1CCOCC1 ZINC000850493408 634017950 /nfs/dbraw/zinc/01/79/50/634017950.db2.gz HIHRWQWCSQEJFE-CZUORRHYSA-N 0 3 293.407 2.793 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000850514937 634026483 /nfs/dbraw/zinc/02/64/83/634026483.db2.gz SHLVUVDDZYWUEQ-YUSALJHKSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)C2(CO)CC2)c([O-])c1 ZINC000850513172 634026568 /nfs/dbraw/zinc/02/65/68/634026568.db2.gz CPXJKXZFLVDDQW-STQMWFEESA-N 0 3 263.381 2.821 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)CC2 ZINC000850565528 634054902 /nfs/dbraw/zinc/05/49/02/634054902.db2.gz DBVIMIZSDIJNCV-LBPRGKRZSA-N 0 3 297.345 2.910 20 10 CFCDHN CC[C@@H](N[C@@H](C)c1nccn1C)c1ccccc1O ZINC000850572474 634057396 /nfs/dbraw/zinc/05/73/96/634057396.db2.gz KNHXGUKYZVAZBZ-WCQYABFASA-N 0 3 259.353 2.928 20 10 CFCDHN CCn1nccc1CNCc1cc(C)c(C)cc1O ZINC000853094150 634902650 /nfs/dbraw/zinc/90/26/50/634902650.db2.gz ZEOHUBWGYGOFOX-UHFFFAOYSA-N 0 3 259.353 2.515 20 10 CFCDHN CCOC(C)(C)CNCc1cc(F)c(N(C)C)cc1F ZINC000858159064 636143213 /nfs/dbraw/zinc/14/32/13/636143213.db2.gz XBGBGSPTMYYSQG-UHFFFAOYSA-N 0 3 286.366 2.936 20 10 CFCDHN CN(C)c1cc(F)c(CNC2(CO)CCCCC2)cc1F ZINC000858156555 636143247 /nfs/dbraw/zinc/14/32/47/636143247.db2.gz YQVFWFXDCKFUDE-UHFFFAOYSA-N 0 3 298.377 2.816 20 10 CFCDHN CO[C@@H]([C@H](C)NCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858173647 636147486 /nfs/dbraw/zinc/14/74/86/636147486.db2.gz DXAFJPWMGGZCBZ-QFYYESIMSA-N 0 3 298.377 2.934 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@@H](CO)CC2CC2)cc1F ZINC000858193635 636153195 /nfs/dbraw/zinc/15/31/95/636153195.db2.gz YWDGCXNECVSDTO-LBPRGKRZSA-N 0 3 298.377 2.529 20 10 CFCDHN CCOc1cccc(CNCc2cc(C)ccc2O)n1 ZINC000858237150 636160426 /nfs/dbraw/zinc/16/04/26/636160426.db2.gz HDDZSWATLDJRIO-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)CC(F)F)c1ccc(C)cc1[O-] ZINC000858596244 636303798 /nfs/dbraw/zinc/30/37/98/636303798.db2.gz DFLDNTJQOCIHHV-ZDUSSCGKSA-N 0 3 286.366 2.938 20 10 CFCDHN CC[C@H]1[C@@H](CO)CCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862384796 637348358 /nfs/dbraw/zinc/34/83/58/637348358.db2.gz KHJGLJFCWIWPRX-ABAIWWIYSA-N 0 3 298.377 2.624 20 10 CFCDHN Cc1cccc2c1C[C@H]([NH2+]Cc1cc(F)ccc1[O-])CO2 ZINC000862439082 637379436 /nfs/dbraw/zinc/37/94/36/637379436.db2.gz HUUREZIJCPSQMS-AWEZNQCLSA-N 0 3 287.334 2.933 20 10 CFCDHN COC(=O)C1=CC[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000862467207 637393193 /nfs/dbraw/zinc/39/31/93/637393193.db2.gz UBEGBJCAWVXSRB-CYBMUJFWSA-N 0 3 295.766 2.705 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC2(C)COC2)c1[O-] ZINC000862477827 637396365 /nfs/dbraw/zinc/39/63/65/637396365.db2.gz RYJSLSYWYORHGZ-UHFFFAOYSA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC2(C)COC2)c1[O-] ZINC000862477827 637396371 /nfs/dbraw/zinc/39/63/71/637396371.db2.gz RYJSLSYWYORHGZ-UHFFFAOYSA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1[O-] ZINC000862528845 637407977 /nfs/dbraw/zinc/40/79/77/637407977.db2.gz JYZYQPMITKKUML-XJKSGUPXSA-N 0 3 295.810 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1[O-] ZINC000862528845 637407980 /nfs/dbraw/zinc/40/79/80/637407980.db2.gz JYZYQPMITKKUML-XJKSGUPXSA-N 0 3 295.810 2.948 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+][C@H]1CC)c1ccc(F)cc1[O-] ZINC000863543693 637689783 /nfs/dbraw/zinc/68/97/83/637689783.db2.gz VZHAOKDMEGRTFB-HZSPNIEDSA-N 0 3 266.360 2.713 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(Cl)ccc1[O-] ZINC000863547642 637693420 /nfs/dbraw/zinc/69/34/20/637693420.db2.gz UDAPWDLFTDSOST-TVYUQYBPSA-N 0 3 268.788 2.837 20 10 CFCDHN COc1cccc(CNCc2cc(F)ccc2OC)c1O ZINC000189203495 650367759 /nfs/dbraw/zinc/36/77/59/650367759.db2.gz QIENXPSJUCQHTQ-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1cccc(O)c1CN[C@@H]1CCCC[C@@H]1F ZINC000865699444 638523074 /nfs/dbraw/zinc/52/30/74/638523074.db2.gz QSZUNYQLAVGEAM-NWDGAFQWSA-N 0 3 253.317 2.771 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCCC[C@@H]1F ZINC000865699444 638523082 /nfs/dbraw/zinc/52/30/82/638523082.db2.gz QSZUNYQLAVGEAM-NWDGAFQWSA-N 0 3 253.317 2.771 20 10 CFCDHN CCOc1cccc(CNCc2ccnc(F)c2)c1O ZINC000865722409 638535814 /nfs/dbraw/zinc/53/58/14/638535814.db2.gz UFQUAXJDYCHENU-UHFFFAOYSA-N 0 3 276.311 2.615 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1c2ccccc2CN1C ZINC000865807562 638584504 /nfs/dbraw/zinc/58/45/04/638584504.db2.gz VLJDDGCJVRETFU-MRXNPFEDSA-N 0 3 298.386 2.677 20 10 CFCDHN COc1cccc([C@@H](C)NCc2ccnc(F)c2)c1O ZINC000866474879 638827207 /nfs/dbraw/zinc/82/72/07/638827207.db2.gz OXZUAPOBJCDLAB-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)CC2 ZINC000866501195 638831108 /nfs/dbraw/zinc/83/11/08/638831108.db2.gz YVORXRFRRQTHIW-KXUCPTDWSA-N 0 3 257.255 2.920 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H](O)C1CCCC1)c1ccccc1[O-] ZINC000866636884 638859247 /nfs/dbraw/zinc/85/92/47/638859247.db2.gz CANQWQCDLCZMRC-DOMZBBRYSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000191609019 650512955 /nfs/dbraw/zinc/51/29/55/650512955.db2.gz CFAXKCSCLYLISR-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN Oc1ccccc1CN(CCn1ccnc1)Cc1ccco1 ZINC000123390433 641112644 /nfs/dbraw/zinc/11/26/44/641112644.db2.gz MKCLVHSRHMASLY-UHFFFAOYSA-N 0 3 297.358 2.884 20 10 CFCDHN C[C@@H](NC(=O)C[C@H]1NCc2ccccc21)c1ccccc1O ZINC000870988782 641140015 /nfs/dbraw/zinc/14/00/15/641140015.db2.gz ZJOPKCDIQXQUAC-MLGOLLRUSA-N 0 3 296.370 2.804 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2C[C@H](O)C2)c1[O-] ZINC000872127412 641655563 /nfs/dbraw/zinc/65/55/63/641655563.db2.gz SCBSHZZXJHEYBS-CKYFFXLPSA-N 0 3 269.772 2.776 20 10 CFCDHN Cc1cc(O)c(CN2CCN(C)c3ncccc3C2)cc1C ZINC000872265020 641726523 /nfs/dbraw/zinc/72/65/23/641726523.db2.gz JCGRYVQXFGRDJD-UHFFFAOYSA-N 0 3 297.402 2.856 20 10 CFCDHN CC(C)(C)[C@]1(CN)CC[N@H+](Cc2cccc(F)c2[O-])C1 ZINC000873223618 642075869 /nfs/dbraw/zinc/07/58/69/642075869.db2.gz PLAKHNMDYHTSIU-INIZCTEOSA-N 0 3 280.387 2.728 20 10 CFCDHN CC(C)(C)[C@]1(CN)CC[N@@H+](Cc2cccc(F)c2[O-])C1 ZINC000873223618 642075871 /nfs/dbraw/zinc/07/58/71/642075871.db2.gz PLAKHNMDYHTSIU-INIZCTEOSA-N 0 3 280.387 2.728 20 10 CFCDHN CCC[N@H+](Cc1ccc(=O)[nH]c1)Cc1ccccc1[O-] ZINC000876654911 642959883 /nfs/dbraw/zinc/95/98/83/642959883.db2.gz UAEMBONAHXEGNL-UHFFFAOYSA-N 0 3 272.348 2.905 20 10 CFCDHN CCC[N@@H+](Cc1ccc(=O)[nH]c1)Cc1ccccc1[O-] ZINC000876654911 642959888 /nfs/dbraw/zinc/95/98/88/642959888.db2.gz UAEMBONAHXEGNL-UHFFFAOYSA-N 0 3 272.348 2.905 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000876738652 642988282 /nfs/dbraw/zinc/98/82/82/642988282.db2.gz IZKLHWFUTXPEDG-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000876738652 642988284 /nfs/dbraw/zinc/98/82/84/642988284.db2.gz IZKLHWFUTXPEDG-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000876812652 643020434 /nfs/dbraw/zinc/02/04/34/643020434.db2.gz XTNSXHODSPGWSV-CABCVRRESA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000876812652 643020437 /nfs/dbraw/zinc/02/04/37/643020437.db2.gz XTNSXHODSPGWSV-CABCVRRESA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)c1ccccc1 ZINC000876888259 643053485 /nfs/dbraw/zinc/05/34/85/643053485.db2.gz BZXMCGMEGUZMQK-MRXNPFEDSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](Cc1ccccc1)N(C)C ZINC000876893602 643054441 /nfs/dbraw/zinc/05/44/41/643054441.db2.gz GNVNUMLNOAUJLI-KRWDZBQOSA-N 0 3 298.430 2.963 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2ccccc2F)c([O-])c1 ZINC000876958697 643081476 /nfs/dbraw/zinc/08/14/76/643081476.db2.gz BBMVGGOFNOHDDV-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CO)Cc1ccccc1 ZINC000876965724 643085933 /nfs/dbraw/zinc/08/59/33/643085933.db2.gz IUQJQFXCMDAKLG-MRXNPFEDSA-N 0 3 285.387 2.641 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOCCC(C)C ZINC000876986414 643093043 /nfs/dbraw/zinc/09/30/43/643093043.db2.gz CKCLQFJYKQBJGC-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C1CCN(CC(F)F)CC1 ZINC000876992087 643096154 /nfs/dbraw/zinc/09/61/54/643096154.db2.gz ZCLDIAXFJUXBKN-UHFFFAOYSA-N 0 3 284.350 2.520 20 10 CFCDHN Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c([O-])c1 ZINC000876995979 643098592 /nfs/dbraw/zinc/09/85/92/643098592.db2.gz LKGRZFIZOSSQPA-UHFFFAOYSA-N 0 3 269.344 2.925 20 10 CFCDHN COc1cc(C[C@H](C)[NH2+]Cc2ccccc2[O-])ccn1 ZINC000876996540 643098627 /nfs/dbraw/zinc/09/86/27/643098627.db2.gz ZCDPPFWVWJWTON-LBPRGKRZSA-N 0 3 272.348 2.517 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2c(C)cccc2[O-])c(C)o1 ZINC000877060110 643126419 /nfs/dbraw/zinc/12/64/19/643126419.db2.gz GLKPRNKWSCOANP-QGZVFWFLSA-N 0 3 289.375 2.908 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c([O-])c1 ZINC000877059021 643126582 /nfs/dbraw/zinc/12/65/82/643126582.db2.gz IZESNWZEOYCMFX-CFVMTHIKSA-N 0 3 261.365 2.604 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CCO)CC(C)C ZINC000877066936 643131582 /nfs/dbraw/zinc/13/15/82/643131582.db2.gz AYKOTUQHXSQGFP-AWEZNQCLSA-N 0 3 265.397 2.835 20 10 CFCDHN CCC(CC)(CCO)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877068884 643133137 /nfs/dbraw/zinc/13/31/37/643133137.db2.gz URPFSOIAPZHMQA-UHFFFAOYSA-N 0 3 265.397 2.979 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(CCO)CCCC2)c([O-])c1 ZINC000877068531 643133559 /nfs/dbraw/zinc/13/35/59/643133559.db2.gz RGUBUSQAPFVUQM-UHFFFAOYSA-N 0 3 263.381 2.733 20 10 CFCDHN Cc1cccc([C@H](O)C[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877090760 643146277 /nfs/dbraw/zinc/14/62/77/643146277.db2.gz BIGGODCZQUAIOU-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)Cc2ccc(F)cc2)c([O-])c1 ZINC000877117577 643159680 /nfs/dbraw/zinc/15/96/80/643159680.db2.gz JOQDESFDZQYSMV-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c([O-])c1 ZINC000877126506 643164664 /nfs/dbraw/zinc/16/46/64/643164664.db2.gz MITNBDDSFXTIQO-BMFZPTHFSA-N 0 3 273.376 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](C)C[C@@H](O)c1ccco1 ZINC000877128315 643167081 /nfs/dbraw/zinc/16/70/81/643167081.db2.gz GBBWBZWBNAMVOR-SWLSCSKDSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)C[C@@H](O)c2ccco2)c([O-])c1 ZINC000877130200 643167962 /nfs/dbraw/zinc/16/79/62/643167962.db2.gz PTEAHWUEBQGJNO-SWLSCSKDSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCC(=O)N1CCCCCC1 ZINC000877146841 643177560 /nfs/dbraw/zinc/17/75/60/643177560.db2.gz LCUOPYBAINMLNU-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2c(C)cccc2[O-])[C@@]12CCCO2 ZINC000877346754 643246030 /nfs/dbraw/zinc/24/60/30/643246030.db2.gz MWSOEBUZDGDJLZ-BBWFWOEESA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1nn(C)c2ccccc12 ZINC000877407840 643262860 /nfs/dbraw/zinc/26/28/60/643262860.db2.gz CIRIVGSDPCERLH-UHFFFAOYSA-N 0 3 295.386 2.920 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000877481094 643298223 /nfs/dbraw/zinc/29/82/23/643298223.db2.gz UVYLSMOVZGBEHW-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000877481094 643298232 /nfs/dbraw/zinc/29/82/32/643298232.db2.gz UVYLSMOVZGBEHW-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(CO)CC2(CCC2)C1 ZINC000877484490 643299987 /nfs/dbraw/zinc/29/99/87/643299987.db2.gz HWLKOFNQXNBYSH-UHFFFAOYSA-N 0 3 275.392 2.733 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc(C)cc2O)c([O-])c1 ZINC000877494406 643306983 /nfs/dbraw/zinc/30/69/83/643306983.db2.gz WPFXZFTZLWFJTR-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H](O)c2ccccc2)c([O-])c1 ZINC000877526318 643329728 /nfs/dbraw/zinc/32/97/28/643329728.db2.gz HVKFWHQBRYENPZ-INIZCTEOSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C2CCC(CO)CC2)c([O-])c1 ZINC000877530731 643334329 /nfs/dbraw/zinc/33/43/29/643334329.db2.gz GTEKTYPJQPYWAE-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+](C)C2CCC(CO)CC2)c([O-])c1 ZINC000877530731 643334334 /nfs/dbraw/zinc/33/43/34/643334334.db2.gz GTEKTYPJQPYWAE-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCCSC2)c([O-])c1 ZINC000877532890 643336822 /nfs/dbraw/zinc/33/68/22/643336822.db2.gz KOOIANYBSBHJKZ-LBPRGKRZSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@H](O)Cc1ccccc1 ZINC000877550261 643350930 /nfs/dbraw/zinc/35/09/30/643350930.db2.gz VRXQKZNYDWBVJS-MRXNPFEDSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@H](O)Cc1ccccc1 ZINC000877550261 643350939 /nfs/dbraw/zinc/35/09/39/643350939.db2.gz VRXQKZNYDWBVJS-MRXNPFEDSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]([C@H](CO)C1CC1)C1CC1 ZINC000877565931 643365154 /nfs/dbraw/zinc/36/51/54/643365154.db2.gz BIQDAGZGXXSICT-WBVHZDCISA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]([C@H](CO)C1CC1)C1CC1 ZINC000877565929 643365771 /nfs/dbraw/zinc/36/57/71/643365771.db2.gz BIQDAGZGXXSICT-NVXWUHKLSA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000877573005 643371841 /nfs/dbraw/zinc/37/18/41/643371841.db2.gz MUYIWSJUTYODCE-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000877573005 643371846 /nfs/dbraw/zinc/37/18/46/643371846.db2.gz MUYIWSJUTYODCE-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])[C@@H](O)C(C)C ZINC000877591630 643385354 /nfs/dbraw/zinc/38/53/54/643385354.db2.gz WJBSNXORGFPEQN-HIFRSBDPSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](CCO)CC1 ZINC000877596954 643389659 /nfs/dbraw/zinc/38/96/59/643389659.db2.gz VTBSOAPEQMDMEZ-AWEZNQCLSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](CCO)CC1 ZINC000877596954 643389664 /nfs/dbraw/zinc/38/96/64/643389664.db2.gz VTBSOAPEQMDMEZ-AWEZNQCLSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)Cc2ccccn2)c([O-])c1 ZINC000877618254 643405414 /nfs/dbraw/zinc/40/54/14/643405414.db2.gz MVLURCFVIBEVNR-ZDUSSCGKSA-N 0 3 256.349 2.816 20 10 CFCDHN Cc1ccc(CNCc2cnc(C(F)(F)F)nc2)c(O)c1 ZINC000877620965 643407955 /nfs/dbraw/zinc/40/79/55/643407955.db2.gz OLNQCHSUICEDRK-UHFFFAOYSA-N 0 3 297.280 2.799 20 10 CFCDHN CC[C@@H](COCC1CC1)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877622839 643409281 /nfs/dbraw/zinc/40/92/81/643409281.db2.gz USEFPGDPWAOXBE-HNNXBMFYSA-N 0 3 263.381 2.995 20 10 CFCDHN CCC(O)(CC)C[N@H+](C)Cc1ccc(C)cc1[O-] ZINC000877659627 643438743 /nfs/dbraw/zinc/43/87/43/643438743.db2.gz YEXSYQGUHDNMLV-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC(O)(CC)C[N@@H+](C)Cc1ccc(C)cc1[O-] ZINC000877659627 643438748 /nfs/dbraw/zinc/43/87/48/643438748.db2.gz YEXSYQGUHDNMLV-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H]1CCSC1 ZINC000877662719 643439472 /nfs/dbraw/zinc/43/94/72/643439472.db2.gz XATHLCBLUJZHRK-LBPRGKRZSA-N 0 3 251.395 2.933 20 10 CFCDHN CC[C@@H]1C[C@@H](C[N@@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702540 643467789 /nfs/dbraw/zinc/46/77/89/643467789.db2.gz AOYJCZOAZWDLPE-GXTWGEPZSA-N 0 3 261.365 2.913 20 10 CFCDHN CC[C@@H]1C[C@@H](C[N@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702540 643467792 /nfs/dbraw/zinc/46/77/92/643467792.db2.gz AOYJCZOAZWDLPE-GXTWGEPZSA-N 0 3 261.365 2.913 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877739573 643506993 /nfs/dbraw/zinc/50/69/93/643506993.db2.gz OJYWMKYUUAODLO-NEPJUHHUSA-N 0 3 279.405 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877739573 643506999 /nfs/dbraw/zinc/50/69/99/643506999.db2.gz OJYWMKYUUAODLO-NEPJUHHUSA-N 0 3 279.405 2.586 20 10 CFCDHN C[C@H]([NH2+]C1CCN(c2cnccn2)CC1)c1ccccc1[O-] ZINC000877757048 643536753 /nfs/dbraw/zinc/53/67/53/643536753.db2.gz CSEIMCLOBOXLLZ-ZDUSSCGKSA-N 0 3 298.390 2.502 20 10 CFCDHN CCOC(=O)C1(C)CC([NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000877757520 643536949 /nfs/dbraw/zinc/53/69/49/643536949.db2.gz LWYVLNSMWZIUSF-OPGSHWCFSA-N 0 3 277.364 2.775 20 10 CFCDHN C[C@@H](CCn1cccn1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877757085 643537399 /nfs/dbraw/zinc/53/73/99/643537399.db2.gz FOYBNSJVRGKMLQ-STQMWFEESA-N 0 3 259.353 2.718 20 10 CFCDHN CCCn1nccc1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877758044 643538797 /nfs/dbraw/zinc/53/87/97/643538797.db2.gz GRLZSWISLQPWDP-LBPRGKRZSA-N 0 3 259.353 2.850 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@@H](O)C1CCCC1 ZINC000877777414 643553460 /nfs/dbraw/zinc/55/34/60/643553460.db2.gz ABCSEQSEHRWATP-OAHLLOKOSA-N 0 3 267.344 2.562 20 10 CFCDHN CC(C)(O)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877796576 643562728 /nfs/dbraw/zinc/56/27/28/643562728.db2.gz JHWMJUBXVCWODC-GFCCVEGCSA-N 0 3 267.344 2.514 20 10 CFCDHN CC(C)(O)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877796576 643562732 /nfs/dbraw/zinc/56/27/32/643562732.db2.gz JHWMJUBXVCWODC-GFCCVEGCSA-N 0 3 267.344 2.514 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H](C(C)(C)O)C2)c1[O-] ZINC000877796410 643562992 /nfs/dbraw/zinc/56/29/92/643562992.db2.gz FYEXSAASOJUSGC-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H](C(C)(C)O)C2)c1[O-] ZINC000877796410 643562997 /nfs/dbraw/zinc/56/29/97/643562997.db2.gz FYEXSAASOJUSGC-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000877806172 643568456 /nfs/dbraw/zinc/56/84/56/643568456.db2.gz OAWOWLURNBTDOW-XEGUGMAKSA-N 0 3 265.328 2.579 20 10 CFCDHN CC(=O)Nc1ccc2c(c1)CN(Cc1ccccc1O)CC2 ZINC000877817165 643582312 /nfs/dbraw/zinc/58/23/12/643582312.db2.gz SQNFMYJTFQZPQU-UHFFFAOYSA-N 0 3 296.370 2.909 20 10 CFCDHN CC(=O)Nc1ccc2c(c1)C[N@@H+](Cc1ccccc1[O-])CC2 ZINC000877817165 643582319 /nfs/dbraw/zinc/58/23/19/643582319.db2.gz SQNFMYJTFQZPQU-UHFFFAOYSA-N 0 3 296.370 2.909 20 10 CFCDHN CC(=O)Nc1ccc2c(c1)C[N@H+](Cc1ccccc1[O-])CC2 ZINC000877817165 643582323 /nfs/dbraw/zinc/58/23/23/643582323.db2.gz SQNFMYJTFQZPQU-UHFFFAOYSA-N 0 3 296.370 2.909 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877818830 643583630 /nfs/dbraw/zinc/58/36/30/643583630.db2.gz PYQIEUJFJLELME-GFCCVEGCSA-N 0 3 295.354 2.697 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877818830 643583634 /nfs/dbraw/zinc/58/36/34/643583634.db2.gz PYQIEUJFJLELME-GFCCVEGCSA-N 0 3 295.354 2.697 20 10 CFCDHN CCc1cccc(CN[C@H](C)c2nccnc2C)c1O ZINC000877828031 643593596 /nfs/dbraw/zinc/59/35/96/643593596.db2.gz DFTJNSAMESCQJD-GFCCVEGCSA-N 0 3 271.364 2.904 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H]2c2cn[nH]c2)cc1 ZINC000878875983 644058304 /nfs/dbraw/zinc/05/83/04/644058304.db2.gz IAJVWMKYFQFLAV-INIZCTEOSA-N 0 3 270.380 2.813 20 10 CFCDHN CCCCCNC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648782 644363095 /nfs/dbraw/zinc/36/30/95/644363095.db2.gz DLKYIKMFTKKQAA-OLZOCXBDSA-N 0 3 278.396 2.738 20 10 CFCDHN CC(C)CC[C@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648933 644363415 /nfs/dbraw/zinc/36/34/15/644363415.db2.gz GOVCINZVSKVSAZ-OLZOCXBDSA-N 0 3 251.370 2.840 20 10 CFCDHN CCC[C@@H](C)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649040 644363589 /nfs/dbraw/zinc/36/35/89/644363589.db2.gz JZDBDEVEEJZEAP-JHJVBQTASA-N 0 3 278.396 2.736 20 10 CFCDHN CCC(CC)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651553 644364613 /nfs/dbraw/zinc/36/46/13/644364613.db2.gz ASEGSISQJMQECV-RYUDHWBXSA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@H](NCc1cc(CO)ccc1F)c1ccccc1O ZINC000879650161 644364859 /nfs/dbraw/zinc/36/48/59/644364859.db2.gz MMFSCINULJUZAP-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(CO)ccc1F)c1ccccc1[O-] ZINC000879650161 644364865 /nfs/dbraw/zinc/36/48/65/644364865.db2.gz MMFSCINULJUZAP-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000094618372 650960486 /nfs/dbraw/zinc/96/04/86/650960486.db2.gz TTWLOLBXPCSFGC-ZWNOBZJWSA-N 0 3 255.333 2.853 20 10 CFCDHN CCC[C@@H](N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 ZINC000881377333 644964289 /nfs/dbraw/zinc/96/42/89/644964289.db2.gz KAARGJPGLJEJPC-CQSZACIVSA-N 0 3 287.411 2.501 20 10 CFCDHN C[C@]1(C[NH2+]Cc2ccccc2[O-])OCCc2ccccc21 ZINC000883340126 645750304 /nfs/dbraw/zinc/75/03/04/645750304.db2.gz KHYUHNQEASOFOC-GOSISDBHSA-N 0 3 283.371 2.970 20 10 CFCDHN CCN1CCC([N@H+](C)Cc2cc(Cl)ccc2[O-])CC1 ZINC000131564574 645753616 /nfs/dbraw/zinc/75/36/16/645753616.db2.gz BQLHZIPKBQQDFY-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN CCN1CCC([N@@H+](C)Cc2cc(Cl)ccc2[O-])CC1 ZINC000131564574 645753621 /nfs/dbraw/zinc/75/36/21/645753621.db2.gz BQLHZIPKBQQDFY-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN CC[C@@H]([NH2+]CCC(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733756 646596431 /nfs/dbraw/zinc/59/64/31/646596431.db2.gz IALUIGUBYRUGAT-CYBMUJFWSA-N 0 3 278.396 2.738 20 10 CFCDHN C[C@@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCCO1 ZINC000927018205 648684048 /nfs/dbraw/zinc/68/40/48/648684048.db2.gz KXGWQASOVMVZBT-BBRMVZONSA-N 0 3 261.365 2.928 20 10 CFCDHN COC[C@H](C[NH2+][C@H](C)c1ccccc1[O-])C(C)C ZINC000927096812 648710037 /nfs/dbraw/zinc/71/00/37/648710037.db2.gz HSAXZGWPNXRBIP-OLZOCXBDSA-N 0 3 251.370 2.961 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@H]1C[N@H+](C)Cc1ccccc1[O-] ZINC000929977835 649159614 /nfs/dbraw/zinc/15/96/14/649159614.db2.gz XCEOIJCOHBVMRO-DZGCQCFKSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1[O-] ZINC000929977835 649159615 /nfs/dbraw/zinc/15/96/15/649159615.db2.gz XCEOIJCOHBVMRO-DZGCQCFKSA-N 0 3 291.391 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C2(CO)CCCC2)c1[O-] ZINC000305855469 651085913 /nfs/dbraw/zinc/08/59/13/651085913.db2.gz VXSZXEPBKFHBNT-UHFFFAOYSA-N 0 3 269.772 2.749 20 10 CFCDHN CCN1CCN(c2ccc(CN(C)CC(F)F)cc2)CC1 ZINC001140306657 770501301 /nfs/dbraw/zinc/50/13/01/770501301.db2.gz VHVGXOQYMDTBPJ-UHFFFAOYSA-N 0 3 297.393 2.525 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC001207166915 770542498 /nfs/dbraw/zinc/54/24/98/770542498.db2.gz GGDUBEMNXOYUSZ-OLZOCXBDSA-N 0 3 293.432 2.894 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC001207166915 770542501 /nfs/dbraw/zinc/54/25/01/770542501.db2.gz GGDUBEMNXOYUSZ-OLZOCXBDSA-N 0 3 293.432 2.894 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CC1)[C@H]1CCCOC1 ZINC000723977263 770730546 /nfs/dbraw/zinc/73/05/46/770730546.db2.gz KIKUWHSLYRWQQK-HOCLYGCPSA-N 0 3 261.365 2.687 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@]13C[C@@H]1CCCC3)OCO2 ZINC000693521769 770768516 /nfs/dbraw/zinc/76/85/16/770768516.db2.gz KNTGOLBGRQOROK-BLLLJJGKSA-N 0 3 275.348 2.791 20 10 CFCDHN C[C@H]1CCN(Cc2ccc(N(C)C)cc2Cl)CC[C@@H]1O ZINC001140921482 775650531 /nfs/dbraw/zinc/65/05/31/775650531.db2.gz FIYCRXPSCWPNJA-LRDDRELGSA-N 0 3 296.842 2.999 20 10 CFCDHN CC[N@H+](Cc1c([O-])ccc2ccccc21)C1CN(C)C1 ZINC001231589568 777268430 /nfs/dbraw/zinc/26/84/30/777268430.db2.gz LAKVXJBTMKLJCJ-UHFFFAOYSA-N 0 3 270.376 2.681 20 10 CFCDHN CC[N@@H+](Cc1c([O-])ccc2ccccc21)C1CN(C)C1 ZINC001231589568 777268435 /nfs/dbraw/zinc/26/84/35/777268435.db2.gz LAKVXJBTMKLJCJ-UHFFFAOYSA-N 0 3 270.376 2.681 20 10 CFCDHN CN(Cc1cncnc1)Cc1c(O)ccc2ccccc21 ZINC001231589886 777269906 /nfs/dbraw/zinc/26/99/06/777269906.db2.gz TYJJWIZLQQAEFK-UHFFFAOYSA-N 0 3 279.343 2.967 20 10 CFCDHN Cn1ncc2c1CC[N@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231590449 777271255 /nfs/dbraw/zinc/27/12/55/777271255.db2.gz BBROBYRGSCLLLJ-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1ncc2c1CC[N@@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231590449 777271263 /nfs/dbraw/zinc/27/12/63/777271263.db2.gz BBROBYRGSCLLLJ-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN CC(=O)N1CC[N@H+](Cc2c([O-])ccc3ccccc32)[C@@H](C)C1 ZINC001231591212 777271783 /nfs/dbraw/zinc/27/17/83/777271783.db2.gz YPOLUNBWVPODPE-ZDUSSCGKSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N1CC[N@@H+](Cc2c([O-])ccc3ccccc32)[C@@H](C)C1 ZINC001231591212 777271790 /nfs/dbraw/zinc/27/17/90/777271790.db2.gz YPOLUNBWVPODPE-ZDUSSCGKSA-N 0 3 298.386 2.598 20 10 CFCDHN COc1cc(CN2C[C@H]3CC[C@@H](C2)C3(F)F)c(O)cc1O ZINC001231633555 777286474 /nfs/dbraw/zinc/28/64/74/777286474.db2.gz OZMGKPUPBMPNCX-PHIMTYICSA-N 0 3 299.317 2.584 20 10 CFCDHN COc1cc(CN2CCC[C@H](C(F)F)C2)c(O)cc1O ZINC001231635728 777286546 /nfs/dbraw/zinc/28/65/46/777286546.db2.gz JABJYGXEMKKFDK-VIFPVBQESA-N 0 3 287.306 2.584 20 10 CFCDHN CCN(Cc1cccnc1)Cc1cc(OC)c(O)cc1O ZINC001231636380 777287360 /nfs/dbraw/zinc/28/73/60/777287360.db2.gz UDTHAOVAGNGALR-UHFFFAOYSA-N 0 3 288.347 2.524 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@@]2(CCCO2)C1 ZINC001231852415 777352080 /nfs/dbraw/zinc/35/20/80/777352080.db2.gz UPJPNIYNDRQNCN-KRWDZBQOSA-N 0 3 290.407 2.516 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@H](OC(C)C)C1 ZINC001231854775 777352641 /nfs/dbraw/zinc/35/26/41/777352641.db2.gz LWYDQTDXNHWWCV-INIZCTEOSA-N 0 3 292.423 2.761 20 10 CFCDHN CC[NH+]1C[C@@H]2CN(Cc3cc(Cl)c(C)cc3[O-])C[C@H]2C1 ZINC001231870914 777360054 /nfs/dbraw/zinc/36/00/54/777360054.db2.gz DGVAOPHWJVNCGW-ZIAGYGMSSA-N 0 3 294.826 2.738 20 10 CFCDHN COc1cc([O-])c(CN2CCC[C@H]2C[NH+](C)C)cc1Cl ZINC001232270223 777501113 /nfs/dbraw/zinc/50/11/13/777501113.db2.gz YWIIIGAWVMEIGS-LBPRGKRZSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1ccc(CN(C)Cc2ccccc2O)c(C)n1 ZINC001232336511 777526063 /nfs/dbraw/zinc/52/60/63/777526063.db2.gz QJCOCGYDYROBIO-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN CN(C)c1ccc(CN2CCOc3ccccc3C2)c(O)c1 ZINC001232839856 777688721 /nfs/dbraw/zinc/68/87/21/777688721.db2.gz XYKRQAMQGYMLBT-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CC(C)([NH3+])C2)cc1Cl ZINC001205000598 777728128 /nfs/dbraw/zinc/72/81/28/777728128.db2.gz GWUWWEDSRZDTRR-UHFFFAOYSA-N 0 3 282.815 2.876 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](O)CC2)c1[O-] ZINC001233287768 777868641 /nfs/dbraw/zinc/86/86/41/777868641.db2.gz GWKDQEORFQYKHM-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](O)CC2)c1[O-] ZINC001233287768 777868649 /nfs/dbraw/zinc/86/86/49/777868649.db2.gz GWKDQEORFQYKHM-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](O)[C@@H](C)C2)c1[O-] ZINC001233288081 777870911 /nfs/dbraw/zinc/87/09/11/777870911.db2.gz VASHECYYYGQRBY-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c1[O-] ZINC001233288081 777870920 /nfs/dbraw/zinc/87/09/20/777870920.db2.gz VASHECYYYGQRBY-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN CCc1ccc(CN(C)Cc2cc(O)c(O)cc2O)cc1 ZINC001233486678 777963173 /nfs/dbraw/zinc/96/31/73/777963173.db2.gz XODVHCADLQTMTC-UHFFFAOYSA-N 0 3 287.359 2.998 20 10 CFCDHN CC[C@H](COc1ccc(N2CCN(CC)CC2)cc1)OC ZINC001234661228 778282332 /nfs/dbraw/zinc/28/23/32/778282332.db2.gz SCNUVNZSMRLVOB-MRXNPFEDSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CCCC[C@@]12CC[NH2+]C2 ZINC001235118006 778389159 /nfs/dbraw/zinc/38/91/59/778389159.db2.gz CTGTZXCEFXRVMI-HNNXBMFYSA-N 0 3 280.799 2.764 20 10 CFCDHN C[N@H+](CCOC(C)(C)C)Cc1cc(F)ccc1[O-] ZINC000690116439 778495953 /nfs/dbraw/zinc/49/59/53/778495953.db2.gz WPHKNOODWILYIW-UHFFFAOYSA-N 0 3 255.333 2.778 20 10 CFCDHN C[N@@H+](CCOC(C)(C)C)Cc1cc(F)ccc1[O-] ZINC000690116439 778495956 /nfs/dbraw/zinc/49/59/56/778495956.db2.gz WPHKNOODWILYIW-UHFFFAOYSA-N 0 3 255.333 2.778 20 10 CFCDHN CC(C)(C)c1ccc(C[NH+]2CCC(CO)CC2)c([O-])c1 ZINC001235682221 778536181 /nfs/dbraw/zinc/53/61/81/778536181.db2.gz POAWRFRXTFKUAG-UHFFFAOYSA-N 0 3 277.408 2.894 20 10 CFCDHN CCCN(Cc1cc(Cl)c(C)cc1[O-])[C@H]1CC[NH2+]C1 ZINC001236324019 778781603 /nfs/dbraw/zinc/78/16/03/778781603.db2.gz NAQDRZABIIJTMB-ZDUSSCGKSA-N 0 3 282.815 2.928 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@H]2COC)c([O-])c1 ZINC001236783654 778934824 /nfs/dbraw/zinc/93/48/24/778934824.db2.gz NVIBBRHAMBDZRY-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@H]2COC)c([O-])c1 ZINC001236783654 778934827 /nfs/dbraw/zinc/93/48/27/778934827.db2.gz NVIBBRHAMBDZRY-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)C2CCN(C)CC2)c([O-])c1 ZINC001236785792 778935262 /nfs/dbraw/zinc/93/52/62/778935262.db2.gz ABGJKQRRZQXESA-UHFFFAOYSA-N 0 3 276.424 2.871 20 10 CFCDHN CCc1ccc(C[N@H+](CC)C2CCN(C)CC2)c([O-])c1 ZINC001236785792 778935268 /nfs/dbraw/zinc/93/52/68/778935268.db2.gz ABGJKQRRZQXESA-UHFFFAOYSA-N 0 3 276.424 2.871 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001236786346 778935646 /nfs/dbraw/zinc/93/56/46/778935646.db2.gz OBVZEDMYWAPMGY-YLQAJVPDSA-N 0 3 275.392 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001236786346 778935651 /nfs/dbraw/zinc/93/56/51/778935651.db2.gz OBVZEDMYWAPMGY-YLQAJVPDSA-N 0 3 275.392 2.954 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C(=O)OC)[C@@H]2C)c([O-])c1 ZINC001236794243 778938852 /nfs/dbraw/zinc/93/88/52/778938852.db2.gz JYTIBKYEILUETG-WFASDCNBSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C(=O)OC)[C@@H]2C)c([O-])c1 ZINC001236794243 778938858 /nfs/dbraw/zinc/93/88/58/778938858.db2.gz JYTIBKYEILUETG-WFASDCNBSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3OCC[C@H]3C2)c([O-])c1 ZINC001236792827 778939920 /nfs/dbraw/zinc/93/99/20/778939920.db2.gz RUIIFCPSLBYQKD-HOCLYGCPSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3OCC[C@H]3C2)c([O-])c1 ZINC001236792827 778939922 /nfs/dbraw/zinc/93/99/22/778939922.db2.gz RUIIFCPSLBYQKD-HOCLYGCPSA-N 0 3 261.365 2.565 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@@H]1CO ZINC001236826465 778954752 /nfs/dbraw/zinc/95/47/52/778954752.db2.gz KFQLXLAAYZTGSJ-OAHLLOKOSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]1CO ZINC001236826465 778954755 /nfs/dbraw/zinc/95/47/55/778954755.db2.gz KFQLXLAAYZTGSJ-OAHLLOKOSA-N 0 3 257.333 2.502 20 10 CFCDHN Oc1cc2ccccc2cc1CN1CCN(CCF)CC1 ZINC001236834050 778959276 /nfs/dbraw/zinc/95/92/76/778959276.db2.gz SQOIQEQKZORAHT-UHFFFAOYSA-N 0 3 288.366 2.633 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001237040461 778996110 /nfs/dbraw/zinc/99/61/10/778996110.db2.gz DFTRUCIEJLVISL-YOEHRIQHSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001237040461 778996114 /nfs/dbraw/zinc/99/61/14/778996114.db2.gz DFTRUCIEJLVISL-YOEHRIQHSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+](CCOC)C(C)C)c([O-])c1 ZINC001237041120 778996244 /nfs/dbraw/zinc/99/62/44/778996244.db2.gz FHWBJRABLAIKPF-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCOC)C(C)C)c([O-])c1 ZINC001237041120 778996247 /nfs/dbraw/zinc/99/62/47/778996247.db2.gz FHWBJRABLAIKPF-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC001237044607 778997458 /nfs/dbraw/zinc/99/74/58/778997458.db2.gz QBPDGRVILPQHKC-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC001237044607 778997463 /nfs/dbraw/zinc/99/74/63/778997463.db2.gz QBPDGRVILPQHKC-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2[C@@H](C)CC[C@H]2CO)c([O-])c1 ZINC001237046246 778998227 /nfs/dbraw/zinc/99/82/27/778998227.db2.gz RZRUZCKOCNLEBN-WFASDCNBSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2[C@@H](C)CC[C@H]2CO)c([O-])c1 ZINC001237046246 778998232 /nfs/dbraw/zinc/99/82/32/778998232.db2.gz RZRUZCKOCNLEBN-WFASDCNBSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](C)C2)c([O-])c1 ZINC001237046090 778999291 /nfs/dbraw/zinc/99/92/91/778999291.db2.gz PHMWLHAIDYGRMU-SWLSCSKDSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)c([O-])c1 ZINC001237046090 778999293 /nfs/dbraw/zinc/99/92/93/778999293.db2.gz PHMWLHAIDYGRMU-SWLSCSKDSA-N 0 3 263.381 2.718 20 10 CFCDHN CCOc1ccc(CN2C[C@@H](C)[C@@H](F)C2)c(O)c1 ZINC001237049518 779001131 /nfs/dbraw/zinc/00/11/31/779001131.db2.gz HFKXVYFZEXDDMH-MFKMUULPSA-N 0 3 253.317 2.581 20 10 CFCDHN Cc1cccc(O)c1CN1CC[C@@](C)(F)[C@H](F)C1 ZINC001237484295 779118305 /nfs/dbraw/zinc/11/83/05/779118305.db2.gz ASDMTCVOIRQRGG-ZIAGYGMSSA-N 0 3 255.308 2.973 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC001237490539 779118933 /nfs/dbraw/zinc/11/89/33/779118933.db2.gz WAVPFLPVXBVSMM-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC001237490539 779118935 /nfs/dbraw/zinc/11/89/35/779118935.db2.gz WAVPFLPVXBVSMM-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN C[N@H+](Cc1ccn2nccc2c1)Cc1ccccc1[O-] ZINC001237541834 779129526 /nfs/dbraw/zinc/12/95/26/779129526.db2.gz GTFDFENPUDIHPR-UHFFFAOYSA-N 0 3 267.332 2.672 20 10 CFCDHN C[N@@H+](Cc1ccn2nccc2c1)Cc1ccccc1[O-] ZINC001237541834 779129532 /nfs/dbraw/zinc/12/95/32/779129532.db2.gz GTFDFENPUDIHPR-UHFFFAOYSA-N 0 3 267.332 2.672 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@@H]2CO)c1[O-] ZINC001237682081 779161079 /nfs/dbraw/zinc/16/10/79/779161079.db2.gz XNWMQZXIMOWGLC-HZMBPMFUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c1[O-] ZINC001237682081 779161084 /nfs/dbraw/zinc/16/10/84/779161084.db2.gz XNWMQZXIMOWGLC-HZMBPMFUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)C[C@H]2C)c1[O-] ZINC001237685112 779161132 /nfs/dbraw/zinc/16/11/32/779161132.db2.gz FBAPLRKQFVUODX-ZWNOBZJWSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)C[C@H]2C)c1[O-] ZINC001237685112 779161136 /nfs/dbraw/zinc/16/11/36/779161136.db2.gz FBAPLRKQFVUODX-ZWNOBZJWSA-N 0 3 269.772 2.699 20 10 CFCDHN Oc1cccc2c1CN(Cc1cccc3c1OCC3)CC2 ZINC001237754961 779175948 /nfs/dbraw/zinc/17/59/48/779175948.db2.gz OETGZSRANZBFNA-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1cccc3c1OCC3)CC2 ZINC001237754961 779175951 /nfs/dbraw/zinc/17/59/51/779175951.db2.gz OETGZSRANZBFNA-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1cccc3c1OCC3)CC2 ZINC001237754961 779175954 /nfs/dbraw/zinc/17/59/54/779175954.db2.gz OETGZSRANZBFNA-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c1[O-] ZINC001238057817 779241271 /nfs/dbraw/zinc/24/12/71/779241271.db2.gz NVDKBYAEKBCRBO-WBMJQRKESA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c1[O-] ZINC001238057817 779241273 /nfs/dbraw/zinc/24/12/73/779241273.db2.gz NVDKBYAEKBCRBO-WBMJQRKESA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC001238055781 779241500 /nfs/dbraw/zinc/24/15/00/779241500.db2.gz DFSPKWMXGHESPX-WFASDCNBSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC001238055781 779241506 /nfs/dbraw/zinc/24/15/06/779241506.db2.gz DFSPKWMXGHESPX-WFASDCNBSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001238059446 779242480 /nfs/dbraw/zinc/24/24/80/779242480.db2.gz CUCNUNKKMZOPIR-WBMJQRKESA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001238059446 779242485 /nfs/dbraw/zinc/24/24/85/779242485.db2.gz CUCNUNKKMZOPIR-WBMJQRKESA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2C(C)(C)O)c1[O-] ZINC001238066078 779244059 /nfs/dbraw/zinc/24/40/59/779244059.db2.gz DXRPSLCKBCAEEP-CYBMUJFWSA-N 0 3 267.344 2.575 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c1[O-] ZINC001238066078 779244062 /nfs/dbraw/zinc/24/40/62/779244062.db2.gz DXRPSLCKBCAEEP-CYBMUJFWSA-N 0 3 267.344 2.575 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@]23CCOC3)c1[O-] ZINC001238071388 779246985 /nfs/dbraw/zinc/24/69/85/779246985.db2.gz WKMGFVHSNMWXFK-HNNXBMFYSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@]23CCOC3)c1[O-] ZINC001238071388 779246987 /nfs/dbraw/zinc/24/69/87/779246987.db2.gz WKMGFVHSNMWXFK-HNNXBMFYSA-N 0 3 265.328 2.595 20 10 CFCDHN COC(=O)[C@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@@H]1C ZINC001238071425 779247086 /nfs/dbraw/zinc/24/70/86/779247086.db2.gz XGBDOKDVUOTCAS-RISCZKNCSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@@H]1C ZINC001238071425 779247089 /nfs/dbraw/zinc/24/70/89/779247089.db2.gz XGBDOKDVUOTCAS-RISCZKNCSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@H]1C ZINC001238071424 779247212 /nfs/dbraw/zinc/24/72/12/779247212.db2.gz XGBDOKDVUOTCAS-FZMZJTMJSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@H]1C ZINC001238071424 779247213 /nfs/dbraw/zinc/24/72/13/779247213.db2.gz XGBDOKDVUOTCAS-FZMZJTMJSA-N 0 3 295.354 2.613 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])cc1 ZINC000386568446 779930985 /nfs/dbraw/zinc/93/09/85/779930985.db2.gz PHKNJDAJKRTLFU-CYBMUJFWSA-N 0 3 298.386 2.911 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CO[C@H](C3CC3)C1)CC2 ZINC000700989359 780745623 /nfs/dbraw/zinc/74/56/23/780745623.db2.gz DLBBCGIKTRWDRQ-GUTXKFCHSA-N 0 3 259.349 2.537 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000703109216 780986623 /nfs/dbraw/zinc/98/66/23/780986623.db2.gz ZCTZSTRGBXCYJT-WDEREUQCSA-N 0 3 267.344 2.997 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000709849466 781319960 /nfs/dbraw/zinc/31/99/60/781319960.db2.gz KPIOBSNKUAIWJD-OAHLLOKOSA-N 0 3 280.799 2.621 20 10 CFCDHN CC(C)(C)N1CC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000822133896 781894159 /nfs/dbraw/zinc/89/41/59/781894159.db2.gz WUHYJVIPVOWQKB-UONOGXRCSA-N 0 3 274.408 2.842 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])C(C)(C)O ZINC000295001367 199294355 /nfs/dbraw/zinc/29/43/55/199294355.db2.gz MAOQJBXQQKVQKI-RISCZKNCSA-N 0 3 251.370 2.901 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)CC(C)(C)O)c([O-])c1 ZINC000295069893 199329867 /nfs/dbraw/zinc/32/98/67/199329867.db2.gz PEKXMQQDIRKBSE-LBPRGKRZSA-N 0 3 281.396 2.820 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C(C)(C)O ZINC000295106687 199348460 /nfs/dbraw/zinc/34/84/60/199348460.db2.gz WTXPCDNARQWXES-FZMZJTMJSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@@H](C)CCO)c1[O-] ZINC000295122763 199356622 /nfs/dbraw/zinc/35/66/22/199356622.db2.gz NLTPCFVQOTTXBA-SNVBAGLBSA-N 0 3 271.788 2.852 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H](CO)c1ccccc1 ZINC000295140817 199368431 /nfs/dbraw/zinc/36/84/31/199368431.db2.gz ZOCSFNGORQTWGW-HNNXBMFYSA-N 0 3 257.333 2.558 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H](CO)c1ccccc1 ZINC000295140817 199368432 /nfs/dbraw/zinc/36/84/32/199368432.db2.gz ZOCSFNGORQTWGW-HNNXBMFYSA-N 0 3 257.333 2.558 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1C ZINC000083113674 347448001 /nfs/dbraw/zinc/44/80/01/347448001.db2.gz WXSHIJYURAHZOB-OAHLLOKOSA-N 0 3 299.418 2.807 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1C ZINC000083113674 347448003 /nfs/dbraw/zinc/44/80/03/347448003.db2.gz WXSHIJYURAHZOB-OAHLLOKOSA-N 0 3 299.418 2.807 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCc3ccccc3[C@@H]2CO)c1 ZINC000093455600 347674788 /nfs/dbraw/zinc/67/47/88/347674788.db2.gz TUJYRQJCSOKAMC-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCc3ccccc3[C@@H]2CO)c1 ZINC000093455600 347674793 /nfs/dbraw/zinc/67/47/93/347674793.db2.gz TUJYRQJCSOKAMC-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1ccc(O)c(CN2CCc3ccccc3[C@@H]2CO)c1 ZINC000093455600 347674797 /nfs/dbraw/zinc/67/47/97/347674797.db2.gz TUJYRQJCSOKAMC-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H](Oc3ccncc3)C2)cc1 ZINC000093865664 347686311 /nfs/dbraw/zinc/68/63/11/347686311.db2.gz YSSUDPHBEABXDA-GOSISDBHSA-N 0 3 297.402 2.801 20 10 CFCDHN CCOc1cccc(CN[C@H](C)c2cnn(CC)c2)c1O ZINC000294776950 199177280 /nfs/dbraw/zinc/17/72/80/199177280.db2.gz GKMNTRVAUMKYAT-GFCCVEGCSA-N 0 3 289.379 2.858 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@H](C)CCO)c([O-])c1 ZINC000297296190 200138782 /nfs/dbraw/zinc/13/87/82/200138782.db2.gz MBUAEMDTWHKCPI-AAEUAGOBSA-N 0 3 251.370 2.760 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000019960339 372216197 /nfs/dbraw/zinc/21/61/97/372216197.db2.gz IFEKNVZZPZUSNS-STQMWFEESA-N 0 3 278.396 2.536 20 10 CFCDHN CCN(CC)CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000020089756 372227833 /nfs/dbraw/zinc/22/78/33/372227833.db2.gz VFZXNPSDSFKTDA-CYBMUJFWSA-N 0 3 250.386 2.693 20 10 CFCDHN COCc1cccc(CNCc2cccc(OC)c2O)c1 ZINC000038010540 372763983 /nfs/dbraw/zinc/76/39/83/372763983.db2.gz SSGMCXMHJDIKJH-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COCc1cccc(C[NH2+]Cc2cccc(OC)c2[O-])c1 ZINC000038010540 372763989 /nfs/dbraw/zinc/76/39/89/372763989.db2.gz SSGMCXMHJDIKJH-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COc1ccc(CNCc2ccc(O)cc2)cc1C ZINC000083421819 374744973 /nfs/dbraw/zinc/74/49/73/374744973.db2.gz JFLQJNWLEGCVQE-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C2Cc3ccccc3C2)c1 ZINC000083396431 374742253 /nfs/dbraw/zinc/74/22/53/374742253.db2.gz PFIBNXQCHWEDTG-UHFFFAOYSA-N 0 3 253.345 2.958 20 10 CFCDHN CC[C@H](CSC)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000091024909 375038297 /nfs/dbraw/zinc/03/82/97/375038297.db2.gz CHGURMZNULZTCY-LLVKDONJSA-N 0 3 283.393 2.694 20 10 CFCDHN CC[C@H](CSC)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000091024909 375038301 /nfs/dbraw/zinc/03/83/01/375038301.db2.gz CHGURMZNULZTCY-LLVKDONJSA-N 0 3 283.393 2.694 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H](n3cccn3)C2)cc1 ZINC000092966922 375169426 /nfs/dbraw/zinc/16/94/26/375169426.db2.gz GQBMHCUUPDFRLB-QGZVFWFLSA-N 0 3 284.407 2.786 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@](C)(O)c1ccccc1 ZINC000111235954 375836621 /nfs/dbraw/zinc/83/66/21/375836621.db2.gz JRRDNLRGLZVXRN-KRWDZBQOSA-N 0 3 271.360 2.732 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@](C)(O)c1ccccc1 ZINC000111235954 375836626 /nfs/dbraw/zinc/83/66/26/375836626.db2.gz JRRDNLRGLZVXRN-KRWDZBQOSA-N 0 3 271.360 2.732 20 10 CFCDHN Cc1cccc(C[NH2+]CCN(C)C2CCCC2)c1[O-] ZINC000124799215 377090139 /nfs/dbraw/zinc/09/01/39/377090139.db2.gz RZHYCFHNESWJFP-UHFFFAOYSA-N 0 3 262.397 2.665 20 10 CFCDHN COc1cccc(C[NH2+]C[C@]2(C)CCCS2)c1[O-] ZINC000126491786 377230596 /nfs/dbraw/zinc/23/05/96/377230596.db2.gz QDCGTTVZKHGIBF-AWEZNQCLSA-N 0 3 267.394 2.776 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1cccc(OCC)c1[O-] ZINC000126878934 377251072 /nfs/dbraw/zinc/25/10/72/377251072.db2.gz TXESWRCSLSPTSA-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1cccc(OCC)c1[O-] ZINC000126878934 377251075 /nfs/dbraw/zinc/25/10/75/377251075.db2.gz TXESWRCSLSPTSA-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN COc1cccc(C[N@H+](C)CCC2CCOCC2)c1[O-] ZINC000129672214 377458902 /nfs/dbraw/zinc/45/89/02/377458902.db2.gz ODKWNKFJKVBDRJ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCC2CCOCC2)c1[O-] ZINC000129672214 377458907 /nfs/dbraw/zinc/45/89/07/377458907.db2.gz ODKWNKFJKVBDRJ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1ccc(O)c(CN2CCS[C@H](C)[C@H]2C)c1 ZINC000180311503 295165973 /nfs/dbraw/zinc/16/59/73/295165973.db2.gz JPJANEHGGDQLAO-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@H](C)[C@H]2C)c1 ZINC000180311503 295165975 /nfs/dbraw/zinc/16/59/75/295165975.db2.gz JPJANEHGGDQLAO-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@H](C)[C@H]2C)c1 ZINC000180311503 295165976 /nfs/dbraw/zinc/16/59/76/295165976.db2.gz JPJANEHGGDQLAO-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@]2(CCSC2)C1 ZINC000133999736 377975377 /nfs/dbraw/zinc/97/53/77/377975377.db2.gz JVZOJUPKLUVYPO-UKRRQHHQSA-N 0 3 279.405 2.537 20 10 CFCDHN C[C@](O)(CNCc1ccc2c(c1)CCO2)c1cccs1 ZINC000153021177 378466562 /nfs/dbraw/zinc/46/65/62/378466562.db2.gz KNPVUFVYRJDIHA-INIZCTEOSA-N 0 3 289.400 2.680 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)c([O-])c1 ZINC000529558896 383729364 /nfs/dbraw/zinc/72/93/64/383729364.db2.gz UPIZHNWLGGTDPW-ONERCXAPSA-N 0 3 261.365 2.925 20 10 CFCDHN [O-]c1ccccc1CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000179566246 380558443 /nfs/dbraw/zinc/55/84/43/380558443.db2.gz ABZPMIZPKCFKPL-UHFFFAOYSA-N 0 3 274.408 2.843 20 10 CFCDHN [O-]c1ccccc1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000179566246 380558448 /nfs/dbraw/zinc/55/84/48/380558448.db2.gz ABZPMIZPKCFKPL-UHFFFAOYSA-N 0 3 274.408 2.843 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000179587027 380560516 /nfs/dbraw/zinc/56/05/16/380560516.db2.gz DCSMWMGYDVSDDP-PBHICJAKSA-N 0 3 286.419 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000179587027 380560521 /nfs/dbraw/zinc/56/05/21/380560521.db2.gz DCSMWMGYDVSDDP-PBHICJAKSA-N 0 3 286.419 2.841 20 10 CFCDHN CCN1CC[C@H]([N@H+](C)Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000180194761 380631484 /nfs/dbraw/zinc/63/14/84/380631484.db2.gz QDLGQPDIELSQJY-DOMZBBRYSA-N 0 3 280.387 2.693 20 10 CFCDHN CCN1CC[C@H]([N@@H+](C)Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000180194761 380631488 /nfs/dbraw/zinc/63/14/88/380631488.db2.gz QDLGQPDIELSQJY-DOMZBBRYSA-N 0 3 280.387 2.693 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000179902991 380595490 /nfs/dbraw/zinc/59/54/90/380595490.db2.gz KTEVSFPBNSKMRT-YVEFUNNKSA-N 0 3 287.359 2.785 20 10 CFCDHN CC[N@@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCO1 ZINC000179975052 380605440 /nfs/dbraw/zinc/60/54/40/380605440.db2.gz MTHIYOSPCQVTIL-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[N@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCO1 ZINC000179975052 380605444 /nfs/dbraw/zinc/60/54/44/380605444.db2.gz MTHIYOSPCQVTIL-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(C)c1[O-] ZINC000180697249 380691436 /nfs/dbraw/zinc/69/14/36/380691436.db2.gz KKYSYNQLZXVBRV-CVEARBPZSA-N 0 3 274.408 2.759 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C)c1[O-] ZINC000180697249 380691443 /nfs/dbraw/zinc/69/14/43/380691443.db2.gz KKYSYNQLZXVBRV-CVEARBPZSA-N 0 3 274.408 2.759 20 10 CFCDHN C[C@@](CO)([NH2+]Cc1cc(F)ccc1[O-])C1CCCCC1 ZINC000180770611 380697383 /nfs/dbraw/zinc/69/73/83/380697383.db2.gz NYYHIKGBDWFLEG-INIZCTEOSA-N 0 3 281.371 2.952 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccsc1 ZINC000180774725 380697445 /nfs/dbraw/zinc/69/74/45/380697445.db2.gz PAADLFWSIOQNGC-CQSZACIVSA-N 0 3 281.352 2.590 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000180866362 380708472 /nfs/dbraw/zinc/70/84/72/380708472.db2.gz YTDRRHHOMGTBSC-GHMZBOCLSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000180866362 380708476 /nfs/dbraw/zinc/70/84/76/380708476.db2.gz YTDRRHHOMGTBSC-GHMZBOCLSA-N 0 3 269.772 2.557 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1[O-] ZINC000403520363 380895189 /nfs/dbraw/zinc/89/51/89/380895189.db2.gz KYEFIIBLNAKORQ-BZPMIXESSA-N 0 3 261.365 2.927 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)[C@H](O)c2ccccc2)c1 ZINC000288614728 381018247 /nfs/dbraw/zinc/01/82/47/381018247.db2.gz QXZQIQPGCDRVCQ-DYVFJYSZSA-N 0 3 271.360 2.912 20 10 CFCDHN COCCCCC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000182322936 381061777 /nfs/dbraw/zinc/06/17/77/381061777.db2.gz OMHBBYUEQZTPDP-LBPRGKRZSA-N 0 3 267.369 2.868 20 10 CFCDHN COCCC1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000295811288 381090722 /nfs/dbraw/zinc/09/07/22/381090722.db2.gz AATGIDRQABRMCR-CYBMUJFWSA-N 0 3 261.365 2.786 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)c1[O-] ZINC000182635499 381123695 /nfs/dbraw/zinc/12/36/95/381123695.db2.gz YIQLIVRKBFFJDU-GDBMZVCRSA-N 0 3 293.432 2.845 20 10 CFCDHN C[C@@H]1CCCCN1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295920648 381159063 /nfs/dbraw/zinc/15/90/63/381159063.db2.gz JSQWAVRBCVQCNL-HIFRSBDPSA-N 0 3 274.408 2.844 20 10 CFCDHN C[C@H]1CCCCN1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295920653 381160122 /nfs/dbraw/zinc/16/01/22/381160122.db2.gz JSQWAVRBCVQCNL-ZFWWWQNUSA-N 0 3 274.408 2.844 20 10 CFCDHN CN(C)CC(C)(C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295933671 381165285 /nfs/dbraw/zinc/16/52/85/381165285.db2.gz KNORESVRSQRWHF-CYBMUJFWSA-N 0 3 262.397 2.557 20 10 CFCDHN CCCN1CC[C@@H](C[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000295976982 381195396 /nfs/dbraw/zinc/19/53/96/381195396.db2.gz MZCTZPYKPVXYLY-ZFWWWQNUSA-N 0 3 274.408 2.701 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(O)CCc2ccccc21)c1ccccc1[O-] ZINC000183628113 381296826 /nfs/dbraw/zinc/29/68/26/381296826.db2.gz HGUMBAOKUXDWMZ-UGSOOPFHSA-N 0 3 283.371 2.877 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@@H](C)c2ccncc2)c1 ZINC000183712010 381309607 /nfs/dbraw/zinc/30/96/07/381309607.db2.gz DOXJOHICLQAUPC-LBPRGKRZSA-N 0 3 272.348 2.989 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)CCc2ccncc2)c1 ZINC000183757719 381315736 /nfs/dbraw/zinc/31/57/36/381315736.db2.gz JSEDNZWHKNODQP-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)CCc2ccncc2)c1 ZINC000183757719 381315739 /nfs/dbraw/zinc/31/57/39/381315739.db2.gz JSEDNZWHKNODQP-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CCCO)c([O-])c1 ZINC000296440748 381397918 /nfs/dbraw/zinc/39/79/18/381397918.db2.gz MGZKXJCQKZLYML-QWHCGFSZSA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@H](CCCCO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000296637965 381484199 /nfs/dbraw/zinc/48/41/99/381484199.db2.gz XXDCBGODYNVJQJ-GHMZBOCLSA-N 0 3 255.333 2.733 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1nccs1)CC2 ZINC000297913855 381575521 /nfs/dbraw/zinc/57/55/21/381575521.db2.gz WTFURVLTVYQGIO-NSHDSACASA-N 0 3 260.362 2.668 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCNC(=O)OC(C)(C)C)c([O-])c1 ZINC000185267287 381582842 /nfs/dbraw/zinc/58/28/42/381582842.db2.gz DTNFEESMUURBQU-LBPRGKRZSA-N 0 3 294.395 2.876 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCNC(=O)c2ccccc2)c([O-])c1 ZINC000185203366 381562723 /nfs/dbraw/zinc/56/27/23/381562723.db2.gz UASGCFLHLMADBM-CQSZACIVSA-N 0 3 298.386 2.781 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185316428 381595234 /nfs/dbraw/zinc/59/52/34/381595234.db2.gz SIJYPQDSJMCAIZ-STQMWFEESA-N 0 3 280.412 2.782 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)c2ccsc2)c1 ZINC000185513103 381655134 /nfs/dbraw/zinc/65/51/34/381655134.db2.gz QCDBCZYDQOARPR-BONVTDFDSA-N 0 3 293.388 2.847 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)c2ccsc2)c1 ZINC000185513123 381655238 /nfs/dbraw/zinc/65/52/38/381655238.db2.gz QCDBCZYDQOARPR-BMIGLBTASA-N 0 3 293.388 2.847 20 10 CFCDHN CN(C)c1ccc(CN2CCC(c3ccncn3)CC2)cc1 ZINC000298536926 381666062 /nfs/dbraw/zinc/66/60/62/381666062.db2.gz WZYNNGNYRIZQGB-UHFFFAOYSA-N 0 3 296.418 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCC[C@H]1Cn1cccn1 ZINC000371533853 381652460 /nfs/dbraw/zinc/65/24/60/381652460.db2.gz KEGKASWHGPHGBJ-HNNXBMFYSA-N 0 3 289.354 2.783 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCC[C@H]1Cn1cccn1 ZINC000371533853 381652462 /nfs/dbraw/zinc/65/24/62/381652462.db2.gz KEGKASWHGPHGBJ-HNNXBMFYSA-N 0 3 289.354 2.783 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CO[C@@H]2CCOC2)c1 ZINC000185673148 381701105 /nfs/dbraw/zinc/70/11/05/381701105.db2.gz DFLXCRARZAXSIW-MGPQQGTHSA-N 0 3 279.380 2.545 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000186505163 381930515 /nfs/dbraw/zinc/93/05/15/381930515.db2.gz MTMJQGBVHGZHMQ-KJDJKKKBSA-N 0 3 253.317 2.509 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)no1 ZINC000373126589 381932647 /nfs/dbraw/zinc/93/26/47/381932647.db2.gz QUOVJJZFQACBQA-LLVKDONJSA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)no1 ZINC000373126589 381932649 /nfs/dbraw/zinc/93/26/49/381932649.db2.gz QUOVJJZFQACBQA-LLVKDONJSA-N 0 3 291.326 2.602 20 10 CFCDHN COc1ccc(C[NH2+]C2CCC3(CCCO3)CC2)c([O-])c1 ZINC000373468481 382011127 /nfs/dbraw/zinc/01/11/27/382011127.db2.gz VPGONFXKEMUMGE-UHFFFAOYSA-N 0 3 291.391 2.982 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1 ZINC000373370702 381988354 /nfs/dbraw/zinc/98/83/54/381988354.db2.gz RGGQQJZIYIWASC-IRXDYDNUSA-N 0 3 291.391 2.696 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])[C@H]2CCCO[C@@H]21 ZINC000374904670 382060083 /nfs/dbraw/zinc/06/00/83/382060083.db2.gz UNTAJUFXRCCCPS-YUELXQCFSA-N 0 3 279.355 2.825 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000375825886 382106372 /nfs/dbraw/zinc/10/63/72/382106372.db2.gz SYEFOOJLGQFIAK-HOCLYGCPSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000375825886 382106378 /nfs/dbraw/zinc/10/63/78/382106378.db2.gz SYEFOOJLGQFIAK-HOCLYGCPSA-N 0 3 277.364 2.544 20 10 CFCDHN CCC[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])OC ZINC000293622437 382201091 /nfs/dbraw/zinc/20/10/91/382201091.db2.gz IKURDQNCONDWDZ-JQWIXIFHSA-N 0 3 255.333 2.997 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293666034 382221891 /nfs/dbraw/zinc/22/18/91/382221891.db2.gz JLOTYRNRURMSLG-OUCADQQQSA-N 0 3 283.437 2.772 20 10 CFCDHN Cc1cc(CN2CCC(F)(F)[C@@H](CO)C2)ccc1N(C)C ZINC000293597834 382188925 /nfs/dbraw/zinc/18/89/25/382188925.db2.gz OQUPIZYPTAZIQX-CQSZACIVSA-N 0 3 298.377 2.511 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])C2 ZINC000363854651 382249198 /nfs/dbraw/zinc/24/91/98/382249198.db2.gz MLHJXMVRKLOKQX-UONOGXRCSA-N 0 3 285.391 2.871 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000377633982 382307046 /nfs/dbraw/zinc/30/70/46/382307046.db2.gz WESRWBMANAPYOP-DYVFJYSZSA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000377633982 382307052 /nfs/dbraw/zinc/30/70/52/382307052.db2.gz WESRWBMANAPYOP-DYVFJYSZSA-N 0 3 291.391 2.964 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1ccccc1[O-] ZINC000187975258 382313259 /nfs/dbraw/zinc/31/32/59/382313259.db2.gz JMFZULPSISMPLZ-VHDGCEQUSA-N 0 3 263.381 2.984 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cc(OC)c(OC)cc1[O-])C(C)C ZINC000188002716 382321907 /nfs/dbraw/zinc/32/19/07/382321907.db2.gz VEPDMOMUEATZSX-ZDUSSCGKSA-N 0 3 297.395 2.560 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCc3nc(C)ncc3C2)cc1C ZINC000377836413 382355783 /nfs/dbraw/zinc/35/57/83/382355783.db2.gz ALNXUMKYOGPABP-MRXNPFEDSA-N 0 3 297.402 2.755 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000377852405 382357258 /nfs/dbraw/zinc/35/72/58/382357258.db2.gz PTZOOCCWUHRTRB-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000377852405 382357265 /nfs/dbraw/zinc/35/72/65/382357265.db2.gz PTZOOCCWUHRTRB-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000294028634 382384883 /nfs/dbraw/zinc/38/48/83/382384883.db2.gz NZEITIPESXFYJL-SJORKVTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCOCC(F)F)c1 ZINC000188757141 382470274 /nfs/dbraw/zinc/47/02/74/382470274.db2.gz HSBSPADCAWNWSO-JTQLQIEISA-N 0 3 259.296 2.633 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC23CCOCC3)c1 ZINC000378440557 382461469 /nfs/dbraw/zinc/46/14/69/382461469.db2.gz BYELRRMRFDBHBM-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC23CCOCC3)c1 ZINC000378440557 382461471 /nfs/dbraw/zinc/46/14/71/382461471.db2.gz BYELRRMRFDBHBM-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000294223458 382467169 /nfs/dbraw/zinc/46/71/69/382467169.db2.gz LZZYSVKYFMOKOC-UONOGXRCSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000294223458 382467172 /nfs/dbraw/zinc/46/71/72/382467172.db2.gz LZZYSVKYFMOKOC-UONOGXRCSA-N 0 3 298.789 2.901 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C[C@H]21 ZINC000378472367 382467959 /nfs/dbraw/zinc/46/79/59/382467959.db2.gz IMPCXJHQZOXQMZ-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3cccc(Cl)c3[O-])C[C@H]21 ZINC000378472367 382467964 /nfs/dbraw/zinc/46/79/64/382467964.db2.gz IMPCXJHQZOXQMZ-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CC(C)(C[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1)C(N)=O ZINC000294761230 382526846 /nfs/dbraw/zinc/52/68/46/382526846.db2.gz JDXLUDPWGYRGTN-CYBMUJFWSA-N 0 3 290.407 2.506 20 10 CFCDHN CC(C)(C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1)C(N)=O ZINC000294761230 382526851 /nfs/dbraw/zinc/52/68/51/382526851.db2.gz JDXLUDPWGYRGTN-CYBMUJFWSA-N 0 3 290.407 2.506 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CC2(CO)CC2)cc1 ZINC000188950457 382511338 /nfs/dbraw/zinc/51/13/38/382511338.db2.gz FONDNNBJKDCVGL-UHFFFAOYSA-N 0 3 276.424 2.737 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2CCN(C)C[C@H]21 ZINC000367356655 382565525 /nfs/dbraw/zinc/56/55/25/382565525.db2.gz OYAROLZODOVTOM-FVQBIDKESA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H]2CCN(C)C[C@H]21 ZINC000367356655 382565531 /nfs/dbraw/zinc/56/55/31/382565531.db2.gz OYAROLZODOVTOM-FVQBIDKESA-N 0 3 274.408 2.869 20 10 CFCDHN C[C@H](C(=O)N(C)Cc1ccccc1O)[C@@H](N)c1ccccc1 ZINC000237397409 382960072 /nfs/dbraw/zinc/96/00/72/382960072.db2.gz GMVBPLPGBFTCFA-SUMWQHHRSA-N 0 3 298.386 2.687 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 ZINC000248529058 383253873 /nfs/dbraw/zinc/25/38/73/383253873.db2.gz WNDMTYPBJJYHHM-GDJRKYJOSA-N 0 3 291.391 2.865 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c([O-])c1 ZINC000249465976 383346861 /nfs/dbraw/zinc/34/68/61/383346861.db2.gz GQUDZUUJLLSUFU-ZMSDIMECSA-N 0 3 291.391 2.838 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1[O-] ZINC000530216950 383768628 /nfs/dbraw/zinc/76/86/28/383768628.db2.gz RACPKOSTWZJLSA-DZGCQCFKSA-N 0 3 260.381 2.718 20 10 CFCDHN COc1cccc(C[NH2+]CCCc2nccs2)c1[O-] ZINC000265600875 383955944 /nfs/dbraw/zinc/95/59/44/383955944.db2.gz LXOHQPVXLPVXIR-UHFFFAOYSA-N 0 3 278.377 2.580 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCC[C@H](C)CO)c([O-])c1 ZINC000270264105 385034867 /nfs/dbraw/zinc/03/48/67/385034867.db2.gz IXIVFLNDPZGLHC-ZDUSSCGKSA-N 0 3 281.396 2.679 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)CC1CCC1)c1ccccc1[O-] ZINC000281312050 385189185 /nfs/dbraw/zinc/18/91/85/385189185.db2.gz ZEVFFEDBXVEAJH-ZFWWWQNUSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@](C)(O)C(F)(F)F ZINC000282003617 385205837 /nfs/dbraw/zinc/20/58/37/385205837.db2.gz NTEOXNUHIOUPBA-CYBMUJFWSA-N 0 3 291.313 2.918 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@](C)(O)C(F)(F)F ZINC000282003617 385205841 /nfs/dbraw/zinc/20/58/41/385205841.db2.gz NTEOXNUHIOUPBA-CYBMUJFWSA-N 0 3 291.313 2.918 20 10 CFCDHN CC[C@H](NCc1ccc(N(C)C)cc1)[C@H](O)C(F)(F)F ZINC000271026950 385308332 /nfs/dbraw/zinc/30/83/32/385308332.db2.gz VYGGJIMRKKUPFV-STQMWFEESA-N 0 3 290.329 2.544 20 10 CFCDHN CC1(C[NH2+]Cc2cc(-c3ccccc3)ccc2[O-])OCCO1 ZINC000271058276 385323156 /nfs/dbraw/zinc/32/31/56/385323156.db2.gz CQPCJQPZUVFDHE-UHFFFAOYSA-N 0 3 299.370 2.912 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](Oc3ccccn3)C2)c1 ZINC000271193904 385370659 /nfs/dbraw/zinc/37/06/59/385370659.db2.gz RONSRCVRQINVHW-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](Oc3ccccn3)C2)c1 ZINC000271193904 385370664 /nfs/dbraw/zinc/37/06/64/385370664.db2.gz RONSRCVRQINVHW-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@](C)(O)c2ccccc2)c1[O-] ZINC000271815818 385394006 /nfs/dbraw/zinc/39/40/06/385394006.db2.gz LYZPLQQXKGFPKT-QGZVFWFLSA-N 0 3 271.360 2.698 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H](O)c1cccc(F)c1 ZINC000272239342 385484932 /nfs/dbraw/zinc/48/49/32/385484932.db2.gz AJZOTPNQNWZXLJ-QLJPJBMISA-N 0 3 293.313 2.882 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)nn1C)c1ccccc1[O-] ZINC000284465572 385548522 /nfs/dbraw/zinc/54/85/22/385548522.db2.gz UDSXWFDQZCKUIM-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)nn1C)c1ccc(C)cc1[O-] ZINC000284377057 385548965 /nfs/dbraw/zinc/54/89/65/385548965.db2.gz OPBNNQDQZGUGEF-HNNXBMFYSA-N 0 3 273.380 2.983 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)nn1C)c1ccc(C)cc1[O-] ZINC000284377060 385548990 /nfs/dbraw/zinc/54/89/90/385548990.db2.gz OPBNNQDQZGUGEF-OAHLLOKOSA-N 0 3 273.380 2.983 20 10 CFCDHN COC[C@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284006662 385523672 /nfs/dbraw/zinc/52/36/72/385523672.db2.gz HYAOZXAYHBWWOX-YPMHNXCESA-N 0 3 251.370 2.942 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000272393378 385526782 /nfs/dbraw/zinc/52/67/82/385526782.db2.gz HQSIIBYFWVWQHV-HOCLYGCPSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000272393378 385526786 /nfs/dbraw/zinc/52/67/86/385526786.db2.gz HQSIIBYFWVWQHV-HOCLYGCPSA-N 0 3 293.407 2.630 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC[C@H](C)O)c([O-])c1 ZINC000285279296 385554215 /nfs/dbraw/zinc/55/42/15/385554215.db2.gz REOJPQDMXSEEPP-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccc(F)cc1[O-] ZINC000285680870 385557077 /nfs/dbraw/zinc/55/70/77/385557077.db2.gz NWDFHXHJQDDOIZ-IUODEOHRSA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000272892141 385643657 /nfs/dbraw/zinc/64/36/57/385643657.db2.gz SSTIMZLATRCNTF-DOMZBBRYSA-N 0 3 289.350 2.786 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1 ZINC000273167233 385672064 /nfs/dbraw/zinc/67/20/64/385672064.db2.gz LQOLSAHNUQAXPI-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000273188428 385673303 /nfs/dbraw/zinc/67/33/03/385673303.db2.gz YUNUTWDSXLCLQW-IRXDYDNUSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000273175462 385673554 /nfs/dbraw/zinc/67/35/54/385673554.db2.gz NBXVTJQJSOSDMC-NEPJUHHUSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1[O-] ZINC000273179996 385673807 /nfs/dbraw/zinc/67/38/07/385673807.db2.gz OBRRGFJALDFZGH-ZIAGYGMSSA-N 0 3 263.381 2.995 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCOC)cc1 ZINC000274087989 385716999 /nfs/dbraw/zinc/71/69/99/385716999.db2.gz OYLYFKBXPZHBQR-UHFFFAOYSA-N 0 3 250.386 2.611 20 10 CFCDHN C[C@@]1([NH2+]Cc2cc(F)ccc2[O-])CCO[C@H]1C1CC1 ZINC000273241083 385675033 /nfs/dbraw/zinc/67/50/33/385675033.db2.gz YTARCRYOKVVFKE-LSDHHAIUSA-N 0 3 265.328 2.579 20 10 CFCDHN Cc1ccc([C@H](C)NCc2cccc(C(N)=O)c2)c(O)c1C ZINC000273305967 385677672 /nfs/dbraw/zinc/67/76/72/385677672.db2.gz CRUNWXAPADJWFQ-ZDUSSCGKSA-N 0 3 298.386 2.959 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN2C)c([O-])c1C ZINC000273376970 385679327 /nfs/dbraw/zinc/67/93/27/385679327.db2.gz HJCSXUPHHCRGKK-KBPBESRZSA-N 0 3 262.397 2.754 20 10 CFCDHN COC(=O)N1CCC([NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1 ZINC000273440123 385682529 /nfs/dbraw/zinc/68/25/29/385682529.db2.gz YCJAKKGRHWXNCN-LBPRGKRZSA-N 0 3 292.379 2.582 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@@H]1O ZINC000273442754 385682628 /nfs/dbraw/zinc/68/26/28/385682628.db2.gz WSOKATNHEDDWCF-ZFWWWQNUSA-N 0 3 281.371 2.760 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@@H]1O ZINC000273442754 385682632 /nfs/dbraw/zinc/68/26/32/385682632.db2.gz WSOKATNHEDDWCF-ZFWWWQNUSA-N 0 3 281.371 2.760 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@H]1O ZINC000273442750 385682776 /nfs/dbraw/zinc/68/27/76/385682776.db2.gz WSOKATNHEDDWCF-DZGCQCFKSA-N 0 3 281.371 2.760 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@H]1O ZINC000273442750 385682779 /nfs/dbraw/zinc/68/27/79/385682779.db2.gz WSOKATNHEDDWCF-DZGCQCFKSA-N 0 3 281.371 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCn2ccnc2)c([O-])c1C ZINC000273443800 385682888 /nfs/dbraw/zinc/68/28/88/385682888.db2.gz ZGRQPNCZCMFFFT-AWEZNQCLSA-N 0 3 273.380 2.946 20 10 CFCDHN Cc1c(CN[C@@H](C)c2ccc(C)c(C)c2O)cnn1C ZINC000273469310 385684680 /nfs/dbraw/zinc/68/46/80/385684680.db2.gz JHNXKNQVHSTGDL-LBPRGKRZSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1c(CN[C@H](C)c2ccc(C)c(C)c2O)cnn1C ZINC000273469307 385685203 /nfs/dbraw/zinc/68/52/03/385685203.db2.gz JHNXKNQVHSTGDL-GFCCVEGCSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c([O-])c1C ZINC000273469428 385685224 /nfs/dbraw/zinc/68/52/24/385685224.db2.gz JKJGICGXWQYVFD-HZSPNIEDSA-N 0 3 261.365 2.597 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCNc2ccccn2)c([O-])c1 ZINC000273563834 385687794 /nfs/dbraw/zinc/68/77/94/385687794.db2.gz IVVCFFHXHNDURA-CYBMUJFWSA-N 0 3 271.364 2.858 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CCSCC2)c([O-])c1C ZINC000273612512 385690771 /nfs/dbraw/zinc/69/07/71/385690771.db2.gz WNOFUAAVFTYREE-CQSZACIVSA-N 0 3 294.464 2.708 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)N(C)C)c([O-])c1C ZINC000273602723 385691141 /nfs/dbraw/zinc/69/11/41/385691141.db2.gz SHWXYHXPNZBABU-DGCLKSJQSA-N 0 3 250.386 2.610 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(C)ccc2[O-])[C@@]12CCCO2 ZINC000273609497 385691243 /nfs/dbraw/zinc/69/12/43/385691243.db2.gz OBIKUWYUKGGDHW-ZACQAIPSSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)N(C)C)c([O-])c1C ZINC000273602721 385691765 /nfs/dbraw/zinc/69/17/65/385691765.db2.gz SHWXYHXPNZBABU-AAEUAGOBSA-N 0 3 250.386 2.610 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCOC[C@@H]2CCCO2)c1 ZINC000035628894 260031017 /nfs/dbraw/zinc/03/10/17/260031017.db2.gz UIVOZUUCLPEPJC-GJZGRUSLSA-N 0 3 293.407 2.937 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(O)CCCCC1)CC2 ZINC000297704228 285397710 /nfs/dbraw/zinc/39/77/10/285397710.db2.gz MKXRSTHDMCOIBK-CYBMUJFWSA-N 0 3 261.365 2.664 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000179587012 285398322 /nfs/dbraw/zinc/39/83/22/285398322.db2.gz DCSMWMGYDVSDDP-RHSMWYFYSA-N 0 3 286.419 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000179587012 285398324 /nfs/dbraw/zinc/39/83/24/285398324.db2.gz DCSMWMGYDVSDDP-RHSMWYFYSA-N 0 3 286.419 2.841 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)CN1C1CC1 ZINC000297826150 393448096 /nfs/dbraw/zinc/44/80/96/393448096.db2.gz ROQAPXJAFCRGPB-ZLDLUXBVSA-N 0 3 272.392 2.594 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CC(=O)N(C(C)(C)C)C1)c1cc(F)ccc1[O-] ZINC000186086574 393540448 /nfs/dbraw/zinc/54/04/48/393540448.db2.gz WRKHDYNHHGFTBT-CMPLNLGQSA-N 0 3 294.370 2.581 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CCC[C@H](N2CCCCC2)C1 ZINC000374899997 393503833 /nfs/dbraw/zinc/50/38/33/393503833.db2.gz UAEQNGNUOQNXRZ-HNNXBMFYSA-N 0 3 292.398 2.982 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CCC[C@H](N2CCCCC2)C1 ZINC000374899997 393503838 /nfs/dbraw/zinc/50/38/38/393503838.db2.gz UAEQNGNUOQNXRZ-HNNXBMFYSA-N 0 3 292.398 2.982 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183507884 393521574 /nfs/dbraw/zinc/52/15/74/393521574.db2.gz RKMOOZRHVWCONV-IAQYHMDHSA-N 0 3 251.370 2.840 20 10 CFCDHN CN(Cc1ccccc1O)Cc1cccc2c1OCCO2 ZINC000109772096 393879760 /nfs/dbraw/zinc/87/97/60/393879760.db2.gz YYNPRMPYBAUWPG-UHFFFAOYSA-N 0 3 285.343 2.795 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2c(C)cc(C)cc2O)n(C)n1 ZINC000284062026 394135153 /nfs/dbraw/zinc/13/51/53/394135153.db2.gz MSNHYCRPEKCOTM-ZDUSSCGKSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])n(C)n1 ZINC000284062026 394135156 /nfs/dbraw/zinc/13/51/56/394135156.db2.gz MSNHYCRPEKCOTM-ZDUSSCGKSA-N 0 3 273.380 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@H]1CCCCO1 ZINC000294864634 394295438 /nfs/dbraw/zinc/29/54/38/394295438.db2.gz YIMPDWZNAAAGPJ-NJZAAPMLSA-N 0 3 261.365 2.927 20 10 CFCDHN CCOC(CC[NH2+][C@H]1CCc2cccc([O-])c21)OCC ZINC000296454531 285986952 /nfs/dbraw/zinc/98/69/52/285986952.db2.gz NKORTMKQBGEBND-ZDUSSCGKSA-N 0 3 279.380 2.758 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CN2CCCC2=O)c([O-])c1C ZINC000273387176 292196071 /nfs/dbraw/zinc/19/60/71/292196071.db2.gz JXJSEVYBPMCAJS-GXTWGEPZSA-N 0 3 290.407 2.671 20 10 CFCDHN COCC[NH+](CCOC)Cc1c([O-])ccc2ccccc21 ZINC000005660765 170124935 /nfs/dbraw/zinc/12/49/35/170124935.db2.gz IADIIYOFMBGXRR-UHFFFAOYSA-N 0 3 289.375 2.640 20 10 CFCDHN COc1cccc(CN[C@H](C)c2ccccn2)c1O ZINC000020123378 171004324 /nfs/dbraw/zinc/00/43/24/171004324.db2.gz QIOKPCINKXPEMO-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cccnc2)c1O ZINC000020127599 171012670 /nfs/dbraw/zinc/01/26/70/171012670.db2.gz DZFAVKBBAHTMLM-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]Cc2cccc(C)c2)c1 ZINC000020134516 171022666 /nfs/dbraw/zinc/02/26/66/171022666.db2.gz HIXMMBQCKDWMLX-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCO2)c1cccnc1 ZINC000037362799 173151897 /nfs/dbraw/zinc/15/18/97/173151897.db2.gz VEEKAXLWYLBHPN-LBPRGKRZSA-N 0 3 254.333 2.867 20 10 CFCDHN CN1C[C@H](C[NH2+]Cc2ccccc2[O-])Cc2ccccc21 ZINC000363989035 262078996 /nfs/dbraw/zinc/07/89/96/262078996.db2.gz ZAOTULJDDDRPJC-AWEZNQCLSA-N 0 3 282.387 2.791 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c1[O-] ZINC000368597662 267189666 /nfs/dbraw/zinc/18/96/66/267189666.db2.gz YDBMVBLNNYWGFO-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)c1[O-] ZINC000368597662 267189670 /nfs/dbraw/zinc/18/96/70/267189670.db2.gz YDBMVBLNNYWGFO-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000368665083 267196523 /nfs/dbraw/zinc/19/65/23/267196523.db2.gz AWFBTGLKSFQMJL-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000368665083 267196524 /nfs/dbraw/zinc/19/65/24/267196524.db2.gz AWFBTGLKSFQMJL-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c1 ZINC000370394026 267315495 /nfs/dbraw/zinc/31/54/95/267315495.db2.gz DHJLBBGYTKNAGQ-DGCLKSJQSA-N 0 3 271.364 2.632 20 10 CFCDHN CN1CCc2cc(CNCc3cccc4nccn43)ccc21 ZINC000370427638 267318026 /nfs/dbraw/zinc/31/80/26/267318026.db2.gz HKRKSPRXNUTHTE-UHFFFAOYSA-N 0 3 292.386 2.616 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCO[C@@H]2C2CC2)cc1F ZINC000371206323 267370087 /nfs/dbraw/zinc/37/00/87/267370087.db2.gz FTMYNHGYNAPRBM-GDBMZVCRSA-N 0 3 278.371 2.549 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2Cc1cccc(C)c1[O-] ZINC000289706170 277354410 /nfs/dbraw/zinc/35/44/10/277354410.db2.gz ORXDSXFAJXHNLV-LVNYTYFRSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1cccc(C)c1[O-] ZINC000289706170 277354411 /nfs/dbraw/zinc/35/44/11/277354411.db2.gz ORXDSXFAJXHNLV-LVNYTYFRSA-N 0 3 273.376 2.556 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@@H]1CCCCO1 ZINC000294864642 278284183 /nfs/dbraw/zinc/28/41/83/278284183.db2.gz YIMPDWZNAAAGPJ-WHOFXGATSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[C@H]([NH2+]CCCN(C)C)c1ccc(F)cc1[O-] ZINC000285748862 288039666 /nfs/dbraw/zinc/03/96/66/288039666.db2.gz RMAZJTUPJMMWNY-ZDUSSCGKSA-N 0 3 254.349 2.524 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)cnn1C ZINC000296179851 280257331 /nfs/dbraw/zinc/25/73/31/280257331.db2.gz YALBKNTZGJIWEM-HZMBPMFUSA-N 0 3 271.364 2.772 20 10 CFCDHN CC[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)N1CCCC1 ZINC000296214832 280839125 /nfs/dbraw/zinc/83/91/25/280839125.db2.gz ZPMAVSQTYYBDDQ-CABCVRRESA-N 0 3 274.408 2.844 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cccc(Cl)c3[O-])[C@@H]2C1 ZINC000272540664 290158518 /nfs/dbraw/zinc/15/85/18/290158518.db2.gz BWRXYVPIYIPRTH-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cccc(Cl)c3[O-])[C@@H]2C1 ZINC000272540664 290158521 /nfs/dbraw/zinc/15/85/21/290158521.db2.gz BWRXYVPIYIPRTH-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](CC(C)(C)O)C2CC2)cc1C ZINC000189944018 301369393 /nfs/dbraw/zinc/36/93/93/301369393.db2.gz FGBXKFSJCPYKJE-UHFFFAOYSA-N 0 3 263.381 2.744 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](CC(C)(C)O)C2CC2)cc1C ZINC000189944018 301369396 /nfs/dbraw/zinc/36/93/96/301369396.db2.gz FGBXKFSJCPYKJE-UHFFFAOYSA-N 0 3 263.381 2.744 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1[C@H]3CCO[C@H]3C13CCC3)CC2 ZINC000297129129 304845935 /nfs/dbraw/zinc/84/59/35/304845935.db2.gz YWTYHYYBRUYLOC-BQGCOEIASA-N 0 3 285.387 2.927 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@H]3OCC[C@@H]31)CC2 ZINC000296264462 328289845 /nfs/dbraw/zinc/28/98/45/328289845.db2.gz BQIUMECKZBIXOS-IXYNUQLISA-N 0 3 273.376 2.927 20 10 CFCDHN CC(C)(C)C[C@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296242270 327091177 /nfs/dbraw/zinc/09/11/77/327091177.db2.gz AWJCHCKHGJKRAV-CHWSQXEVSA-N 0 3 263.381 2.766 20 10 CFCDHN CC[C@H]([NH2+]CC1(COC)CCOCC1)c1ccccc1[O-] ZINC000368199125 328937098 /nfs/dbraw/zinc/93/70/98/328937098.db2.gz FEJKNBOULIPJCL-HNNXBMFYSA-N 0 3 293.407 2.876 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC[C@H]2CCCOC2)c1 ZINC000527735097 330278694 /nfs/dbraw/zinc/27/86/94/330278694.db2.gz BMHSBMIDLMCRHZ-CYBMUJFWSA-N 0 3 279.380 2.697 20 10 CFCDHN COc1ccc(CN[C@]23C[C@H]2COC3(C)C)cc1C ZINC000527762554 330281418 /nfs/dbraw/zinc/28/14/18/330281418.db2.gz DKKUKZRRWLETGT-XJKSGUPXSA-N 0 3 261.365 2.661 20 10 CFCDHN COc1ccc(CN[C@@]23C[C@@H]2COC3(C)C)cc1C ZINC000527762550 330281450 /nfs/dbraw/zinc/28/14/50/330281450.db2.gz DKKUKZRRWLETGT-CJNGLKHVSA-N 0 3 261.365 2.661 20 10 CFCDHN CCOCc1cc(CN[C@@H]2C[C@]2(C)OCC)ccc1OC ZINC000527783780 330283178 /nfs/dbraw/zinc/28/31/78/330283178.db2.gz UMENYUFYYTXECK-SJORKVTESA-N 0 3 293.407 2.889 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC[C@H]1CC=CCC1)OCO2 ZINC000527787078 330283437 /nfs/dbraw/zinc/28/34/37/330283437.db2.gz HGCJKUGEDXCUIA-LBPRGKRZSA-N 0 3 275.348 2.957 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1 ZINC000527803916 330284258 /nfs/dbraw/zinc/28/42/58/330284258.db2.gz LOUOATAXJUPAKT-BUWBCJGYSA-N 0 3 279.380 2.692 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc1C ZINC000527804651 330284446 /nfs/dbraw/zinc/28/44/46/330284446.db2.gz RCNZKYPPEIOKMG-ZWUHOBOKSA-N 0 3 263.381 2.911 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1c2ccccc2C(=O)N1C)c1ccccc1[O-] ZINC000528008716 330303821 /nfs/dbraw/zinc/30/38/21/330303821.db2.gz XBLKSHCIMUMRLS-BLLLJJGKSA-N 0 3 296.370 2.870 20 10 CFCDHN Cc1cc(Cl)cc(CN[C@H]2CC[NH2+]C23CCC3)c1[O-] ZINC000530179462 333527203 /nfs/dbraw/zinc/52/72/03/333527203.db2.gz YDLWDBWBNRDJBY-ZDUSSCGKSA-N 0 3 280.799 2.728 20 10 CFCDHN CCCC[C@@H](COC)[NH2+]Cc1cccc(OC)c1[O-] ZINC000076768200 521056876 /nfs/dbraw/zinc/05/68/76/521056876.db2.gz VPNQEMZFOBCVHY-ZDUSSCGKSA-N 0 3 267.369 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H]2CCSC2)c1 ZINC000130614010 521145037 /nfs/dbraw/zinc/14/50/37/521145037.db2.gz KGPMDDHMVFJLGH-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CC(C)C[C@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094617834 519362610 /nfs/dbraw/zinc/36/26/10/519362610.db2.gz FDWGJIBHCIXGNC-ZYHUDNBSSA-N 0 3 255.333 2.589 20 10 CFCDHN CC(=O)Nc1ccc(CNCc2cc(C)c(C)cc2O)cn1 ZINC000278630705 519717315 /nfs/dbraw/zinc/71/73/15/519717315.db2.gz KRAGXHOPTWPGND-UHFFFAOYSA-N 0 3 299.374 2.652 20 10 CFCDHN CC(C)OCCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000168882204 519768469 /nfs/dbraw/zinc/76/84/69/519768469.db2.gz ISGDIRAAJSOSEW-CYBMUJFWSA-N 0 3 250.386 2.828 20 10 CFCDHN CC(C)[C@@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000272682448 519805758 /nfs/dbraw/zinc/80/57/58/519805758.db2.gz VQJSZNZGMXNJIY-HIFRSBDPSA-N 0 3 267.344 2.825 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000272835560 519822621 /nfs/dbraw/zinc/82/26/21/519822621.db2.gz IQVIBLXSBYHMJD-WFASDCNBSA-N 0 3 263.381 2.840 20 10 CFCDHN CCC1(C[NH2+]Cc2cccc(C)c2[O-])CCOCC1 ZINC000271874945 519843058 /nfs/dbraw/zinc/84/30/58/519843058.db2.gz YYEZLRNJYNYFGG-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CCOCCN[C@H](C)c1ccc(N(C)CC)cc1 ZINC000161904295 519970454 /nfs/dbraw/zinc/97/04/54/519970454.db2.gz HZQSTJOOLPRNAL-CYBMUJFWSA-N 0 3 250.386 2.830 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@H](C)OC)c([O-])c1 ZINC000289888417 520344478 /nfs/dbraw/zinc/34/44/78/520344478.db2.gz WHSDQISDDVJDPG-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@H](C)OC)c([O-])c1 ZINC000289888417 520344485 /nfs/dbraw/zinc/34/44/85/520344485.db2.gz WHSDQISDDVJDPG-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H]2CCOC[C@H]2C)c([O-])c1 ZINC000285406312 520368139 /nfs/dbraw/zinc/36/81/39/520368139.db2.gz FMCNETRVDPFKPZ-ZIAGYGMSSA-N 0 3 293.407 2.943 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(OC)c2[O-])C12CCC2 ZINC000266191228 520372562 /nfs/dbraw/zinc/37/25/62/520372562.db2.gz YQEHFRQSFVYWMC-HUUCEWRRSA-N 0 3 291.391 2.838 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000278041604 520373937 /nfs/dbraw/zinc/37/39/37/520373937.db2.gz XMMCSTRYJFVPIB-WFASDCNBSA-N 0 3 279.380 2.696 20 10 CFCDHN CC1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000297005472 520736181 /nfs/dbraw/zinc/73/61/81/520736181.db2.gz SWKYZFZNQIZKPB-CYBMUJFWSA-N 0 3 261.365 2.786 20 10 CFCDHN CCCCOCC[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228672624 520782820 /nfs/dbraw/zinc/78/28/20/520782820.db2.gz KULKHTNINHMKHX-UHFFFAOYSA-N 0 3 287.787 2.961 20 10 CFCDHN CCCCOCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094617804 520784621 /nfs/dbraw/zinc/78/46/21/520784621.db2.gz IZASNXOFSRNDFO-LLVKDONJSA-N 0 3 255.333 2.999 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000280048407 520808961 /nfs/dbraw/zinc/80/89/61/520808961.db2.gz JKKMQZSBDREXLT-TZMCWYRMSA-N 0 3 251.370 2.902 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H]2CCCOC2)cc1F ZINC000236933112 520911921 /nfs/dbraw/zinc/91/19/21/520911921.db2.gz MWBIOYBBQPIZSR-CQSZACIVSA-N 0 3 280.387 2.941 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000266193797 520936458 /nfs/dbraw/zinc/93/64/58/520936458.db2.gz JHLNAIXPSPCJOT-OAHLLOKOSA-N 0 3 251.370 2.650 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000230661730 520938483 /nfs/dbraw/zinc/93/84/83/520938483.db2.gz YWKWTHJWNYTXFX-IUODEOHRSA-N 0 3 251.370 2.902 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H]2CCSC2)c1 ZINC000130614010 521145017 /nfs/dbraw/zinc/14/50/17/521145017.db2.gz KGPMDDHMVFJLGH-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCC(O)(CC)CC)c1 ZINC000276257178 521150594 /nfs/dbraw/zinc/15/05/94/521150594.db2.gz RYPPGYJJRMNZTP-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN CCOc1cccc(C[NH2+]CC(C)(C)CCOC)c1[O-] ZINC000230867207 521362210 /nfs/dbraw/zinc/36/22/10/521362210.db2.gz JJBRSFMBSHQOAH-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cccc(OC)c1[O-])OC ZINC000291662208 521441771 /nfs/dbraw/zinc/44/17/71/521441771.db2.gz FGSNDMMHOKCGKH-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CCC(CC)(CO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000266184640 521458874 /nfs/dbraw/zinc/45/88/74/521458874.db2.gz WHEAZEQTTQSXAH-UHFFFAOYSA-N 0 3 251.370 2.650 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228668702 521639604 /nfs/dbraw/zinc/63/96/04/521639604.db2.gz BOLJGOCRCKVKKG-CYBMUJFWSA-N 0 3 298.814 2.628 20 10 CFCDHN CCNC(=O)[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263720508 521743682 /nfs/dbraw/zinc/74/36/82/521743682.db2.gz WIZGSRNGTXUXHJ-CYBMUJFWSA-N 0 3 298.386 2.673 20 10 CFCDHN CO[C@]1(C)CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000280148959 521750344 /nfs/dbraw/zinc/75/03/44/521750344.db2.gz DOKJKEOZSUFBED-OAHLLOKOSA-N 0 3 267.344 2.922 20 10 CFCDHN CO[C@]1(C)CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000280148959 521750348 /nfs/dbraw/zinc/75/03/48/521750348.db2.gz DOKJKEOZSUFBED-OAHLLOKOSA-N 0 3 267.344 2.922 20 10 CFCDHN CN(C)c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000226583536 522208713 /nfs/dbraw/zinc/20/87/13/522208713.db2.gz RPSNFHGSGCQCEJ-UHFFFAOYSA-N 0 3 274.339 2.887 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)C2)c1[O-] ZINC000228631140 522538215 /nfs/dbraw/zinc/53/82/15/522538215.db2.gz BKHMYFSKILIIRF-VIFPVBQESA-N 0 3 255.745 2.896 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)C2)c1[O-] ZINC000228631140 522538225 /nfs/dbraw/zinc/53/82/25/522538225.db2.gz BKHMYFSKILIIRF-VIFPVBQESA-N 0 3 255.745 2.896 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)CSC)c1[O-] ZINC000169088670 522540424 /nfs/dbraw/zinc/54/04/24/522540424.db2.gz NDICDPQPYYALKX-MRVPVSSYSA-N 0 3 275.801 2.895 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2cccnc2)c1[O-] ZINC000228670842 522540587 /nfs/dbraw/zinc/54/05/87/522540587.db2.gz PTOOJECHCXJLGT-UHFFFAOYSA-N 0 3 292.766 2.782 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCCOCC2CC2)c1[O-] ZINC000228670010 522540605 /nfs/dbraw/zinc/54/06/05/522540605.db2.gz XQQFRWZQIJYKHW-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN CC[C@H]([NH2+]CCN1CC=CCC1)c1ccccc1[O-] ZINC000280852024 522588506 /nfs/dbraw/zinc/58/85/06/522588506.db2.gz BPDISPXJYOVISA-HNNXBMFYSA-N 0 3 260.381 2.695 20 10 CFCDHN CC[C@H]([NH2+]CCN(CC)C1CC1)c1ccccc1[O-] ZINC000155564633 522589921 /nfs/dbraw/zinc/58/99/21/522589921.db2.gz ZIKUITYHYIDLNK-HNNXBMFYSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(NC(C)=O)nc1)c1ccccc1[O-] ZINC000279196453 522650073 /nfs/dbraw/zinc/65/00/73/522650073.db2.gz WZCBKQMGYCMHDE-HNNXBMFYSA-N 0 3 299.374 2.987 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cnn(C)c1)c1ccccc1[O-] ZINC000156004810 522703332 /nfs/dbraw/zinc/70/33/32/522703332.db2.gz OUUOHWOSCMUWJB-FZMZJTMJSA-N 0 3 259.353 2.928 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)CC(C)C)c1ccccc1[O-] ZINC000040774185 522707100 /nfs/dbraw/zinc/70/71/00/522707100.db2.gz SJWADDJDPIMURU-OCCSQVGLSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@@H](CO)SC)c1ccccc1[O-] ZINC000155947678 522736566 /nfs/dbraw/zinc/73/65/66/522736566.db2.gz PGDWHCPVUMLYDZ-SCDSUCTJSA-N 0 3 269.410 2.545 20 10 CFCDHN COC[C@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000113355650 522752566 /nfs/dbraw/zinc/75/25/66/522752566.db2.gz OBTMKFIVYZOPID-HNNXBMFYSA-N 0 3 257.333 2.870 20 10 CFCDHN COc1cc(O)c(CN2CCC(C)=C(C)C2)cc1OC ZINC000280844565 522775466 /nfs/dbraw/zinc/77/54/66/522775466.db2.gz AZJKNGQRSKWAIQ-UHFFFAOYSA-N 0 3 277.364 2.952 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000287033148 522908960 /nfs/dbraw/zinc/90/89/60/522908960.db2.gz LYAGHXFMJSKHRZ-GXTWGEPZSA-N 0 3 250.386 2.691 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CC(=O)N(C(C)C)C1)c1ccc(C)cc1[O-] ZINC000280038489 522921066 /nfs/dbraw/zinc/92/10/66/522921066.db2.gz IRIOTJCIACMDFP-UKRRQHHQSA-N 0 3 290.407 2.751 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1cccc(OC)c1[O-] ZINC000230863830 522985136 /nfs/dbraw/zinc/98/51/36/522985136.db2.gz XCFTXJNXXPQBDR-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN COCCC1(C[NH2+]Cc2cc(Cl)cc(OC)c2[O-])CC1 ZINC000230935238 523063349 /nfs/dbraw/zinc/06/33/49/523063349.db2.gz LJWZDBABUWCWFN-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCC=CO1 ZINC000191056857 523261659 /nfs/dbraw/zinc/26/16/59/523261659.db2.gz SAZKGMLWUKUYHV-INIZCTEOSA-N 0 3 260.381 2.877 20 10 CFCDHN COCC[N@H+](C)Cc1cc(Br)cc(C)c1[O-] ZINC000162808509 523619936 /nfs/dbraw/zinc/61/99/36/523619936.db2.gz POKXITRFGFERLQ-UHFFFAOYSA-N 0 3 288.185 2.541 20 10 CFCDHN COCC[N@@H+](C)Cc1cc(Br)cc(C)c1[O-] ZINC000162808509 523619947 /nfs/dbraw/zinc/61/99/47/523619947.db2.gz POKXITRFGFERLQ-UHFFFAOYSA-N 0 3 288.185 2.541 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)N1[C@@H](C)CC[C@@H]1C ZINC000101645584 524087053 /nfs/dbraw/zinc/08/70/53/524087053.db2.gz DZYLRYJGDCAAQJ-IHRRRGAJSA-N 0 3 290.407 2.612 20 10 CFCDHN Cc1cccc(C(=O)NCC[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000272858163 524195099 /nfs/dbraw/zinc/19/50/99/524195099.db2.gz MHONMHQNIHUBFP-AWEZNQCLSA-N 0 3 298.386 2.781 20 10 CFCDHN Cc1cccc(CN(CCN(C)C)Cc2ccco2)c1O ZINC000289440546 524382741 /nfs/dbraw/zinc/38/27/41/524382741.db2.gz LXSLQCCRZBSFJC-UHFFFAOYSA-N 0 3 288.391 2.857 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1[O-] ZINC000245850616 524402395 /nfs/dbraw/zinc/40/23/95/524402395.db2.gz MHBURWIVCZGLOK-CJNGLKHVSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1[O-] ZINC000245850616 524402404 /nfs/dbraw/zinc/40/24/04/524402404.db2.gz MHBURWIVCZGLOK-CJNGLKHVSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000191683648 524468832 /nfs/dbraw/zinc/46/88/32/524468832.db2.gz GCSISROOPOAQNN-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H](CO)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263724786 524530313 /nfs/dbraw/zinc/53/03/13/524530313.db2.gz WVPSIUKCJMWFDX-ZDUSSCGKSA-N 0 3 271.360 2.777 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1nccs1 ZINC000230693704 524739736 /nfs/dbraw/zinc/73/97/36/524739736.db2.gz OITINHSCJUQQPC-VIFPVBQESA-N 0 3 266.341 2.881 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000292845594 524742048 /nfs/dbraw/zinc/74/20/48/524742048.db2.gz SPKRTQASUFYAIL-OAHLLOKOSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000292845594 524742052 /nfs/dbraw/zinc/74/20/52/524742052.db2.gz SPKRTQASUFYAIL-OAHLLOKOSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2(SC)CCC2)c1 ZINC000193363819 524748448 /nfs/dbraw/zinc/74/84/48/524748448.db2.gz NUHNHLXWWUUJND-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@H](O)c2ccccc2)c1 ZINC000289389543 524750988 /nfs/dbraw/zinc/75/09/88/524750988.db2.gz DPBCHNCZMFMJBY-KRWDZBQOSA-N 0 3 287.359 2.614 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2COc3c(C)cccc3C2)c1 ZINC000290960571 524756644 /nfs/dbraw/zinc/75/66/44/524756644.db2.gz ROQFUXKXOCRFNW-HNNXBMFYSA-N 0 3 299.370 2.803 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@@H](OC)CC2)c1 ZINC000364986508 524769739 /nfs/dbraw/zinc/76/97/39/524769739.db2.gz SVZVQMSLIXEZLI-QWHCGFSZSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@@H](OC)CC2)c1 ZINC000364986508 524769750 /nfs/dbraw/zinc/76/97/50/524769750.db2.gz SVZVQMSLIXEZLI-QWHCGFSZSA-N 0 3 279.380 2.963 20 10 CFCDHN Cc1cc(CN[C@@H](CO)c2ccccc2)ccc1N(C)C ZINC000272554825 524770010 /nfs/dbraw/zinc/77/00/10/524770010.db2.gz RLXAVOBCDLSTIV-KRWDZBQOSA-N 0 3 284.403 2.884 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CSC)c1 ZINC000168785861 524773476 /nfs/dbraw/zinc/77/34/76/524773476.db2.gz XTRLDKQSOQICEE-ZJUUUORDSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](CO)c2ccccc2)c1 ZINC000062999299 524774906 /nfs/dbraw/zinc/77/49/06/524774906.db2.gz IMOUEOXLPKIPAJ-LRDDRELGSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1ncccc1CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000289595329 525044109 /nfs/dbraw/zinc/04/41/09/525044109.db2.gz BFKGBYIUDVVYSA-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)C[C@@H]2C)cc1C ZINC000290553837 525314189 /nfs/dbraw/zinc/31/41/89/525314189.db2.gz RYWONLUKQNHJLY-GOEBONIOSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)cc1C ZINC000290553837 525314199 /nfs/dbraw/zinc/31/41/99/525314199.db2.gz RYWONLUKQNHJLY-GOEBONIOSA-N 0 3 276.424 2.781 20 10 CFCDHN C[C@H](NCC1=CCCOC1)c1ccc(N(C)C)cc1 ZINC000274745769 525321993 /nfs/dbraw/zinc/32/19/93/525321993.db2.gz DHYOFFSSUWCJRM-ZDUSSCGKSA-N 0 3 260.381 2.750 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccccc1[O-] ZINC000278394986 525339331 /nfs/dbraw/zinc/33/93/31/525339331.db2.gz DCQQVDQAOSNUIB-GJZGRUSLSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@H]([NH2+]CCOCC(F)(F)C(F)F)c1ccccc1[O-] ZINC000276154470 525357413 /nfs/dbraw/zinc/35/74/13/525357413.db2.gz CMBXLCXHOCXWJJ-VIFPVBQESA-N 0 3 295.276 2.960 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)CC(C)C)c1 ZINC000040775405 525364219 /nfs/dbraw/zinc/36/42/19/525364219.db2.gz CNZIMUCKHCNKOU-STQMWFEESA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)Cn2ccnc2)c1 ZINC000037158374 525365573 /nfs/dbraw/zinc/36/55/73/525365573.db2.gz SQJAZNMFIPFFSL-OLZOCXBDSA-N 0 3 259.353 2.636 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CSCCS1)c1ccccc1[O-] ZINC000167457421 525397954 /nfs/dbraw/zinc/39/79/54/525397954.db2.gz PUFRWWPVOCNFKL-WDEREUQCSA-N 0 3 269.435 2.891 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CSCCS1)c1ccccc1[O-] ZINC000167457625 525423554 /nfs/dbraw/zinc/42/35/54/525423554.db2.gz PUFRWWPVOCNFKL-QWRGUYRKSA-N 0 3 269.435 2.891 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccccc1[O-] ZINC000278394994 525436520 /nfs/dbraw/zinc/43/65/20/525436520.db2.gz DCQQVDQAOSNUIB-LSDHHAIUSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@H](NCc1cccn1C)c1ccc(N2CCOCC2)cc1 ZINC000161812213 525465473 /nfs/dbraw/zinc/46/54/73/525465473.db2.gz LSPUHMKSMFLXHE-HNNXBMFYSA-N 0 3 299.418 2.713 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CSCCS1)c1ccccc1[O-] ZINC000167457529 525487870 /nfs/dbraw/zinc/48/78/70/525487870.db2.gz PUFRWWPVOCNFKL-GHMZBOCLSA-N 0 3 269.435 2.891 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000185370847 525495846 /nfs/dbraw/zinc/49/58/46/525495846.db2.gz WMWFEDBGFNUVNH-IUODEOHRSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618034 525498330 /nfs/dbraw/zinc/49/83/30/525498330.db2.gz TUWXHDJJCYAICT-LLVKDONJSA-N 0 3 277.343 2.846 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H](O)c1ccccc1 ZINC000290242806 525512776 /nfs/dbraw/zinc/51/27/76/525512776.db2.gz UUNVGLDYJWYLDT-BDJLRTHQSA-N 0 3 275.323 2.743 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCc3nccn3C2)c([O-])c1 ZINC000278952744 525728155 /nfs/dbraw/zinc/72/81/55/525728155.db2.gz LNSLBUFJXDFGAN-KGLIPLIRSA-N 0 3 285.391 2.810 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)C(C)C)c([O-])c1 ZINC000230664229 525741164 /nfs/dbraw/zinc/74/11/64/525741164.db2.gz AZDFKRBEYQFPPH-OCCSQVGLSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)CC2CCC2)c([O-])c1 ZINC000280886055 525937162 /nfs/dbraw/zinc/93/71/62/525937162.db2.gz DSJYHARSQGNSCO-GXTWGEPZSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc(CN2CCSC(C)(C)C2)c1O ZINC000093504545 525950008 /nfs/dbraw/zinc/95/00/08/525950008.db2.gz XMVNEVOICYJHRS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@@H+]2CCSC(C)(C)C2)c1[O-] ZINC000093504545 525950011 /nfs/dbraw/zinc/95/00/11/525950011.db2.gz XMVNEVOICYJHRS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCSC(C)(C)C2)c1[O-] ZINC000093504545 525950018 /nfs/dbraw/zinc/95/00/18/525950018.db2.gz XMVNEVOICYJHRS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cc(C)ccc2[O-])c1O ZINC000265110611 526024586 /nfs/dbraw/zinc/02/45/86/526024586.db2.gz WUIPBCCCXIFYFV-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2C[C@@](C)(OC)C2(C)C)c1[O-] ZINC000174132964 526039569 /nfs/dbraw/zinc/03/95/69/526039569.db2.gz FEDJDHOXQNJDJK-XJKSGUPXSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1nnc(CC[NH2+][C@H](C)c2ccc(C)cc2[O-])s1 ZINC000289578530 526329982 /nfs/dbraw/zinc/32/99/82/526329982.db2.gz BIMIDOZZYOTKTJ-SNVBAGLBSA-N 0 3 277.393 2.754 20 10 CFCDHN O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1cc(F)ccc1[O-] ZINC000272409207 526355017 /nfs/dbraw/zinc/35/50/17/526355017.db2.gz KONZTTHPUWIIHM-CYBMUJFWSA-N 0 3 288.322 2.799 20 10 CFCDHN Oc1ccccc1CN(Cc1ccccn1)C1CC1 ZINC000290553596 526371585 /nfs/dbraw/zinc/37/15/85/526371585.db2.gz RXPABJNGBCQLIM-UHFFFAOYSA-N 0 3 254.333 2.952 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@]1(CO)C[C@@H]1c1ccccc1 ZINC000289870250 527625900 /nfs/dbraw/zinc/62/59/00/527625900.db2.gz OYIFCNDFHUMBQE-SJLPKXTDSA-N 0 3 283.371 2.648 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCOC(C)(C)C2)c([O-])c1 ZINC000754081083 574088827 /nfs/dbraw/zinc/08/88/27/574088827.db2.gz YMWYPMLZXGGINK-CYBMUJFWSA-N 0 3 279.380 2.838 20 10 CFCDHN C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870858 574131141 /nfs/dbraw/zinc/13/11/41/574131141.db2.gz ZZXXNRAYGAWHNN-IJLUTSLNSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C1=CC(=O)CS1 ZINC000731870858 574131143 /nfs/dbraw/zinc/13/11/43/574131143.db2.gz ZZXXNRAYGAWHNN-IJLUTSLNSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@H]1CCC[C@](CNC(=O)c2cc([O-])cs2)([NH+](C)C)C1 ZINC000732276437 574149443 /nfs/dbraw/zinc/14/94/43/574149443.db2.gz KBWVQWUTNBBCBD-NHYWBVRUSA-N 0 3 296.436 2.694 20 10 CFCDHN CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cc([O-])cs1 ZINC000732281651 574150119 /nfs/dbraw/zinc/15/01/19/574150119.db2.gz VQSICXKAXKEUNX-GFCCVEGCSA-N 0 3 296.436 2.838 20 10 CFCDHN CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([O-])cs1 ZINC000732281651 574150122 /nfs/dbraw/zinc/15/01/22/574150122.db2.gz VQSICXKAXKEUNX-GFCCVEGCSA-N 0 3 296.436 2.838 20 10 CFCDHN CCCCN1CCCC[C@@H]1CNC(=O)C1=CC(=O)CS1 ZINC000732281651 574150125 /nfs/dbraw/zinc/15/01/25/574150125.db2.gz VQSICXKAXKEUNX-GFCCVEGCSA-N 0 3 296.436 2.838 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000748088410 574228299 /nfs/dbraw/zinc/22/82/99/574228299.db2.gz KERFPJKLTVBBOZ-ZDUSSCGKSA-N 0 3 275.392 2.739 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000748088410 574228301 /nfs/dbraw/zinc/22/83/01/574228301.db2.gz KERFPJKLTVBBOZ-ZDUSSCGKSA-N 0 3 275.392 2.739 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccco1)c1cc(F)ccc1[O-] ZINC000756382098 574231858 /nfs/dbraw/zinc/23/18/58/574231858.db2.gz QXQJZIWXDMQGSP-RNCFNFMXSA-N 0 3 265.284 2.509 20 10 CFCDHN C[C@H](Cn1ccnc1)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756401660 574233991 /nfs/dbraw/zinc/23/39/91/574233991.db2.gz JEVUUCSBYPRGTF-NQBHXWOUSA-N 0 3 289.354 2.954 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(C)C2)c([O-])c1C ZINC000756443793 574237813 /nfs/dbraw/zinc/23/78/13/574237813.db2.gz IWSYQMXHVPLUHS-KBPBESRZSA-N 0 3 262.397 2.754 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000756459085 574238886 /nfs/dbraw/zinc/23/88/86/574238886.db2.gz WJLUDNAROWTOHJ-NTZNESFSSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCC(=O)Nc2ccccn2)c1 ZINC000756481366 574240102 /nfs/dbraw/zinc/24/01/02/574240102.db2.gz XIKVPNNBFSPJFN-CYBMUJFWSA-N 0 3 299.374 2.775 20 10 CFCDHN COC(=O)N1CCC[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000756526878 574243486 /nfs/dbraw/zinc/24/34/86/574243486.db2.gz HXTUJOJYZOSIOP-QWHCGFSZSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCSCCCO)c2c1c(F)ccc2[O-] ZINC000756541652 574245164 /nfs/dbraw/zinc/24/51/64/574245164.db2.gz GNGKEIWYASDAKI-ZYHUDNBSSA-N 0 3 299.411 2.785 20 10 CFCDHN CCc1nncn1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756620734 574252344 /nfs/dbraw/zinc/25/23/44/574252344.db2.gz LXJRSGRCMIXHFS-ZDUSSCGKSA-N 0 3 288.395 2.514 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@]2(O)CCSC2)c([O-])c1C ZINC000756637596 574254127 /nfs/dbraw/zinc/25/41/27/574254127.db2.gz NZQVPZAZOHIBDF-IUODEOHRSA-N 0 3 281.421 2.528 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2C=C[C@H](CO)C2)c2c1c(F)ccc2[O-] ZINC000756661216 574256502 /nfs/dbraw/zinc/25/65/02/574256502.db2.gz QEJZOQKMLNZIIY-LSCVPOLPSA-N 0 3 277.339 2.606 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1cc(F)ccc1[O-] ZINC000756661184 574256506 /nfs/dbraw/zinc/25/65/06/574256506.db2.gz PLJLVGNVHZBDBY-NEPJUHHUSA-N 0 3 293.338 2.626 20 10 CFCDHN Cc1noc(CC[NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)n1 ZINC000756689123 574257650 /nfs/dbraw/zinc/25/76/50/574257650.db2.gz RPWLWNLLJLULNN-KCJUWKMLSA-N 0 3 291.326 2.603 20 10 CFCDHN Cc1cc(CN[C@H]2C[C@H](C)c3c2c(O)ccc3F)ncn1 ZINC000756775434 574261832 /nfs/dbraw/zinc/26/18/32/574261832.db2.gz HKSATHZMGAAFAA-ZANVPECISA-N 0 3 287.338 2.968 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](O)CC2)c([O-])c1C ZINC000756771190 574261860 /nfs/dbraw/zinc/26/18/60/574261860.db2.gz SBOWJRSEQPVVBB-MGPQQGTHSA-N 0 3 263.381 2.963 20 10 CFCDHN CO[C@@H]1CCC[C@H]1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756786051 574262771 /nfs/dbraw/zinc/26/27/71/574262771.db2.gz IIKVVUGRVCMVMW-JRPNMDOOSA-N 0 3 267.344 2.997 20 10 CFCDHN CO[C@@H]1CCC[C@H]1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756786055 574262787 /nfs/dbraw/zinc/26/27/87/574262787.db2.gz IIKVVUGRVCMVMW-ZIBATOQPSA-N 0 3 267.344 2.997 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCC[C@H]2OC)c1 ZINC000756787088 574262956 /nfs/dbraw/zinc/26/29/56/574262956.db2.gz OHJZRMPXHAKNFX-MQIPJXDCSA-N 0 3 279.380 2.867 20 10 CFCDHN C[C@@H]([NH2+]CCc1cnccn1)c1cc2c(cc1[O-])CCCC2 ZINC000756785957 574263013 /nfs/dbraw/zinc/26/30/13/574263013.db2.gz HDDRAIWRWRULIW-CYBMUJFWSA-N 0 3 297.402 2.954 20 10 CFCDHN CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C(F)(F)F ZINC000756834295 574266008 /nfs/dbraw/zinc/26/60/08/574266008.db2.gz DTLMWUNPIFKFFY-RDDDGLTNSA-N 0 3 281.249 2.759 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](C)c1ccncc1 ZINC000749296039 574288379 /nfs/dbraw/zinc/28/83/79/574288379.db2.gz MMJCQKANLWPMSR-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)Cc2ccncc2)c([O-])c1 ZINC000749295283 574288543 /nfs/dbraw/zinc/28/85/43/574288543.db2.gz LIENCRBCVDGTKQ-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN COC1CCC(C[NH2+]Cc2cc(C)ccc2[O-])CC1 ZINC000749927327 574316553 /nfs/dbraw/zinc/31/65/53/574316553.db2.gz XIEMVVPKZMFSPF-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@H](CNCc1cc(C)c(C)cc1O)C(F)(F)F ZINC000742370683 574324977 /nfs/dbraw/zinc/32/49/77/574324977.db2.gz IWVUEZSSNKYNTC-GFCCVEGCSA-N 0 3 277.286 2.676 20 10 CFCDHN COc1ccc(N2CCN(CCC3CC3)CC2)cc1 ZINC000743836502 574373110 /nfs/dbraw/zinc/37/31/10/574373110.db2.gz WXGSLVDOZPHGOT-UHFFFAOYSA-N 0 3 260.381 2.617 20 10 CFCDHN CCOC(=O)C[C@@](C)([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000187705382 617721843 /nfs/dbraw/zinc/72/18/43/617721843.db2.gz BFNRBOBEZDFWGZ-MRXNPFEDSA-N 0 3 297.370 2.989 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000300417644 617797373 /nfs/dbraw/zinc/79/73/73/617797373.db2.gz WOSAPHVIJKYJLB-HUUCEWRRSA-N 0 3 278.371 2.638 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cncc(Br)c1 ZINC000157880730 618185361 /nfs/dbraw/zinc/18/53/61/618185361.db2.gz XSPQZEXYYMSYHO-UHFFFAOYSA-N 0 3 293.164 2.840 20 10 CFCDHN CN(CC[C@H]1CCCC[N@@H+]1C)Cc1cc(F)cc(F)c1[O-] ZINC000894053365 618293076 /nfs/dbraw/zinc/29/30/76/618293076.db2.gz GAWLTTADBXFSLJ-CQSZACIVSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@H]1CCCC[N@H+]1C)Cc1cc(F)cc(F)c1[O-] ZINC000894053365 618293079 /nfs/dbraw/zinc/29/30/79/618293079.db2.gz GAWLTTADBXFSLJ-CQSZACIVSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@@H]1CC[N@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894053365 618293083 /nfs/dbraw/zinc/29/30/83/618293083.db2.gz GAWLTTADBXFSLJ-CQSZACIVSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@@H]1CC[N@@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894053365 618293089 /nfs/dbraw/zinc/29/30/89/618293089.db2.gz GAWLTTADBXFSLJ-CQSZACIVSA-N 0 3 298.377 2.977 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@@H]21 ZINC000894096432 618323489 /nfs/dbraw/zinc/32/34/89/618323489.db2.gz UZWOIHGIDBCKJP-NHYWBVRUSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@@H]21 ZINC000894096432 618323496 /nfs/dbraw/zinc/32/34/96/618323496.db2.gz UZWOIHGIDBCKJP-NHYWBVRUSA-N 0 3 296.361 2.587 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2cccnc2)c(O)c1OC ZINC000892480330 618355384 /nfs/dbraw/zinc/35/53/84/618355384.db2.gz BGFGTALACSKKRN-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cc(C)cc(CNCc2cccc(C)n2)c1O ZINC000894183802 618431729 /nfs/dbraw/zinc/43/17/29/618431729.db2.gz LSZXJPAQYWOECA-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)CCC1 ZINC000840883929 618646649 /nfs/dbraw/zinc/64/66/49/618646649.db2.gz HKIJJXRAXYOCQI-DGCLKSJQSA-N 0 3 261.365 2.927 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000311897203 618728077 /nfs/dbraw/zinc/72/80/77/618728077.db2.gz PTIXTDLMPJHAFL-NWDGAFQWSA-N 0 3 268.376 2.911 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000840977209 619205736 /nfs/dbraw/zinc/20/57/36/619205736.db2.gz IVDOGGCOPSDZIV-OAHLLOKOSA-N 0 3 286.350 2.900 20 10 CFCDHN CC(C)[NH+]1CCC(N(C)Cc2cc(F)cc(F)c2[O-])CC1 ZINC000893920301 619243602 /nfs/dbraw/zinc/24/36/02/619243602.db2.gz PVXPUJJNSLMZPT-UHFFFAOYSA-N 0 3 298.377 2.975 20 10 CFCDHN COc1cc(C)cc(CN[C@H](CO)c2ccsc2)c1O ZINC000894480603 619397049 /nfs/dbraw/zinc/39/70/49/619397049.db2.gz PXLAZCRMPJGHHB-CYBMUJFWSA-N 0 3 293.388 2.594 20 10 CFCDHN COC(=O)[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])CC(C)C ZINC000894791595 619464913 /nfs/dbraw/zinc/46/49/13/619464913.db2.gz UPEJILMABMPEQZ-CQSZACIVSA-N 0 3 279.380 2.626 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2(N(C)C)CC2)c1[O-] ZINC000841890812 619539392 /nfs/dbraw/zinc/53/93/92/619539392.db2.gz VSTBJWZSDLAYFM-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN COc1ccc(C[N@H+](C)C[C@@H]2CC2(C)C)c([O-])c1OC ZINC000895482289 619541025 /nfs/dbraw/zinc/54/10/25/619541025.db2.gz TWGPLFBBKVRNJL-LBPRGKRZSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1ccc(C[N@@H+](C)C[C@@H]2CC2(C)C)c([O-])c1OC ZINC000895482289 619541026 /nfs/dbraw/zinc/54/10/26/619541026.db2.gz TWGPLFBBKVRNJL-LBPRGKRZSA-N 0 3 279.380 2.887 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1C[C@H]2C[C@@]2(O)C1 ZINC000895649221 619573233 /nfs/dbraw/zinc/57/32/33/619573233.db2.gz OVRGSTLTOOFGGT-SJLPKXTDSA-N 0 3 281.355 2.626 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@H]2C[C@@]2(O)C1 ZINC000895649221 619573235 /nfs/dbraw/zinc/57/32/35/619573235.db2.gz OVRGSTLTOOFGGT-SJLPKXTDSA-N 0 3 281.355 2.626 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@]23CCCO3)c([O-])c1 ZINC000895679421 619581072 /nfs/dbraw/zinc/58/10/72/619581072.db2.gz GSHHPEBCWCXVHQ-CVEARBPZSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc(C[NH2+]C2CCC3(COC3)CC2)c([O-])c1 ZINC000895695363 619587452 /nfs/dbraw/zinc/58/74/52/619587452.db2.gz VZWGKGWIPQPFOZ-UHFFFAOYSA-N 0 3 261.365 2.749 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)Cc2ccccc2F)c([O-])c1 ZINC000895747509 619595730 /nfs/dbraw/zinc/59/57/30/619595730.db2.gz DEKSSGSMYICNGZ-HNNXBMFYSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@]3(CO[C@@H](C)C3)O2)c([O-])c1 ZINC000895817199 619614244 /nfs/dbraw/zinc/61/42/44/619614244.db2.gz HAJZANDGEJGBPV-QRTARXTBSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)C2)O1 ZINC000895820525 619614610 /nfs/dbraw/zinc/61/46/10/619614610.db2.gz OIYWZYRFGGPUDX-ZQIUZPCESA-N 0 3 291.391 2.517 20 10 CFCDHN C[C@@H]([NH2+]Cc1cn(C)nc1C1CC1)c1ccccc1[O-] ZINC000895852637 619623163 /nfs/dbraw/zinc/62/31/63/619623163.db2.gz YKOLWZSEQOQGEX-LLVKDONJSA-N 0 3 271.364 2.854 20 10 CFCDHN COc1cc2c(cc1O)CCN(Cc1c(C)cccc1O)C2 ZINC000895886846 619628138 /nfs/dbraw/zinc/62/81/38/619628138.db2.gz GKKMTDVJUZUOBU-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN COc1ccc(CN[C@]23CCC[C@@]2(OC)OCC3)cc1C ZINC000896414613 619732247 /nfs/dbraw/zinc/73/22/47/619732247.db2.gz ABFYCHYIFYNFOJ-DLBZAZTESA-N 0 3 291.391 2.779 20 10 CFCDHN CCc1nn(C)c(Cl)c1C[NH2+]Cc1c([O-])cccc1F ZINC000896640631 619781304 /nfs/dbraw/zinc/78/13/04/619781304.db2.gz KFAOKOBXAAMWOY-UHFFFAOYSA-N 0 3 297.761 2.770 20 10 CFCDHN CCc1nn(C)c(Cl)c1CNCc1c(O)cccc1F ZINC000896640631 619781306 /nfs/dbraw/zinc/78/13/06/619781306.db2.gz KFAOKOBXAAMWOY-UHFFFAOYSA-N 0 3 297.761 2.770 20 10 CFCDHN Cc1cccc(O)c1CNCc1cc(C(F)(F)F)nn1C ZINC000896840755 619838015 /nfs/dbraw/zinc/83/80/15/619838015.db2.gz PGFJOIWIXYEXAD-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN CCc1onc(C)c1CNCc1cccc(C)c1O ZINC000897337455 620000296 /nfs/dbraw/zinc/00/02/96/620000296.db2.gz SVDOAEAEPNDOOU-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN C[C@H]([NH2+]CCCN(C)C)c1ccc(Cl)cc1[O-] ZINC000841743093 620178175 /nfs/dbraw/zinc/17/81/75/620178175.db2.gz CBMKEBPULAAFBQ-JTQLQIEISA-N 0 3 256.777 2.648 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@H]1CCCC[C@H]1O ZINC000897536916 620222639 /nfs/dbraw/zinc/22/26/39/620222639.db2.gz YHVAZBXLDAMCAN-BXUZGUMPSA-N 0 3 267.344 2.562 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@@H]1O ZINC000897684286 620271425 /nfs/dbraw/zinc/27/14/25/620271425.db2.gz LZWOIOCDGIXUJL-UGSOOPFHSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@@H]1O ZINC000897684286 620271428 /nfs/dbraw/zinc/27/14/28/620271428.db2.gz LZWOIOCDGIXUJL-UGSOOPFHSA-N 0 3 283.371 2.872 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](CCO)C1CCCC1 ZINC000897883187 620297718 /nfs/dbraw/zinc/29/77/18/620297718.db2.gz XRRRDUAZNKFRTP-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2cccnc2C)c([O-])c1 ZINC000898257666 620358846 /nfs/dbraw/zinc/35/88/46/620358846.db2.gz ZPPTUKRWYFFROR-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2COC[C@H]2C2CC2)c1[O-] ZINC000898381290 620378975 /nfs/dbraw/zinc/37/89/75/620378975.db2.gz CSILFMPDKMURLJ-QWHCGFSZSA-N 0 3 297.782 2.569 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000927019961 620440087 /nfs/dbraw/zinc/44/00/87/620440087.db2.gz VBYUDJREOXYRBW-JQWIXIFHSA-N 0 3 255.333 2.733 20 10 CFCDHN COc1ccc(CNC/C=C\Cl)cc1Cn1cccn1 ZINC000898424216 620461265 /nfs/dbraw/zinc/46/12/65/620461265.db2.gz CGGIFYLXVLKFJG-KXFIGUGUSA-N 0 3 291.782 2.782 20 10 CFCDHN C[C@@H](N[C@H]1C[NH2+]CC1(C)C)c1cc(Cl)ccc1[O-] ZINC000902450788 621091596 /nfs/dbraw/zinc/09/15/96/621091596.db2.gz UKEYVLKADNNRDP-RNCFNFMXSA-N 0 3 268.788 2.694 20 10 CFCDHN CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902468924 621100408 /nfs/dbraw/zinc/10/04/08/621100408.db2.gz YJDSLANESLAMJD-RUZUBIRVSA-N 0 3 280.799 2.979 20 10 CFCDHN C[C@H](NC[C@@H]1CCCCC[NH2+]1)c1ccc(F)cc1[O-] ZINC000902484529 621111116 /nfs/dbraw/zinc/11/11/16/621111116.db2.gz WCXRRIYCKOYJSV-AAEUAGOBSA-N 0 3 266.360 2.714 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@]2(OC(C)C)CCOC2)c([O-])c1 ZINC000903358719 621347978 /nfs/dbraw/zinc/34/79/78/621347978.db2.gz YGFXQOAAVVSBSL-RHSMWYFYSA-N 0 3 293.407 2.935 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000903450775 621386092 /nfs/dbraw/zinc/38/60/92/621386092.db2.gz MXOUVDXLBKHZQA-WZRBSPASSA-N 0 3 295.354 2.914 20 10 CFCDHN Nc1ccc(C[N@H+](Cc2ccccc2[O-])C2CCCC2)nn1 ZINC000904320449 621573571 /nfs/dbraw/zinc/57/35/71/621573571.db2.gz HKFYVVQUPWRALF-UHFFFAOYSA-N 0 3 298.390 2.709 20 10 CFCDHN Nc1ccc(C[N@@H+](Cc2ccccc2[O-])C2CCCC2)nn1 ZINC000904320449 621573574 /nfs/dbraw/zinc/57/35/74/621573574.db2.gz HKFYVVQUPWRALF-UHFFFAOYSA-N 0 3 298.390 2.709 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1ccsc1 ZINC000226583837 623084085 /nfs/dbraw/zinc/08/40/85/623084085.db2.gz WFAMIAHOXMYUQO-UHFFFAOYSA-N 0 3 251.326 2.925 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1CC[C@H]1O ZINC000822504321 623117064 /nfs/dbraw/zinc/11/70/64/623117064.db2.gz RWMAXRNGOMPAEW-IAGOWNOFSA-N 0 3 299.370 2.584 20 10 CFCDHN CC(C)(C)OC(=O)NC1CC([NH2+]Cc2ccccc2[O-])C1 ZINC000228407804 623142301 /nfs/dbraw/zinc/14/23/01/623142301.db2.gz DASXOODWLPWUET-UHFFFAOYSA-N 0 3 292.379 2.538 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000229312774 623197216 /nfs/dbraw/zinc/19/72/16/623197216.db2.gz RSURNHCUQNICTI-AWEZNQCLSA-N 0 3 261.365 2.974 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](C)c2cn[nH]c2)c1 ZINC000230669565 623289789 /nfs/dbraw/zinc/28/97/89/623289789.db2.gz OWDYXHLZPYESFQ-NXEZZACHSA-N 0 3 261.325 2.536 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)CC(C)C)c([O-])c1 ZINC000230660071 623292044 /nfs/dbraw/zinc/29/20/44/623292044.db2.gz YQVRPUDKNGQIJC-CHWSQXEVSA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@@H]([NH3+])[C@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000063191323 623330060 /nfs/dbraw/zinc/33/00/60/623330060.db2.gz VIGBSIBIUVWHCP-ZWNOBZJWSA-N 0 3 268.788 2.747 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000063218349 623331432 /nfs/dbraw/zinc/33/14/32/623331432.db2.gz WKBDAXLPXPZJCP-DZGCQCFKSA-N 0 3 271.360 2.646 20 10 CFCDHN CC(C)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1O ZINC000823987167 623429780 /nfs/dbraw/zinc/42/97/80/623429780.db2.gz QRDKJBTXOLHMKS-ZDUSSCGKSA-N 0 3 296.798 2.535 20 10 CFCDHN CC(C)C[C@@H](CN1CCCC1)[NH2+]Cc1ccccc1[O-] ZINC000824559395 623524116 /nfs/dbraw/zinc/52/41/16/623524116.db2.gz SCWOYHKPZBUSMQ-INIZCTEOSA-N 0 3 276.424 2.992 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](OC)[C@H](C)CC)c([O-])c1 ZINC000824596806 623529975 /nfs/dbraw/zinc/52/99/75/623529975.db2.gz LPNKRDUBJTTWDT-MLGOLLRUSA-N 0 3 281.396 2.942 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000824751423 623557370 /nfs/dbraw/zinc/55/73/70/623557370.db2.gz WEFCIUQSJFQYIW-CYBMUJFWSA-N 0 3 261.365 2.831 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000824751033 623557805 /nfs/dbraw/zinc/55/78/05/623557805.db2.gz QNAIJAAKVUWJDC-LBPRGKRZSA-N 0 3 279.355 2.970 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000824750243 623558000 /nfs/dbraw/zinc/55/80/00/623558000.db2.gz FPWQSBSEOZMHOL-ZDUSSCGKSA-N 0 3 291.391 2.840 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC)[C@H](C)C2)c([O-])c1 ZINC000824814870 623570879 /nfs/dbraw/zinc/57/08/79/623570879.db2.gz GBCYMQIBSSYPPN-WBMJQRKESA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC)[C@H](C)C2)c([O-])c1 ZINC000824814870 623570887 /nfs/dbraw/zinc/57/08/87/623570887.db2.gz GBCYMQIBSSYPPN-WBMJQRKESA-N 0 3 279.380 2.648 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)Cc1cnn(C)c1)c1ccccc1[O-] ZINC000825046214 623615670 /nfs/dbraw/zinc/61/56/70/623615670.db2.gz QVJGUNCAVIMNBS-IUODEOHRSA-N 0 3 273.380 2.798 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000825133679 623637743 /nfs/dbraw/zinc/63/77/43/623637743.db2.gz KHBBWOLWHLDXCX-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000825133679 623637745 /nfs/dbraw/zinc/63/77/45/623637745.db2.gz KHBBWOLWHLDXCX-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CC(C)OCCOC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000825207363 623650221 /nfs/dbraw/zinc/65/02/21/623650221.db2.gz JBZJMRORALOPBA-UHFFFAOYSA-N 0 3 293.407 2.798 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000825320539 623669644 /nfs/dbraw/zinc/66/96/44/623669644.db2.gz KZZIVYROYNWMMA-WCQYABFASA-N 0 3 282.815 2.926 20 10 CFCDHN C[C@H]([NH2+]Cc1cccnc1N(C)C)c1cc(F)ccc1[O-] ZINC000185015880 625674361 /nfs/dbraw/zinc/67/43/61/625674361.db2.gz ZHSGHFRIBCDAQP-NSHDSACASA-N 0 3 289.354 2.843 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)C2(CO)CC2)c1[O-] ZINC000826990508 623920065 /nfs/dbraw/zinc/92/00/65/623920065.db2.gz HOJYMOYSJDSUKQ-JTQLQIEISA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827699659 624068760 /nfs/dbraw/zinc/06/87/60/624068760.db2.gz KVXVAYSSJYEWNO-ABAIWWIYSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827699659 624068762 /nfs/dbraw/zinc/06/87/62/624068762.db2.gz KVXVAYSSJYEWNO-ABAIWWIYSA-N 0 3 283.799 2.804 20 10 CFCDHN CCCN(C)CC(C)(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000827722846 624077351 /nfs/dbraw/zinc/07/73/51/624077351.db2.gz XQHGBYSUSBXXHB-UHFFFAOYSA-N 0 3 268.376 2.741 20 10 CFCDHN Cc1ncc2c(n1)CC[C@@H]([NH2+][C@H]1CCc3cccc([O-])c31)C2 ZINC000834508484 625699299 /nfs/dbraw/zinc/69/92/99/625699299.db2.gz MUTLNENHEAZSIZ-ZBFHGGJFSA-N 0 3 295.386 2.625 20 10 CFCDHN Cc1cnccc1CC[N@@H+](C)Cc1ccccc1[O-] ZINC000828062633 624163780 /nfs/dbraw/zinc/16/37/80/624163780.db2.gz MOFHPQZUPJYPDM-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cnccc1CC[N@H+](C)Cc1ccccc1[O-] ZINC000828062633 624163784 /nfs/dbraw/zinc/16/37/84/624163784.db2.gz MOFHPQZUPJYPDM-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc3c2OCC3)cc1 ZINC000921496134 624902061 /nfs/dbraw/zinc/90/20/61/624902061.db2.gz OKPARFXZXXQQFO-UHFFFAOYSA-N 0 3 282.387 2.977 20 10 CFCDHN CO[C@]1(C)C[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000180816912 625042059 /nfs/dbraw/zinc/04/20/59/625042059.db2.gz OGDYJTWVIWROGV-DZGCQCFKSA-N 0 3 267.344 2.825 20 10 CFCDHN CO[C@@]1(C)C[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000180816951 625042465 /nfs/dbraw/zinc/04/24/65/625042465.db2.gz OGDYJTWVIWROGV-ZFWWWQNUSA-N 0 3 267.344 2.825 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@H](O)Cc1ccccc1 ZINC000834689085 625785048 /nfs/dbraw/zinc/78/50/48/625785048.db2.gz JKIGJBNQQWERDM-FDQGKXFDSA-N 0 3 297.398 2.961 20 10 CFCDHN C[C@@H]1COCC[C@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834798899 625866767 /nfs/dbraw/zinc/86/67/67/625866767.db2.gz RCCVGLMDMCXYNV-XBFCOCLRSA-N 0 3 261.365 2.642 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCOC[C@@H]1OC)c1ccc(C)cc1[O-] ZINC000834880813 625907744 /nfs/dbraw/zinc/90/77/44/625907744.db2.gz RVRHARHRNCSQOY-QRTARXTBSA-N 0 3 293.407 2.793 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2cnn(C)c2)c([O-])c1 ZINC000834896847 625913195 /nfs/dbraw/zinc/91/31/95/625913195.db2.gz OJRNGFPMVGPIEJ-QWHCGFSZSA-N 0 3 273.380 2.716 20 10 CFCDHN CC1(C)CCCN1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834908892 625920079 /nfs/dbraw/zinc/92/00/79/625920079.db2.gz IKYAXAZACJBFKH-CQSZACIVSA-N 0 3 274.408 2.844 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCC[C@H]2O)c1[O-] ZINC000834912579 625920939 /nfs/dbraw/zinc/92/09/39/625920939.db2.gz DQBCQTANSOQNGP-OASPWFOLSA-N 0 3 269.772 2.918 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H]2CCCCN2C1=O)c1ccccc1[O-] ZINC000834914278 625921824 /nfs/dbraw/zinc/92/18/24/625921824.db2.gz LSUNMRUGQPGSOA-VHDGCEQUSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H]([NH2+]C[C@@](C)(O)C(C)C)c1ccccc1[O-] ZINC000186189207 626012032 /nfs/dbraw/zinc/01/20/32/626012032.db2.gz CUJHOACGYZHJQP-DZGCQCFKSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H](CNC(=O)OC(C)(C)C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000227685759 626012313 /nfs/dbraw/zinc/01/23/13/626012313.db2.gz YGWQRTSFWBYXOT-VXGBXAGGSA-N 0 3 294.395 2.956 20 10 CFCDHN COc1ccc(O)c(CNCc2nccc3c2CCCC3)c1 ZINC000921740918 626102954 /nfs/dbraw/zinc/10/29/54/626102954.db2.gz QOXDNCZLTWEPBY-UHFFFAOYSA-N 0 3 298.386 2.964 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000922677910 626339851 /nfs/dbraw/zinc/33/98/51/626339851.db2.gz IEBBTPKFROOMDV-WCQYABFASA-N 0 3 289.297 2.982 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCC2(CCC2)O1 ZINC000922812469 626368723 /nfs/dbraw/zinc/36/87/23/626368723.db2.gz MVSHURZAMWFEFG-ZDUSSCGKSA-N 0 3 291.391 2.982 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@]2(C)CCCCO2)c([O-])c1 ZINC000922819118 626373166 /nfs/dbraw/zinc/37/31/66/626373166.db2.gz ZEZGHTGOBUUNCP-INIZCTEOSA-N 0 3 279.380 2.840 20 10 CFCDHN COCC[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-] ZINC000186914269 626403843 /nfs/dbraw/zinc/40/38/43/626403843.db2.gz LXWWZHPMGRLPRU-VIFPVBQESA-N 0 3 288.185 2.760 20 10 CFCDHN CC[C@@H]1OCC[C@H]1[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000839193374 626530945 /nfs/dbraw/zinc/53/09/45/626530945.db2.gz XZFLIHWXKNASHR-NEPJUHHUSA-N 0 3 285.771 2.711 20 10 CFCDHN CC[C@@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464803 627345433 /nfs/dbraw/zinc/34/54/33/627345433.db2.gz AOJPHEBIHBUFCU-WBVHZDCISA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464803 627345437 /nfs/dbraw/zinc/34/54/37/627345437.db2.gz AOJPHEBIHBUFCU-WBVHZDCISA-N 0 3 291.391 2.830 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2c([O-])cccc2OC)C1 ZINC000769422086 627436930 /nfs/dbraw/zinc/43/69/30/627436930.db2.gz GLEBUURRPZPPSA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2c([O-])cccc2OC)C1 ZINC000769422086 627436934 /nfs/dbraw/zinc/43/69/34/627436934.db2.gz GLEBUURRPZPPSA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(CN(C)Cc2ccc[nH]2)c(O)c1 ZINC000769542331 627454751 /nfs/dbraw/zinc/45/47/51/627454751.db2.gz GGZLRUNBHXNSBG-UHFFFAOYSA-N 0 3 260.337 2.751 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000769933662 627489134 /nfs/dbraw/zinc/48/91/34/627489134.db2.gz HBVUUDWBGRNECB-UHFFFAOYSA-N 0 3 283.327 2.900 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000770374985 627516332 /nfs/dbraw/zinc/51/63/32/627516332.db2.gz PMKLUSVJWIWBBR-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000770374985 627516337 /nfs/dbraw/zinc/51/63/37/627516337.db2.gz PMKLUSVJWIWBBR-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC000771894335 627644782 /nfs/dbraw/zinc/64/47/82/627644782.db2.gz WJTQGQYRIPNJFC-BLLLJJGKSA-N 0 3 279.380 2.694 20 10 CFCDHN CCN(C)c1ccc(CN2CCC(O)(C(F)F)CC2)cc1 ZINC000773843588 627863680 /nfs/dbraw/zinc/86/36/80/627863680.db2.gz AENUBCKRQDVJOB-UHFFFAOYSA-N 0 3 298.377 2.735 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC23CCOCC3)c([O-])c1 ZINC000775155920 627997028 /nfs/dbraw/zinc/99/70/28/627997028.db2.gz CDDGCLAPBOPPGD-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC23CCOCC3)c([O-])c1 ZINC000775155920 627997029 /nfs/dbraw/zinc/99/70/29/627997029.db2.gz CDDGCLAPBOPPGD-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CC[C@@H]([NH2+]CCC(=O)Nc1ccccn1)c1ccccc1[O-] ZINC000775496323 628031605 /nfs/dbraw/zinc/03/16/05/628031605.db2.gz GKFCQEVKAGHYNZ-CQSZACIVSA-N 0 3 299.374 2.857 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)Cc1cnccn1)c1ccccc1[O-] ZINC000775495834 628031681 /nfs/dbraw/zinc/03/16/81/628031681.db2.gz CSWFKSOCLSIKEM-WFASDCNBSA-N 0 3 271.364 2.854 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CN(C2CC2)C[C@H]1C)c1ccccc1[O-] ZINC000775512604 628033091 /nfs/dbraw/zinc/03/30/91/628033091.db2.gz LHGDZBJEHRMHBT-KCXAZCMYSA-N 0 3 274.408 2.916 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H](C)N(C)C[C@@H]2C)c1O ZINC000775985511 628090897 /nfs/dbraw/zinc/09/08/97/628090897.db2.gz LZBWYEVTCWVRMP-MNOVXSKESA-N 0 3 298.814 2.579 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1([C@@H](C)CCO)CCC1 ZINC000776258336 628123226 /nfs/dbraw/zinc/12/32/26/628123226.db2.gz WCQHAORJUIUJJH-ZDUSSCGKSA-N 0 3 293.407 2.679 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC(C)(C)O2)c([O-])c1 ZINC000778207919 628286974 /nfs/dbraw/zinc/28/69/74/628286974.db2.gz AOBBNBGBMMAXCH-CQSZACIVSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1n[nH]cc1[C@@H](C)NCc1ccc(N(C)C)cc1C ZINC000779064412 628348841 /nfs/dbraw/zinc/34/88/41/628348841.db2.gz HWEKGVVQFWXWKZ-GFCCVEGCSA-N 0 3 272.396 2.943 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCn3ccnc3C2)c([O-])c1 ZINC000779066595 628349573 /nfs/dbraw/zinc/34/95/73/628349573.db2.gz SKLDMQLQWFFPJU-STQMWFEESA-N 0 3 271.364 2.563 20 10 CFCDHN C[C@@H](Cc1cccc(O)c1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779072812 628350079 /nfs/dbraw/zinc/35/00/79/628350079.db2.gz LPDMHEJPPKMAHJ-NSHDSACASA-N 0 3 275.323 2.958 20 10 CFCDHN CSc1cc(C[NH2+]Cc2cc(F)ccc2[O-])ccn1 ZINC000779131602 628354563 /nfs/dbraw/zinc/35/45/63/628354563.db2.gz OCHLEBWBDDOGJV-UHFFFAOYSA-N 0 3 278.352 2.938 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCn3ccnc3C2)c1[O-] ZINC000779192940 628359002 /nfs/dbraw/zinc/35/90/02/628359002.db2.gz RCQGGSLQLOCDKJ-ZDUSSCGKSA-N 0 3 291.782 2.655 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCOC2(CCOCC2)C1)c1ccccc1[O-] ZINC000783516501 628715922 /nfs/dbraw/zinc/71/59/22/628715922.db2.gz COUGWCQMDHRLNL-ZIAGYGMSSA-N 0 3 291.391 2.771 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCOC2(CCOCC2)C1)c1ccccc1[O-] ZINC000783516498 628715961 /nfs/dbraw/zinc/71/59/61/628715961.db2.gz COUGWCQMDHRLNL-KBPBESRZSA-N 0 3 291.391 2.771 20 10 CFCDHN C[C@H](NCc1ccnc(N)c1)c1ccc(N(C)C)cc1 ZINC000785807392 628914407 /nfs/dbraw/zinc/91/44/07/628914407.db2.gz HVOVZRSDBJEGTQ-LBPRGKRZSA-N 0 3 270.380 2.581 20 10 CFCDHN COc1ccc(N2CCN(CC3(C)CC3)CC2)cc1F ZINC000787206330 628999054 /nfs/dbraw/zinc/99/90/54/628999054.db2.gz GGHUALHPQTYBNA-UHFFFAOYSA-N 0 3 278.371 2.756 20 10 CFCDHN CC(C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccnn1C ZINC000788265367 629054266 /nfs/dbraw/zinc/05/42/66/629054266.db2.gz DXLAIQYJRIKCLH-AWEZNQCLSA-N 0 3 291.370 2.794 20 10 CFCDHN Oc1ccccc1CNCc1ccc(-c2cc[nH]n2)o1 ZINC000788510035 629076971 /nfs/dbraw/zinc/07/69/71/629076971.db2.gz VTTVXUQGQQDKMQ-UHFFFAOYSA-N 0 3 269.304 2.665 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000788510035 629076976 /nfs/dbraw/zinc/07/69/76/629076976.db2.gz VTTVXUQGQQDKMQ-UHFFFAOYSA-N 0 3 269.304 2.665 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CC[N@H+](CC2CC2)C1 ZINC000790960912 629273966 /nfs/dbraw/zinc/27/39/66/629273966.db2.gz LLRNAUUWSHHTKY-LLVKDONJSA-N 0 3 298.789 2.759 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000790960912 629273967 /nfs/dbraw/zinc/27/39/67/629273967.db2.gz LLRNAUUWSHHTKY-LLVKDONJSA-N 0 3 298.789 2.759 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CCN(C3CC3)CC2)cc1 ZINC000835025776 629319969 /nfs/dbraw/zinc/31/99/69/629319969.db2.gz NIOIQTHWOJJGDY-ARJAWSKDSA-N 0 3 285.435 2.546 20 10 CFCDHN CN(C)c1ccc(/C=C/CNC[C@@H](O)c2ccco2)cc1 ZINC000835036957 629330797 /nfs/dbraw/zinc/33/07/97/629330797.db2.gz SBBVNDHNIGYQFH-LLCTXKFZSA-N 0 3 286.375 2.682 20 10 CFCDHN C[C@H](NC/C=C/c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000835041039 629336107 /nfs/dbraw/zinc/33/61/07/629336107.db2.gz IUBHEMKODZSRKT-IHVVCDCBSA-N 0 3 270.380 2.840 20 10 CFCDHN C[C@@H]1C[C@H](C)N1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000793219677 629507703 /nfs/dbraw/zinc/50/77/03/629507703.db2.gz DDSALTOLDCZWME-BETUJISGSA-N 0 3 278.371 2.645 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc3c(C)cccn23)c([O-])c1 ZINC000793388129 629535936 /nfs/dbraw/zinc/53/59/36/629535936.db2.gz MRJHFNMLBXQUTQ-UHFFFAOYSA-N 0 3 297.358 2.647 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc(F)nc2C)c([O-])c1 ZINC000793389405 629535948 /nfs/dbraw/zinc/53/59/48/629535948.db2.gz XQKNVKHCADKJNS-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN Cc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)n(C)n1 ZINC000793561996 629571854 /nfs/dbraw/zinc/57/18/54/629571854.db2.gz SMGJNRCRXJMTSX-TVQRCGJNSA-N 0 3 289.354 2.911 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCCC[C@H]1CCO ZINC000793610670 629578384 /nfs/dbraw/zinc/57/83/84/629578384.db2.gz VOSOODFXMAKCEJ-AWEZNQCLSA-N 0 3 267.344 2.658 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCCC[C@H]1CCO ZINC000793610670 629578386 /nfs/dbraw/zinc/57/83/86/629578386.db2.gz VOSOODFXMAKCEJ-AWEZNQCLSA-N 0 3 267.344 2.658 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794805162 629687954 /nfs/dbraw/zinc/68/79/54/629687954.db2.gz FYCZBKWWPGECBQ-XJKSGUPXSA-N 0 3 274.408 2.978 20 10 CFCDHN CC[C@H]([NH2+]C[C@@]1(CCO)CCOC1)c1ccc(C)cc1[O-] ZINC000794811570 629688596 /nfs/dbraw/zinc/68/85/96/629688596.db2.gz RQMVXQMGDBMNJO-DOTOQJQBSA-N 0 3 293.407 2.530 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000794812227 629689562 /nfs/dbraw/zinc/68/95/62/629689562.db2.gz VJZYWYLQHJUBSJ-OCCSQVGLSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@@H]([NH2+]CC1(OC)CCOCC1)c1ccc(C)cc1[O-] ZINC000794815931 629689723 /nfs/dbraw/zinc/68/97/23/629689723.db2.gz MIIGJIGRIKOXMH-OAHLLOKOSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC(=O)N(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794817797 629690081 /nfs/dbraw/zinc/69/00/81/629690081.db2.gz QWNNLIVAMFEVCX-WFASDCNBSA-N 0 3 288.391 2.505 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCO)C1CC1)c1ccc(C)cc1[O-] ZINC000794818665 629690333 /nfs/dbraw/zinc/69/03/33/629690333.db2.gz UVOCLAHKRPLFAZ-CABCVRRESA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC(=O)N(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794817796 629690497 /nfs/dbraw/zinc/69/04/97/629690497.db2.gz QWNNLIVAMFEVCX-SWLSCSKDSA-N 0 3 288.391 2.505 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCN2CC=CCC2)c2c1c(F)ccc2[O-] ZINC000794834417 629692408 /nfs/dbraw/zinc/69/24/08/629692408.db2.gz NJOMGQKOAYCRIB-JSGCOSHPSA-N 0 3 290.382 2.931 20 10 CFCDHN CNC(=O)C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])c1ccccc1 ZINC000795849709 629841176 /nfs/dbraw/zinc/84/11/76/629841176.db2.gz QGXAKDXPFFVSOY-XJKSGUPXSA-N 0 3 298.386 2.920 20 10 CFCDHN Cc1ccc(O)c(CN[C@H](c2nccn2C)C2CC2)c1 ZINC000796465595 629921512 /nfs/dbraw/zinc/92/15/12/629921512.db2.gz KQJBFOCASWQJRZ-HNNXBMFYSA-N 0 3 271.364 2.675 20 10 CFCDHN CCCCN(CC(=O)N[C@@H](C)CC)Cc1ccccc1O ZINC000801599688 630461874 /nfs/dbraw/zinc/46/18/74/630461874.db2.gz ZFPVTRRGKBGOLL-AWEZNQCLSA-N 0 3 292.423 2.909 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CSC2(C)C)c([O-])c1 ZINC000801735875 630467722 /nfs/dbraw/zinc/46/77/22/630467722.db2.gz PMUNDSZGMLVHEV-CYBMUJFWSA-N 0 3 267.394 2.775 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cnn(C)c2)c1[O-] ZINC000808679920 631027270 /nfs/dbraw/zinc/02/72/70/631027270.db2.gz FEZXJIUODUNSEW-JTQLQIEISA-N 0 3 279.771 2.938 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808680517 631027854 /nfs/dbraw/zinc/02/78/54/631027854.db2.gz JUMPAQLWSVUJTA-LLVKDONJSA-N 0 3 298.814 2.873 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCCN(C)C2=O)c1[O-] ZINC000808699958 631030639 /nfs/dbraw/zinc/03/06/39/631030639.db2.gz FZOYWOLMHRMADC-MFKMUULPSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCCN(C)C2=O)c1[O-] ZINC000808699959 631031192 /nfs/dbraw/zinc/03/11/92/631031192.db2.gz FZOYWOLMHRMADC-ZWNOBZJWSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)C[S@@](C)=O)c1[O-] ZINC000808714344 631033474 /nfs/dbraw/zinc/03/34/74/631033474.db2.gz VLDSRTKCRJIHDD-AUSHCKSDSA-N 0 3 289.828 2.772 20 10 CFCDHN CC[C@H](N[C@@H](C)C(=O)NC(C)C)c1ccc(N(C)C)cc1 ZINC000840890417 631253038 /nfs/dbraw/zinc/25/30/38/631253038.db2.gz MLFYNIKCVFGMQX-BBRMVZONSA-N 0 3 291.439 2.706 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H]1CCn2ccnc21 ZINC000840894309 631254833 /nfs/dbraw/zinc/25/48/33/631254833.db2.gz PXZDAYPPGXVHJW-YOEHRIQHSA-N 0 3 298.434 2.923 20 10 CFCDHN CCOc1ccc(C[N@H+](CC2CCC2)[C@H](C)CO)c([O-])c1 ZINC000809665629 631259294 /nfs/dbraw/zinc/25/92/94/631259294.db2.gz XZDVQTYZVFYBNK-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC2CCC2)[C@H](C)CO)c([O-])c1 ZINC000809665629 631259300 /nfs/dbraw/zinc/25/93/00/631259300.db2.gz XZDVQTYZVFYBNK-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H](CO)C(C)C)c1[O-] ZINC000809724199 631271188 /nfs/dbraw/zinc/27/11/88/631271188.db2.gz XTPLMZQWLCGLLR-GFCCVEGCSA-N 0 3 271.788 2.708 20 10 CFCDHN CCOc1ccc(C[N@H+](CCN(C)C)CC(C)C)c([O-])c1 ZINC000809729226 631272483 /nfs/dbraw/zinc/27/24/83/631272483.db2.gz BMUBLBXTFMSWMO-UHFFFAOYSA-N 0 3 294.439 2.811 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCN(C)C)CC(C)C)c([O-])c1 ZINC000809729226 631272487 /nfs/dbraw/zinc/27/24/87/631272487.db2.gz BMUBLBXTFMSWMO-UHFFFAOYSA-N 0 3 294.439 2.811 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC2(F)F)c([O-])c1 ZINC000840968095 631288625 /nfs/dbraw/zinc/28/86/25/631288625.db2.gz NMOWRKRUPNHOTG-KWQFWETISA-N 0 3 257.280 2.534 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C1CC1)N(C)C)c1ccccc1[O-] ZINC000155228070 650004290 /nfs/dbraw/zinc/00/42/90/650004290.db2.gz UDFKYIPSAFDSJD-LSDHHAIUSA-N 0 3 262.397 2.773 20 10 CFCDHN CC(C)[C@@H]([NH3+])CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000841028905 631308018 /nfs/dbraw/zinc/30/80/18/631308018.db2.gz KTQMURKVSCNQGI-NSHDSACASA-N 0 3 277.195 2.772 20 10 CFCDHN CC(C)C[C@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841038519 631316608 /nfs/dbraw/zinc/31/66/08/631316608.db2.gz LIEQHHGYBUXSKB-GFCCVEGCSA-N 0 3 256.777 2.509 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CC(N)=O)cc2)c([O-])c1 ZINC000810242530 631348385 /nfs/dbraw/zinc/34/83/85/631348385.db2.gz RHZUZBUKAGRXCN-CYBMUJFWSA-N 0 3 298.386 2.579 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2(N(C)C)CC2)c2c1c(F)ccc2[O-] ZINC000841764321 631468909 /nfs/dbraw/zinc/46/89/09/631468909.db2.gz WDHXZZRVVICIJU-PWSUYJOCSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@](C)(CO)C(C)C)c1[O-] ZINC000811516624 631576069 /nfs/dbraw/zinc/57/60/69/631576069.db2.gz YNDORDGDTUWWDU-AWEZNQCLSA-N 0 3 271.788 2.851 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCOC1 ZINC000812780589 631770860 /nfs/dbraw/zinc/77/08/60/631770860.db2.gz JTLJDIUFFQCFTP-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCOC1 ZINC000812780589 631770865 /nfs/dbraw/zinc/77/08/65/631770865.db2.gz JTLJDIUFFQCFTP-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000842915939 631782142 /nfs/dbraw/zinc/78/21/42/631782142.db2.gz HZLNJWUKNIRZJT-FPMFFAJLSA-N 0 3 263.381 2.766 20 10 CFCDHN CC(C)[C@H]([NH3+])CCN(C)Cc1cc(Cl)cc(F)c1[O-] ZINC000843056755 631819941 /nfs/dbraw/zinc/81/99/41/631819941.db2.gz ZCGVHIQUKGUCTG-CYBMUJFWSA-N 0 3 288.794 2.990 20 10 CFCDHN [NH3+][C@@H]1CCC[C@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@H]21 ZINC000843059418 631822300 /nfs/dbraw/zinc/82/23/00/631822300.db2.gz LIYUYUOQJDUTRH-MRCXROJRSA-N 0 3 298.789 2.744 20 10 CFCDHN CC(=O)c1cc(Cl)cc(C[NH2+][C@](C)(CN)C(C)C)c1[O-] ZINC000843355722 631935311 /nfs/dbraw/zinc/93/53/11/631935311.db2.gz IJLSLGXKBJMERW-OAHLLOKOSA-N 0 3 298.814 2.711 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC000843412942 631946148 /nfs/dbraw/zinc/94/61/48/631946148.db2.gz BXDMJIFTEZCJMW-OAHLLOKOSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC000843412942 631946151 /nfs/dbraw/zinc/94/61/51/631946151.db2.gz BXDMJIFTEZCJMW-OAHLLOKOSA-N 0 3 279.380 2.790 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1ccccc1[O-])C1(CO)CC=CC1 ZINC000843432390 631957576 /nfs/dbraw/zinc/95/75/76/631957576.db2.gz CLNUCAGEEDRDQQ-INIZCTEOSA-N 0 3 275.392 2.835 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1CC(F)(F)C1 ZINC000813781533 631958286 /nfs/dbraw/zinc/95/82/86/631958286.db2.gz QANBFMBIOWGIIK-UHFFFAOYSA-N 0 3 257.280 2.536 20 10 CFCDHN CC[C@H](O)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000813884155 631972363 /nfs/dbraw/zinc/97/23/63/631972363.db2.gz JRYUDLKZZBFYDA-KOLCDFICSA-N 0 3 257.761 2.776 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000816535868 632479576 /nfs/dbraw/zinc/47/95/76/632479576.db2.gz CTSFWSFGKLDODD-NEPJUHHUSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000816535868 632479577 /nfs/dbraw/zinc/47/95/77/632479577.db2.gz CTSFWSFGKLDODD-NEPJUHHUSA-N 0 3 298.789 2.901 20 10 CFCDHN C[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000816648510 632503728 /nfs/dbraw/zinc/50/37/28/632503728.db2.gz LLYSBOWKEJKTSL-STQMWFEESA-N 0 3 278.371 2.503 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccnn1CC)c1ccccc1[O-] ZINC000845993333 632609642 /nfs/dbraw/zinc/60/96/42/632609642.db2.gz YBIPDYGLKNJQOA-CQSZACIVSA-N 0 3 259.353 2.850 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1[O-] ZINC000817411778 632623805 /nfs/dbraw/zinc/62/38/05/632623805.db2.gz ZARAPUGXTZJSOS-YDHLFZDLSA-N 0 3 290.407 2.725 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412645 632624033 /nfs/dbraw/zinc/62/40/33/632624033.db2.gz NOXIZZHWKGRMRY-JQWIXIFHSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412645 632624035 /nfs/dbraw/zinc/62/40/35/632624035.db2.gz NOXIZZHWKGRMRY-JQWIXIFHSA-N 0 3 283.799 2.804 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@@H](CO)C2)c1[O-] ZINC000817412507 632624428 /nfs/dbraw/zinc/62/44/28/632624428.db2.gz MBRUNHOJWHOWJW-GHMZBOCLSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c1[O-] ZINC000817412507 632624431 /nfs/dbraw/zinc/62/44/31/632624431.db2.gz MBRUNHOJWHOWJW-GHMZBOCLSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2cccn2C)cc1 ZINC000846053902 632625363 /nfs/dbraw/zinc/62/53/63/632625363.db2.gz YSPPPYMIOXYHFY-UHFFFAOYSA-N 0 3 287.407 2.602 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCO[C@@H](CC)C2)c([O-])c1 ZINC000817415700 632626377 /nfs/dbraw/zinc/62/63/77/632626377.db2.gz WYKZYSZLUPFWHH-KGLIPLIRSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@H](C)OCC23CCC3)c1 ZINC000846066829 632627500 /nfs/dbraw/zinc/62/75/00/632627500.db2.gz HFGAYUSKQIZJCD-CYBMUJFWSA-N 0 3 261.365 2.844 20 10 CFCDHN COc1cccc([C@H](C)NCc2c(C)noc2C)c1O ZINC000846146940 632647349 /nfs/dbraw/zinc/64/73/49/632647349.db2.gz SYXHAHXREFXVMT-VIFPVBQESA-N 0 3 276.336 2.856 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(OC)CC1)c1ccc(C)cc1[O-] ZINC000817587170 632671601 /nfs/dbraw/zinc/67/16/01/632671601.db2.gz CMPMOKRWKZRZHK-OAHLLOKOSA-N 0 3 278.396 2.767 20 10 CFCDHN CCCN1C[C@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1=O ZINC000817590172 632673160 /nfs/dbraw/zinc/67/31/60/632673160.db2.gz VQZNCGYRNSUEQH-KBPBESRZSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCNC1)c1ccc2ccccc2c1[O-] ZINC000817940090 632744060 /nfs/dbraw/zinc/74/40/60/632744060.db2.gz DTCJIDQULKBUQH-GXTWGEPZSA-N 0 3 270.376 2.948 20 10 CFCDHN C[C@H]([NH2+]C[C@H](N)c1ccc(N(C)C)cc1)c1ccccc1[O-] ZINC000817943573 632746346 /nfs/dbraw/zinc/74/63/46/632746346.db2.gz VPPWIOVZISHHEO-GUYCJALGSA-N 0 3 299.418 2.809 20 10 CFCDHN C[C@H](NC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1[O-] ZINC000817951677 632751729 /nfs/dbraw/zinc/75/17/29/632751729.db2.gz JIZYKXKGEIQXJG-GXSJLCMTSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CN)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817961469 632761032 /nfs/dbraw/zinc/76/10/32/632761032.db2.gz ZIFMGLWFKBVHOR-OLZOCXBDSA-N 0 3 268.788 2.824 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](N)C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817964515 632763000 /nfs/dbraw/zinc/76/30/00/632763000.db2.gz BEZNKIKNCCFMCY-PELKAZGASA-N 0 3 288.313 2.799 20 10 CFCDHN C[C@@H](N[C@@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1[O-] ZINC000817981099 632777899 /nfs/dbraw/zinc/77/78/99/632777899.db2.gz PYBFFHCQPVGMLO-PRHODGIISA-N 0 3 290.741 2.693 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[C@H]1O ZINC000818231388 632817948 /nfs/dbraw/zinc/81/79/48/632817948.db2.gz PXBRRJIWBDRGMU-NVXWUHKLSA-N 0 3 269.344 2.672 20 10 CFCDHN CC[C@@H]([NH2+]CCCCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000818351178 632836328 /nfs/dbraw/zinc/83/63/28/632836328.db2.gz PFXIPFSTDKNUOS-CQSZACIVSA-N 0 3 299.436 2.566 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCCN2CCC2)c(Cl)c1 ZINC000848543129 633284166 /nfs/dbraw/zinc/28/41/66/633284166.db2.gz AUUXDMMWGZXNCO-UHFFFAOYSA-N 0 3 268.788 2.539 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CC1)[C@@H]1CCCCO1 ZINC000848559590 633289157 /nfs/dbraw/zinc/28/91/57/633289157.db2.gz GBCKGWXRDKWKPS-HOTGVXAUSA-N 0 3 261.365 2.830 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCc1ncc(C)cc1C ZINC000848565687 633290973 /nfs/dbraw/zinc/29/09/73/633290973.db2.gz ZNBSORPWJFVJBQ-UHFFFAOYSA-N 0 3 286.375 2.745 20 10 CFCDHN CCc1cccc(CN2C[C@H](C)O[C@H](C)[C@@H]2C)c1O ZINC000848905379 633392337 /nfs/dbraw/zinc/39/23/37/633392337.db2.gz JVAHEYUKMHTBQN-RWMBFGLXSA-N 0 3 263.381 2.952 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000848913078 633398218 /nfs/dbraw/zinc/39/82/18/633398218.db2.gz NTXHPKSTVNBDPO-INIZCTEOSA-N 0 3 277.408 2.841 20 10 CFCDHN CCCCCCNC(=[NH2+])NCc1ccc(OC)cc1[O-] ZINC000849025271 633466684 /nfs/dbraw/zinc/46/66/84/633466684.db2.gz WTQDDGDCRSPDRS-UHFFFAOYSA-N 0 3 279.384 2.595 20 10 CFCDHN COC[C@@H](NCc1ccccc1O)c1cccc(OC)c1 ZINC000850362626 633956694 /nfs/dbraw/zinc/95/66/94/633956694.db2.gz QPXWQIDEOAUUSR-MRXNPFEDSA-N 0 3 287.359 2.878 20 10 CFCDHN COC[C@@H]([NH2+]Cc1ccccc1[O-])c1cccc(OC)c1 ZINC000850362626 633956698 /nfs/dbraw/zinc/95/66/98/633956698.db2.gz QPXWQIDEOAUUSR-MRXNPFEDSA-N 0 3 287.359 2.878 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H]1C[C@H](O)C1 ZINC000850417537 633983991 /nfs/dbraw/zinc/98/39/91/633983991.db2.gz CFJJJCIISCIJQJ-WKILWMFISA-N 0 3 269.344 2.672 20 10 CFCDHN C[C@@H](O)[C@@H](NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000850420434 633985339 /nfs/dbraw/zinc/98/53/39/633985339.db2.gz OUCCKFUXOWCWEH-FZKQIMNGSA-N 0 3 283.371 2.833 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](COC)C1CCOCC1)c1ccccc1[O-] ZINC000850494904 634018048 /nfs/dbraw/zinc/01/80/48/634018048.db2.gz ZVXHBBQEMCZBOM-CVEARBPZSA-N 0 3 293.407 2.875 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](CO)CC1CC1)c1ccccc1[O-] ZINC000850544170 634046458 /nfs/dbraw/zinc/04/64/58/634046458.db2.gz DCZLUSDCFQBSOZ-HIFRSBDPSA-N 0 3 263.381 2.842 20 10 CFCDHN Nc1cccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000854215151 635258895 /nfs/dbraw/zinc/25/88/95/635258895.db2.gz CHXUOFVOAKQFFR-CQSZACIVSA-N 0 3 254.333 2.752 20 10 CFCDHN Cc1nn(C)c(C)c1CNCc1ccc(N(C)C)cc1C ZINC000115629101 636025473 /nfs/dbraw/zinc/02/54/73/636025473.db2.gz PXEVIOGASUSBRK-UHFFFAOYSA-N 0 3 286.423 2.701 20 10 CFCDHN CC(C)C[C@H](CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858106812 636127224 /nfs/dbraw/zinc/12/72/24/636127224.db2.gz STMWTRWAPSCGRL-GFCCVEGCSA-N 0 3 286.366 2.527 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@H]2CCCCO2)cc1F ZINC000858109745 636128584 /nfs/dbraw/zinc/12/85/84/636128584.db2.gz WLXSGLGGKJHCAU-GFCCVEGCSA-N 0 3 284.350 2.690 20 10 CFCDHN COCC(C)(C)NCc1cc(F)c(N(C)C)cc1F ZINC000858123776 636133288 /nfs/dbraw/zinc/13/32/88/636133288.db2.gz CUOJZFVWTPJZTN-UHFFFAOYSA-N 0 3 272.339 2.545 20 10 CFCDHN CC(C)[C@](C)(O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858133989 636135754 /nfs/dbraw/zinc/13/57/54/636135754.db2.gz FPKMZFROOJIAGT-OAHLLOKOSA-N 0 3 286.366 2.527 20 10 CFCDHN CC[C@@H](O)CCCNCc1cc(F)c(N(C)C)cc1F ZINC000858144767 636137823 /nfs/dbraw/zinc/13/78/23/636137823.db2.gz HGDYGPHRKGANKJ-GFCCVEGCSA-N 0 3 286.366 2.672 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnn2C(C)C)c1 ZINC000858239639 636160562 /nfs/dbraw/zinc/16/05/62/636160562.db2.gz RLYHJUWXMOTREC-UHFFFAOYSA-N 0 3 259.353 2.768 20 10 CFCDHN CN(C)c1ccc(CN(c2ccnc(CO)c2)C2CC2)cc1 ZINC000858358134 636205807 /nfs/dbraw/zinc/20/58/07/636205807.db2.gz MOXGVOPCOIEJDA-UHFFFAOYSA-N 0 3 297.402 2.809 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC=C(C(=O)OC)C1)c1ccccc1[O-] ZINC000858473409 636260218 /nfs/dbraw/zinc/26/02/18/636260218.db2.gz NQVGSYGNOGYIES-GXTWGEPZSA-N 0 3 275.348 2.695 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000858485143 636267523 /nfs/dbraw/zinc/26/75/23/636267523.db2.gz KKFNEESJNCZJKJ-WCQYABFASA-N 0 3 269.360 2.979 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000858504948 636274653 /nfs/dbraw/zinc/27/46/53/636274653.db2.gz BWMLPXNLEQNAJG-WCQYABFASA-N 0 3 275.348 2.695 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)CC(F)F)c1ccccc1[O-] ZINC000858597095 636304148 /nfs/dbraw/zinc/30/41/48/636304148.db2.gz LBYSNGHFJHCQBG-LBPRGKRZSA-N 0 3 272.339 2.630 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)CC2(O)CCCC2)cc1F ZINC000862247539 637298777 /nfs/dbraw/zinc/29/87/77/637298777.db2.gz ZMSVOKRGMKFXCX-UHFFFAOYSA-N 0 3 298.377 2.768 20 10 CFCDHN COc1cccc(O)c1CN1CC(Cc2ccco2)C1 ZINC000862486712 637400766 /nfs/dbraw/zinc/40/07/66/637400766.db2.gz IGMBQMMYFQLTAW-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN Cc1noc(C)c1CC[N@@H+](C)Cc1ccccc1[O-] ZINC000119337911 637590731 /nfs/dbraw/zinc/59/07/31/637590731.db2.gz HWUZTIJELWBDAT-UHFFFAOYSA-N 0 3 260.337 2.672 20 10 CFCDHN Cc1noc(C)c1CC[N@H+](C)Cc1ccccc1[O-] ZINC000119337911 637590735 /nfs/dbraw/zinc/59/07/35/637590735.db2.gz HWUZTIJELWBDAT-UHFFFAOYSA-N 0 3 260.337 2.672 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2ccncc2OC)c1 ZINC000189009655 650356752 /nfs/dbraw/zinc/35/67/52/650356752.db2.gz KDQUOEIPCDGFGK-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN CC[C@@H]1[NH2+]CC[C@H]1N[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000863542883 637690277 /nfs/dbraw/zinc/69/02/77/637690277.db2.gz HVPXNOVNJGCJPE-TVYUQYBPSA-N 0 3 268.788 2.837 20 10 CFCDHN COc1ccc(O)c(CNCc2cc(C)oc2C)c1 ZINC000120518638 638277886 /nfs/dbraw/zinc/27/78/86/638277886.db2.gz ZBZKVXPFFPZTON-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN CC(C)CC[C@](C)(O)C[NH2+]Cc1ccccc1[O-] ZINC000077456025 650426373 /nfs/dbraw/zinc/42/63/73/650426373.db2.gz XZAPXDZRUIYRDD-HNNXBMFYSA-N 0 3 251.370 2.669 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2ccnc(F)c2)c([O-])c1 ZINC000865722565 638535024 /nfs/dbraw/zinc/53/50/24/638535024.db2.gz KUPUNRSDPTXPPA-UHFFFAOYSA-N 0 3 276.311 2.615 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@H](SC)C2)c([O-])c1 ZINC000865734449 638544209 /nfs/dbraw/zinc/54/42/09/638544209.db2.gz YWMFNSOFJQRQBR-AULYBMBSSA-N 0 3 267.394 2.775 20 10 CFCDHN C[C@H](NC/C=C\c1ccc(N(C)C)cc1)c1ccnn1C ZINC000865838237 638603507 /nfs/dbraw/zinc/60/35/07/638603507.db2.gz RXPJNXNOIDHPIM-GXMNPTEKSA-N 0 3 284.407 2.850 20 10 CFCDHN C[C@@H](NC/C=C/c1ccc(N(C)C)cc1)c1ccnn1C ZINC000865838239 638603542 /nfs/dbraw/zinc/60/35/42/638603542.db2.gz RXPJNXNOIDHPIM-VBROQKIQSA-N 0 3 284.407 2.850 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@]23CCC[C@H]2OCC3)cc1F ZINC000865857983 638619332 /nfs/dbraw/zinc/61/93/32/638619332.db2.gz XOMVYYILUHZHAQ-CVEARBPZSA-N 0 3 296.361 2.832 20 10 CFCDHN C[C@H](CCc1cccnc1)[NH2+]Cc1ccccc1[O-] ZINC000866253830 638781459 /nfs/dbraw/zinc/78/14/59/638781459.db2.gz NPCROQMNVWHEIP-CYBMUJFWSA-N 0 3 256.349 2.898 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCn2nccc21)c1cc(F)ccc1[O-] ZINC000866634313 638858565 /nfs/dbraw/zinc/85/85/65/638858565.db2.gz QDQYBZYUAORVFD-MFKMUULPSA-N 0 3 275.327 2.914 20 10 CFCDHN C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1cccnc1 ZINC000078378931 650496756 /nfs/dbraw/zinc/49/67/56/650496756.db2.gz XYVSSPYCXKWUDA-OAHLLOKOSA-N 0 3 297.402 2.769 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000191590525 650512082 /nfs/dbraw/zinc/51/20/82/650512082.db2.gz LEUMUNIPEADMBV-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC(F)F)c([O-])c1 ZINC000194032736 650714117 /nfs/dbraw/zinc/71/41/17/650714117.db2.gz OOGDEXDPPOIJQX-JTQLQIEISA-N 0 3 259.296 2.981 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](O)Cc1cccc(Cl)c1 ZINC000873179139 642051414 /nfs/dbraw/zinc/05/14/14/642051414.db2.gz DXAPCLUEXRTOQU-OAHLLOKOSA-N 0 3 291.778 2.739 20 10 CFCDHN CCCCN(Cc1cnc(N)cn1)Cc1ccccc1O ZINC000873209646 642068578 /nfs/dbraw/zinc/06/85/78/642068578.db2.gz RHSQIVTZBKABPB-UHFFFAOYSA-N 0 3 286.379 2.567 20 10 CFCDHN CCCC[N@H+](Cc1cnc(N)cn1)Cc1ccccc1[O-] ZINC000873209646 642068581 /nfs/dbraw/zinc/06/85/81/642068581.db2.gz RHSQIVTZBKABPB-UHFFFAOYSA-N 0 3 286.379 2.567 20 10 CFCDHN CCCC[N@@H+](Cc1cnc(N)cn1)Cc1ccccc1[O-] ZINC000873209646 642068582 /nfs/dbraw/zinc/06/85/82/642068582.db2.gz RHSQIVTZBKABPB-UHFFFAOYSA-N 0 3 286.379 2.567 20 10 CFCDHN [NH3+][C@@H]1C[C@H]1c1ccc(NCc2cccc(F)c2[O-])cc1 ZINC000873215327 642071712 /nfs/dbraw/zinc/07/17/12/642071712.db2.gz XBMNEQOQOYZDOA-DZGCQCFKSA-N 0 3 272.323 2.958 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000020093243 642298102 /nfs/dbraw/zinc/29/81/02/642298102.db2.gz KVHVOVXZNXQVEN-GFCCVEGCSA-N 0 3 284.359 2.603 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000083551956 650764896 /nfs/dbraw/zinc/76/48/96/650764896.db2.gz NADHYAKTWJCPAC-VXGBXAGGSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000083551956 650764899 /nfs/dbraw/zinc/76/48/99/650764899.db2.gz NADHYAKTWJCPAC-VXGBXAGGSA-N 0 3 280.799 2.762 20 10 CFCDHN CCc1nn(C)cc1CN[C@@H](C)c1cc(OC)ccc1O ZINC000125498867 642649831 /nfs/dbraw/zinc/64/98/31/642649831.db2.gz CRPGCGMTTKMKOB-NSHDSACASA-N 0 3 289.379 2.548 20 10 CFCDHN CCCC(=O)NC1CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000876617980 642948561 /nfs/dbraw/zinc/94/85/61/642948561.db2.gz YJYBJLZJHQJRDS-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000876781130 643005487 /nfs/dbraw/zinc/00/54/87/643005487.db2.gz KAGSOCXMYRHDTQ-KBPBESRZSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000876781130 643005495 /nfs/dbraw/zinc/00/54/95/643005495.db2.gz KAGSOCXMYRHDTQ-KBPBESRZSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876812227 643020371 /nfs/dbraw/zinc/02/03/71/643020371.db2.gz SJEKHVAZRNUNNE-GOEBONIOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876812227 643020376 /nfs/dbraw/zinc/02/03/76/643020376.db2.gz SJEKHVAZRNUNNE-GOEBONIOSA-N 0 3 275.392 2.949 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876916544 643064674 /nfs/dbraw/zinc/06/46/74/643064674.db2.gz CVZJWZRQRLVBER-KRWDZBQOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1cccc(C(=O)NCC[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000876958331 643080549 /nfs/dbraw/zinc/08/05/49/643080549.db2.gz ZGBKFVKVTQLZIR-UHFFFAOYSA-N 0 3 298.386 2.529 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)[C@H](C)c2ccccc2)c([O-])c1 ZINC000877034448 643112744 /nfs/dbraw/zinc/11/27/44/643112744.db2.gz IFBBMXJEAFFDPG-PBHICJAKSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@H](C)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877066406 643131709 /nfs/dbraw/zinc/13/17/09/643131709.db2.gz LAMVMJVLBFUXKA-LBPRGKRZSA-N 0 3 287.407 2.772 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)c2ccncc2)c([O-])c1 ZINC000877076339 643138301 /nfs/dbraw/zinc/13/83/01/643138301.db2.gz VVGOYJSFGGCZAW-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)c([O-])c1 ZINC000877117578 643160048 /nfs/dbraw/zinc/16/00/48/643160048.db2.gz JOQDESFDZQYSMV-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2COC3(CCCCC3)O2)c([O-])c1 ZINC000877136659 643171821 /nfs/dbraw/zinc/17/18/21/643171821.db2.gz JFUAKAUXWFMWMQ-OAHLLOKOSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000877166953 643185224 /nfs/dbraw/zinc/18/52/24/643185224.db2.gz JKBIRTVQRCFGEL-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000877166953 643185227 /nfs/dbraw/zinc/18/52/27/643185227.db2.gz JKBIRTVQRCFGEL-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000877166950 643185508 /nfs/dbraw/zinc/18/55/08/643185508.db2.gz JKBIRTVQRCFGEL-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000877166950 643185512 /nfs/dbraw/zinc/18/55/12/643185512.db2.gz JKBIRTVQRCFGEL-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN COC(=O)C1(C[NH2+]Cc2c(C)cccc2[O-])CCCC1 ZINC000877312544 643233365 /nfs/dbraw/zinc/23/33/65/643233365.db2.gz KMYLGXHBXJELSJ-UHFFFAOYSA-N 0 3 277.364 2.524 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](C3(C)OCCO3)C2)c([O-])c1 ZINC000877316345 643234136 /nfs/dbraw/zinc/23/41/36/643234136.db2.gz VNQDQRJFWWDYDD-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c([O-])c1 ZINC000877316345 643234140 /nfs/dbraw/zinc/23/41/40/643234140.db2.gz VNQDQRJFWWDYDD-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCc2ccncc2)c([O-])c1 ZINC000877319362 643237165 /nfs/dbraw/zinc/23/71/65/643237165.db2.gz WVICGHVCHQCNJZ-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCc2ccncc2)c([O-])c1 ZINC000877319362 643237170 /nfs/dbraw/zinc/23/71/70/643237170.db2.gz WVICGHVCHQCNJZ-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN COC(=O)CCC(C)(C)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877356114 643246069 /nfs/dbraw/zinc/24/60/69/643246069.db2.gz FQANEDNIWMQVIO-UHFFFAOYSA-N 0 3 265.353 2.522 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(C)CCO[C@@H]1C1CC1 ZINC000877395689 643258197 /nfs/dbraw/zinc/25/81/97/643258197.db2.gz LZIGCADOTHEWAE-SJORKVTESA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000877395973 643258852 /nfs/dbraw/zinc/25/88/52/643258852.db2.gz PWLRLUUXYKOWPI-SJORKVTESA-N 0 3 275.392 2.995 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877396169 643258950 /nfs/dbraw/zinc/25/89/50/643258950.db2.gz SXBFBYGGJFUQNO-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877396169 643258953 /nfs/dbraw/zinc/25/89/53/643258953.db2.gz SXBFBYGGJFUQNO-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877438526 643272593 /nfs/dbraw/zinc/27/25/93/643272593.db2.gz KGIUQPQCOMJNQR-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877438526 643272600 /nfs/dbraw/zinc/27/26/00/643272600.db2.gz KGIUQPQCOMJNQR-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCSC[C@@H](C)C1 ZINC000877474961 643293103 /nfs/dbraw/zinc/29/31/03/643293103.db2.gz KJOSYZDYCOLJTA-NSHDSACASA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCSC[C@@H](C)C1 ZINC000877474961 643293110 /nfs/dbraw/zinc/29/31/10/643293110.db2.gz KJOSYZDYCOLJTA-NSHDSACASA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](C)NC(=O)OC(C)(C)C ZINC000877487261 643301739 /nfs/dbraw/zinc/30/17/39/643301739.db2.gz ROPUMJIFTPSLCA-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN COc1ccc(C[NH2+]Cc2c(C)cccc2O)c([O-])c1 ZINC000877494492 643307179 /nfs/dbraw/zinc/30/71/79/643307179.db2.gz XIVAGIZQPNQPQY-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCc3cccnc3CC2)c([O-])c1 ZINC000877494120 643307844 /nfs/dbraw/zinc/30/78/44/643307844.db2.gz SWULUUVZXAQBGC-OAHLLOKOSA-N 0 3 298.386 2.833 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530729 643335373 /nfs/dbraw/zinc/33/53/73/643335373.db2.gz GSURZGRJJGQLTI-RISCZKNCSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2ccc(F)c(F)c2[O-])C1 ZINC000877530729 643335379 /nfs/dbraw/zinc/33/53/79/643335379.db2.gz GSURZGRJJGQLTI-RISCZKNCSA-N 0 3 296.361 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)c([O-])c1 ZINC000877540284 643342867 /nfs/dbraw/zinc/34/28/67/643342867.db2.gz VLAKWTDZTSNZIS-HKUYNNGSSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CC2)C(C)(C)CO)c([O-])c1 ZINC000877542124 643343569 /nfs/dbraw/zinc/34/35/69/643343569.db2.gz VXZQWCNUORJRPO-HNNXBMFYSA-N 0 3 263.381 2.587 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])OC ZINC000877559544 643360493 /nfs/dbraw/zinc/36/04/93/643360493.db2.gz YWYZOADRQBJIKY-IUODEOHRSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([O-])c1 ZINC000877563336 643362952 /nfs/dbraw/zinc/36/29/52/643362952.db2.gz JOFZNWBAIBQZRR-BZUAXINKSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([O-])c1 ZINC000877563336 643362961 /nfs/dbraw/zinc/36/29/61/643362961.db2.gz JOFZNWBAIBQZRR-BZUAXINKSA-N 0 3 275.392 2.826 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])CC1 ZINC000877577336 643374522 /nfs/dbraw/zinc/37/45/22/643374522.db2.gz VTZFNNSJBMCPCT-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])CC1 ZINC000877577336 643374524 /nfs/dbraw/zinc/37/45/24/643374524.db2.gz VTZFNNSJBMCPCT-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(CN2CCO[C@H](C3CCC3)C2)c(O)c1 ZINC000877588001 643382915 /nfs/dbraw/zinc/38/29/15/643382915.db2.gz UBBCRLJMHOYJMF-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccncc1CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877625108 643410520 /nfs/dbraw/zinc/41/05/20/643410520.db2.gz VTGDDLHSIFFZTF-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@H]1[NH2+]Cc1c(C)cccc1[O-] ZINC000877640028 643423675 /nfs/dbraw/zinc/42/36/75/643423675.db2.gz SDTWRAAHLFXEHN-WBVHZDCISA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2c3ccccc3C(=O)N2C)c([O-])c1 ZINC000877657141 643436902 /nfs/dbraw/zinc/43/69/02/643436902.db2.gz WWEJZAMUHNDPTQ-INIZCTEOSA-N 0 3 296.370 2.617 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CC(C)(C)CC[C@H]2O)c([O-])c1 ZINC000877683644 643452269 /nfs/dbraw/zinc/45/22/69/643452269.db2.gz GJCFQUQPMYEAGE-ZIAGYGMSSA-N 0 3 263.381 2.730 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000877727639 643488507 /nfs/dbraw/zinc/48/85/07/643488507.db2.gz DXPAMABHLLGQME-AWEZNQCLSA-N 0 3 275.392 2.997 20 10 CFCDHN C[C@@H]([NH2+]C1CC(n2cccn2)C1)c1ccccc1[O-] ZINC000877755871 643536018 /nfs/dbraw/zinc/53/60/18/643536018.db2.gz PRBYSLLLPAEWDE-PNESKVBLSA-N 0 3 257.337 2.643 20 10 CFCDHN COC(=O)C(C)(C)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877757348 643537080 /nfs/dbraw/zinc/53/70/80/643537080.db2.gz RWSDGZODJIMLDH-NSHDSACASA-N 0 3 265.353 2.632 20 10 CFCDHN COCCc1ncc(C[NH2+][C@@H](C)c2ccccc2[O-])s1 ZINC000877758313 643538568 /nfs/dbraw/zinc/53/85/68/643538568.db2.gz SGEIAPIFBQJUCD-NSHDSACASA-N 0 3 292.404 2.888 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccccc1[O-] ZINC000877758149 643538782 /nfs/dbraw/zinc/53/87/82/643538782.db2.gz KUEUYKHNWONHDH-STQMWFEESA-N 0 3 262.397 2.916 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCn1ccc(C(F)(F)F)n1 ZINC000877804631 643565776 /nfs/dbraw/zinc/56/57/76/643565776.db2.gz CAHZNJLTCNZSHJ-UHFFFAOYSA-N 0 3 299.296 2.706 20 10 CFCDHN Cc1ccc(C[NH2+]CCn2ccc(C(F)(F)F)n2)c([O-])c1 ZINC000877806138 643567800 /nfs/dbraw/zinc/56/78/00/643567800.db2.gz NQAFEOKJRPWJKB-UHFFFAOYSA-N 0 3 299.296 2.706 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000877820205 643587324 /nfs/dbraw/zinc/58/73/24/643587324.db2.gz CNICFOWGVWRPFR-ZDUSSCGKSA-N 0 3 277.364 2.557 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000877820205 643587326 /nfs/dbraw/zinc/58/73/26/643587326.db2.gz CNICFOWGVWRPFR-ZDUSSCGKSA-N 0 3 277.364 2.557 20 10 CFCDHN CCOC(=O)[C@@H](C)C1CN(Cc2cc(C)c(C)cc2O)C1 ZINC000877829223 643594454 /nfs/dbraw/zinc/59/44/54/643594454.db2.gz RJRIYZYLIFDOQE-ZDUSSCGKSA-N 0 3 291.391 2.640 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(CCOCC2)O1 ZINC000878241255 643804399 /nfs/dbraw/zinc/80/43/99/643804399.db2.gz CMSJJELMGPOUEP-HNNXBMFYSA-N 0 3 291.391 2.552 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(CCOCC2)O1 ZINC000878241255 643804403 /nfs/dbraw/zinc/80/44/03/643804403.db2.gz CMSJJELMGPOUEP-HNNXBMFYSA-N 0 3 291.391 2.552 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000878242465 643804748 /nfs/dbraw/zinc/80/47/48/643804748.db2.gz RTOKKGXGVUIRRV-NOLJZWGESA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000878242465 643804755 /nfs/dbraw/zinc/80/47/55/643804755.db2.gz RTOKKGXGVUIRRV-NOLJZWGESA-N 0 3 261.365 2.782 20 10 CFCDHN CC(C)C[C@@H](C)N(C)C(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648386 644361638 /nfs/dbraw/zinc/36/16/38/644361638.db2.gz MILSQKFANFJUQZ-ZIAGYGMSSA-N 0 3 292.423 2.936 20 10 CFCDHN CC(C)CN(C(=O)C[NH2+][C@H](C)c1ccccc1[O-])C1CC1 ZINC000879648154 644361694 /nfs/dbraw/zinc/36/16/94/644361694.db2.gz AFHODKRAGFEOIU-CYBMUJFWSA-N 0 3 290.407 2.690 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1)c1ccccc1[O-] ZINC000879647825 644361794 /nfs/dbraw/zinc/36/17/94/644361794.db2.gz MODHKISOLJJKCH-HZSPNIEDSA-N 0 3 290.407 2.547 20 10 CFCDHN CCC(C)(C)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649074 644363103 /nfs/dbraw/zinc/36/31/03/644363103.db2.gz LHFAWKFPFRAXTM-NEPJUHHUSA-N 0 3 278.396 2.736 20 10 CFCDHN CCCCOC(=O)CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648751 644363349 /nfs/dbraw/zinc/36/33/49/644363349.db2.gz CFFRRQLUAYAPJX-GFCCVEGCSA-N 0 3 265.353 2.776 20 10 CFCDHN CC(C)N(C(=O)C[NH2+][C@@H](C)c1ccccc1[O-])C(C)C ZINC000879652711 644366343 /nfs/dbraw/zinc/36/63/43/644366343.db2.gz GUJCWCSYNFXRPS-ZDUSSCGKSA-N 0 3 278.396 2.688 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N[C@H]1CCCC[C@H]1C)c1ccccc1[O-] ZINC000879652591 644366472 /nfs/dbraw/zinc/36/64/72/644366472.db2.gz GCTNYFIJNOJTJK-IPYPFGDCSA-N 0 3 290.407 2.738 20 10 CFCDHN CCN(CC)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094616689 650959963 /nfs/dbraw/zinc/95/99/63/650959963.db2.gz OJEVWAIHTXEMHA-NSHDSACASA-N 0 3 254.349 2.524 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618030 650960380 /nfs/dbraw/zinc/96/03/80/650960380.db2.gz YFJIWNZXTJSDDR-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@@H]([NH2+]CCCCn1ccnc1)c1cc(F)ccc1[O-] ZINC000094618012 650960526 /nfs/dbraw/zinc/96/05/26/650960526.db2.gz BKLCJDFZRGPJEW-GFCCVEGCSA-N 0 3 277.343 2.859 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)c(F)c1 ZINC000303977643 651010674 /nfs/dbraw/zinc/01/06/74/651010674.db2.gz CYWOAUDMFGRAMM-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)c(F)c1 ZINC000303977643 651010678 /nfs/dbraw/zinc/01/06/78/651010678.db2.gz CYWOAUDMFGRAMM-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)Cc1ccoc1)c1cc(F)ccc1[O-] ZINC000883275914 645717372 /nfs/dbraw/zinc/71/73/72/645717372.db2.gz CLFXJJPEMYTMOD-WCQYABFASA-N 0 3 293.338 2.626 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)C(F)(F)C(F)(F)F)c1ccccc1[O-] ZINC000883359497 645766388 /nfs/dbraw/zinc/76/63/88/645766388.db2.gz HSQJTZGHZJVDKU-XCBNKYQSSA-N 0 3 299.239 2.601 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CCC3(COC3)CC2)c([O-])c1 ZINC000883391715 645790278 /nfs/dbraw/zinc/79/02/78/645790278.db2.gz QOKXXRGPIUHCEO-UHFFFAOYSA-N 0 3 291.391 2.840 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1c([O-])cccc1F ZINC000886501677 647021335 /nfs/dbraw/zinc/02/13/35/647021335.db2.gz TYDRPUWTIPCFMN-NWDGAFQWSA-N 0 3 278.371 2.666 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@H](C)c2c([O-])cccc2F)C1 ZINC000886506132 647023489 /nfs/dbraw/zinc/02/34/89/647023489.db2.gz CZLFYRHDMZGDQD-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886603691 647063243 /nfs/dbraw/zinc/06/32/43/647063243.db2.gz UGWAMENMILDZRE-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000886670675 647101878 /nfs/dbraw/zinc/10/18/78/647101878.db2.gz UFVRFMMKHMCGGL-DZKIICNBSA-N 0 3 293.407 2.671 20 10 CFCDHN CCC1([NH3+])CCN([C@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000925761305 648311449 /nfs/dbraw/zinc/31/14/49/648311449.db2.gz ZBIBLYKTCYZVCB-SNVBAGLBSA-N 0 3 284.350 2.935 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(COC2)O1 ZINC000929753081 649111853 /nfs/dbraw/zinc/11/18/53/649111853.db2.gz KGLBKXNJHHLFAO-HNNXBMFYSA-N 0 3 291.391 2.552 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(COC2)O1 ZINC000929753081 649111857 /nfs/dbraw/zinc/11/18/57/649111857.db2.gz KGLBKXNJHHLFAO-HNNXBMFYSA-N 0 3 291.391 2.552 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@@H]1C[N@H+](C)Cc1ccccc1[O-] ZINC000929977836 649159488 /nfs/dbraw/zinc/15/94/88/649159488.db2.gz XCEOIJCOHBVMRO-HIFRSBDPSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccccc1[O-] ZINC000929977836 649159491 /nfs/dbraw/zinc/15/94/91/649159491.db2.gz XCEOIJCOHBVMRO-HIFRSBDPSA-N 0 3 291.391 2.803 20 10 CFCDHN CC[C@@](O)(C[NH2+][C@H](C)c1ccccc1[O-])C(F)(F)F ZINC000931554368 649453730 /nfs/dbraw/zinc/45/37/30/649453730.db2.gz ORBJGMMTDPZGGE-BXKDBHETSA-N 0 3 277.286 2.746 20 10 CFCDHN Cc1nnsc1[C@H](C)N[C@@H](C)c1ccccc1O ZINC000931555390 649453829 /nfs/dbraw/zinc/45/38/29/649453829.db2.gz YNMJWBNNBMPGKI-IUCAKERBSA-N 0 3 263.366 2.964 20 10 CFCDHN CCN(CC[NH2+]Cc1c([O-])cccc1Cl)C(C)C ZINC000113333028 651191842 /nfs/dbraw/zinc/19/18/42/651191842.db2.gz VDDAGYBTAQEYLD-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN Cc1ccc(C)c(CN2CCCC(=O)[C@H](C)C2)c1O ZINC001140178138 770259714 /nfs/dbraw/zinc/25/97/14/770259714.db2.gz AFUDSIZNIORRLX-CYBMUJFWSA-N 0 3 261.365 2.810 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C2CC2)[C@@H]2CCCOC2)c1 ZINC000724011805 770749068 /nfs/dbraw/zinc/74/90/68/770749068.db2.gz SCAJJJKPFHCUJS-PBHICJAKSA-N 0 3 275.392 2.995 20 10 CFCDHN C[C@@H]([NH2+]CCO[C@H]1CC1(F)F)c1cc(F)ccc1[O-] ZINC000690725612 770778485 /nfs/dbraw/zinc/77/84/85/770778485.db2.gz GQCASPPLRUIJEI-PELKAZGASA-N 0 3 275.270 2.606 20 10 CFCDHN Oc1ccc(O)c(CN2CC[C@@H](F)C(F)(F)CC2)c1 ZINC001141156378 775962556 /nfs/dbraw/zinc/96/25/56/775962556.db2.gz VNRVQMAYFVCWST-GFCCVEGCSA-N 0 3 275.270 2.667 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1SCCS1)CC2 ZINC000692902045 776580899 /nfs/dbraw/zinc/58/08/99/776580899.db2.gz HVVBSPHHTDKLGN-JTQLQIEISA-N 0 3 267.419 2.775 20 10 CFCDHN CO[C@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587689 777269674 /nfs/dbraw/zinc/26/96/74/777269674.db2.gz HEDVVZBPFRCXAW-HOCLYGCPSA-N 0 3 275.323 2.714 20 10 CFCDHN CO[C@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587689 777269682 /nfs/dbraw/zinc/26/96/82/777269682.db2.gz HEDVVZBPFRCXAW-HOCLYGCPSA-N 0 3 275.323 2.714 20 10 CFCDHN CO[C@H]1CN(Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC001231587689 777269691 /nfs/dbraw/zinc/26/96/91/777269691.db2.gz HEDVVZBPFRCXAW-HOCLYGCPSA-N 0 3 275.323 2.714 20 10 CFCDHN Cc1ccc2c(n1)N(C)CCN(Cc1cccc(C)c1O)C2 ZINC001231591475 777271842 /nfs/dbraw/zinc/27/18/42/777271842.db2.gz DPLUZGHKBJLEAN-UHFFFAOYSA-N 0 3 297.402 2.856 20 10 CFCDHN CC(=O)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231590958 777271893 /nfs/dbraw/zinc/27/18/93/777271893.db2.gz ROUNNBJRXSXXKM-CQSZACIVSA-N 0 3 269.344 2.956 20 10 CFCDHN CC(=O)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231590958 777271899 /nfs/dbraw/zinc/27/18/99/777271899.db2.gz ROUNNBJRXSXXKM-CQSZACIVSA-N 0 3 269.344 2.956 20 10 CFCDHN CCOC(=O)C1(F)CCN(Cc2cccc(C)c2O)CC1 ZINC001231591753 777272018 /nfs/dbraw/zinc/27/20/18/777272018.db2.gz CEARTIZPGRYWFT-UHFFFAOYSA-N 0 3 295.354 2.568 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001231841871 777344517 /nfs/dbraw/zinc/34/45/17/777344517.db2.gz FIMOKORUQUXCST-RHSMWYFYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001231841871 777344520 /nfs/dbraw/zinc/34/45/20/777344520.db2.gz FIMOKORUQUXCST-RHSMWYFYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001231842790 777346256 /nfs/dbraw/zinc/34/62/56/777346256.db2.gz PTMYZBNOXDMAEK-YOEHRIQHSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001231842790 777346259 /nfs/dbraw/zinc/34/62/59/777346259.db2.gz PTMYZBNOXDMAEK-YOEHRIQHSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@]2(CCCO2)C1 ZINC001231852416 777352306 /nfs/dbraw/zinc/35/23/06/777352306.db2.gz UPJPNIYNDRQNCN-QGZVFWFLSA-N 0 3 290.407 2.516 20 10 CFCDHN CCN(Cc1cncc(O)c1)Cc1ccccc1O ZINC001232042985 777422067 /nfs/dbraw/zinc/42/20/67/777422067.db2.gz CMVUMLUGHZBTMI-UHFFFAOYSA-N 0 3 258.321 2.515 20 10 CFCDHN CCN(CC)Cc1c2ccccc2n(C)c1C(=O)OC ZINC001232401733 777549362 /nfs/dbraw/zinc/54/93/62/777549362.db2.gz NXEKKTHTIMACFZ-UHFFFAOYSA-N 0 3 274.364 2.807 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](O)[C@H](C)C2)c1[O-] ZINC001233288084 777868422 /nfs/dbraw/zinc/86/84/22/777868422.db2.gz VASHECYYYGQRBY-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](O)[C@H](C)C2)c1[O-] ZINC001233288084 777868432 /nfs/dbraw/zinc/86/84/32/777868432.db2.gz VASHECYYYGQRBY-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@@H]1CC[N@@H+]1Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727656 778057219 /nfs/dbraw/zinc/05/72/19/778057219.db2.gz NUUNVZCTWWHKLD-MRVPVSSYSA-N 0 3 261.243 2.885 20 10 CFCDHN C[C@@H]1CC[N@H+]1Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727656 778057236 /nfs/dbraw/zinc/05/72/36/778057236.db2.gz NUUNVZCTWWHKLD-MRVPVSSYSA-N 0 3 261.243 2.885 20 10 CFCDHN C[N@H+](Cc1cccc(OC(F)(F)F)c1[O-])[C@@H]1CCOC1 ZINC001233760612 778067988 /nfs/dbraw/zinc/06/79/88/778067988.db2.gz JAXQIRQWEROBGN-SNVBAGLBSA-N 0 3 291.269 2.512 20 10 CFCDHN C[N@@H+](Cc1cccc(OC(F)(F)F)c1[O-])[C@@H]1CCOC1 ZINC001233760612 778067999 /nfs/dbraw/zinc/06/79/99/778067999.db2.gz JAXQIRQWEROBGN-SNVBAGLBSA-N 0 3 291.269 2.512 20 10 CFCDHN C[C@@H]1C[NH2+][C@@H](C)CN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001235450748 778493972 /nfs/dbraw/zinc/49/39/72/778493972.db2.gz WAKPTGHXIXOXSQ-VHSXEESVSA-N 0 3 288.313 2.593 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH2+][C@H](C(C)C)C2)cc1Cl ZINC001235471733 778501177 /nfs/dbraw/zinc/50/11/77/778501177.db2.gz KPTJFNAYMWWQQQ-AWEZNQCLSA-N 0 3 282.815 2.784 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC3(COC3)C2)c([O-])c1 ZINC001235682842 778535923 /nfs/dbraw/zinc/53/59/23/778535923.db2.gz QQGIWIMSFKOTLN-UHFFFAOYSA-N 0 3 275.392 2.912 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC3(COC3)C2)c([O-])c1 ZINC001235682842 778535925 /nfs/dbraw/zinc/53/59/25/778535925.db2.gz QQGIWIMSFKOTLN-UHFFFAOYSA-N 0 3 275.392 2.912 20 10 CFCDHN Cc1cc(CN2C[C@@H](N)[C@@H](F)C2)c(C)n1-c1ccccc1 ZINC001235894413 778594936 /nfs/dbraw/zinc/59/49/36/778594936.db2.gz ZSIOTIHMIJJSKA-DLBZAZTESA-N 0 3 287.382 2.575 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[NH2+][C@@H](C)C2)cc1Cl ZINC001236095451 778690085 /nfs/dbraw/zinc/69/00/85/778690085.db2.gz UNAKQWJEAVVUBW-NSHDSACASA-N 0 3 268.788 2.538 20 10 CFCDHN Cc1cc([O-])c(CN(C)[C@@]2(C)CCC[NH2+]C2)cc1Cl ZINC001236207411 778735876 /nfs/dbraw/zinc/73/58/76/778735876.db2.gz PTZKCXZNCBPMKT-HNNXBMFYSA-N 0 3 282.815 2.928 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3[NH2+]C[C@H]3C2)cc1Cl ZINC001236286470 778761789 /nfs/dbraw/zinc/76/17/89/778761789.db2.gz NDQXLECPDLIPKE-FZMZJTMJSA-N 0 3 294.826 2.747 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)[NH2+][C@@H](C)C2)cc1Cl ZINC001236425737 778820391 /nfs/dbraw/zinc/82/03/91/778820391.db2.gz ZCJQFBOQVVKOLK-QWRGUYRKSA-N 0 3 268.788 2.536 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H](CO)CC[C@@H]2C)c([O-])c1 ZINC001236782748 778933176 /nfs/dbraw/zinc/93/31/76/778933176.db2.gz DPVCGAIMHMOTQF-JSGCOSHPSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H](CO)CC[C@@H]2C)c([O-])c1 ZINC001236782748 778933181 /nfs/dbraw/zinc/93/31/81/778933181.db2.gz DPVCGAIMHMOTQF-JSGCOSHPSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236782841 778933389 /nfs/dbraw/zinc/93/33/89/778933389.db2.gz FNTXOKQPAOSTND-DYVFJYSZSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236782841 778933391 /nfs/dbraw/zinc/93/33/91/778933391.db2.gz FNTXOKQPAOSTND-DYVFJYSZSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(COC)CC2)c([O-])c1 ZINC001236783582 778935362 /nfs/dbraw/zinc/93/53/62/778935362.db2.gz MJAJUHMSICQUSK-UHFFFAOYSA-N 0 3 263.381 2.813 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC001236786665 778936057 /nfs/dbraw/zinc/93/60/57/778936057.db2.gz DPEPVJGIZOXFEB-DOMZBBRYSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC001236786665 778936060 /nfs/dbraw/zinc/93/60/60/778936060.db2.gz DPEPVJGIZOXFEB-DOMZBBRYSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](C)C[C@@H](C(=O)OC)C2)c([O-])c1 ZINC001236787301 778936913 /nfs/dbraw/zinc/93/69/13/778936913.db2.gz ATLXCSFHZJPUMB-IUODEOHRSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](C)C[C@@H](C(=O)OC)C2)c([O-])c1 ZINC001236787301 778936920 /nfs/dbraw/zinc/93/69/20/778936920.db2.gz ATLXCSFHZJPUMB-IUODEOHRSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@]3(CCO3)C2)c([O-])c1 ZINC001236787255 778937242 /nfs/dbraw/zinc/93/72/42/778937242.db2.gz AQOSAWIKTOJPNT-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@]3(CCO3)C2)c([O-])c1 ZINC001236787255 778937246 /nfs/dbraw/zinc/93/72/46/778937246.db2.gz AQOSAWIKTOJPNT-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](CCO)C2)c([O-])c1 ZINC001236794431 778938674 /nfs/dbraw/zinc/93/86/74/778938674.db2.gz MRHJJDUHLLNBMK-CQSZACIVSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](CCO)C2)c([O-])c1 ZINC001236794431 778938678 /nfs/dbraw/zinc/93/86/78/778938678.db2.gz MRHJJDUHLLNBMK-CQSZACIVSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC001236795667 778941761 /nfs/dbraw/zinc/94/17/61/778941761.db2.gz YNEIUARKJYMYOF-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC001236795667 778941767 /nfs/dbraw/zinc/94/17/67/778941767.db2.gz YNEIUARKJYMYOF-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@](C)(CF)C2)c([O-])c1 ZINC001236807669 778947047 /nfs/dbraw/zinc/94/70/47/778947047.db2.gz IPQXTZUQDDZHFT-HNNXBMFYSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@](C)(CF)C2)c([O-])c1 ZINC001236807669 778947052 /nfs/dbraw/zinc/94/70/52/778947052.db2.gz IPQXTZUQDDZHFT-HNNXBMFYSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236808274 778948399 /nfs/dbraw/zinc/94/83/99/778948399.db2.gz OHKJNZNGVYFVSU-SUMWQHHRSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236808274 778948406 /nfs/dbraw/zinc/94/84/06/778948406.db2.gz OHKJNZNGVYFVSU-SUMWQHHRSA-N 0 3 291.391 2.710 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])CC[C@H]1O ZINC001236827672 778956551 /nfs/dbraw/zinc/95/65/51/778956551.db2.gz VRAAYYVXIMVEJB-BLLLJJGKSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])CC[C@H]1O ZINC001236827672 778956553 /nfs/dbraw/zinc/95/65/53/778956553.db2.gz VRAAYYVXIMVEJB-BLLLJJGKSA-N 0 3 271.360 2.748 20 10 CFCDHN CN1CC[C@H]2C[N@H+](Cc3cc4ccccc4cc3[O-])C[C@H]21 ZINC001236831301 778957841 /nfs/dbraw/zinc/95/78/41/778957841.db2.gz GHQQUIJIQFXETM-DOTOQJQBSA-N 0 3 282.387 2.681 20 10 CFCDHN CN1CC[C@H]2C[N@@H+](Cc3cc4ccccc4cc3[O-])C[C@H]21 ZINC001236831301 778957844 /nfs/dbraw/zinc/95/78/44/778957844.db2.gz GHQQUIJIQFXETM-DOTOQJQBSA-N 0 3 282.387 2.681 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@](C)(F)C2)c(O)c1 ZINC001232835735 778982808 /nfs/dbraw/zinc/98/28/08/778982808.db2.gz GRTIIIQKZOSNFE-OAHLLOKOSA-N 0 3 266.360 2.782 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001237050607 778999902 /nfs/dbraw/zinc/99/99/02/778999902.db2.gz SDPUYLSWVJGKRK-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001237050607 778999905 /nfs/dbraw/zinc/99/99/05/778999905.db2.gz SDPUYLSWVJGKRK-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CCC(CO)CC2)c([O-])c1 ZINC001237051488 779000000 /nfs/dbraw/zinc/00/00/00/779000000.db2.gz LTWKMCZSDZKWDD-UHFFFAOYSA-N 0 3 263.381 2.720 20 10 CFCDHN CN(C)c1ccc(CN2CCNC3=CCCC[C@H]32)cc1 ZINC001237218117 779050832 /nfs/dbraw/zinc/05/08/32/779050832.db2.gz FJMDVTKVBMLPDQ-QGZVFWFLSA-N 0 3 271.408 2.594 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237405487 779099035 /nfs/dbraw/zinc/09/90/35/779099035.db2.gz QTADSORATFSDOU-SMDDNHRTSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@]2(C1)CCCCO2 ZINC001237486258 779117750 /nfs/dbraw/zinc/11/77/50/779117750.db2.gz ZTDCUIVCSHLPKI-MRXNPFEDSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@]2(C1)CCCCO2 ZINC001237486258 779117753 /nfs/dbraw/zinc/11/77/53/779117753.db2.gz ZTDCUIVCSHLPKI-MRXNPFEDSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C)[C@@](C)(O)CC1 ZINC001237485810 779118317 /nfs/dbraw/zinc/11/83/17/779118317.db2.gz UGFYMIUOSRAYDW-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C)[C@@](C)(O)CC1 ZINC001237485810 779118318 /nfs/dbraw/zinc/11/83/18/779118318.db2.gz UGFYMIUOSRAYDW-BBRMVZONSA-N 0 3 263.381 2.684 20 10 CFCDHN COc1cc2c(cn1)CCN(Cc1c(C)cccc1O)C2 ZINC001237494873 779120608 /nfs/dbraw/zinc/12/06/08/779120608.db2.gz MKACXAVWMMWRBH-UHFFFAOYSA-N 0 3 284.359 2.663 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC3(COC3)CC2)c1[O-] ZINC001237681110 779159507 /nfs/dbraw/zinc/15/95/07/779159507.db2.gz LCZMAUKDBYKFBQ-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(CO)C2)c1[O-] ZINC001237681855 779160680 /nfs/dbraw/zinc/16/06/80/779160680.db2.gz UDCJTROPWNUSHU-CQSZACIVSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(CO)C2)c1[O-] ZINC001237681855 779160682 /nfs/dbraw/zinc/16/06/82/779160682.db2.gz UDCJTROPWNUSHU-CQSZACIVSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C2CCOCC2)c1[O-] ZINC001237681373 779160773 /nfs/dbraw/zinc/16/07/73/779160773.db2.gz OCJWBIAZZRAJKK-UHFFFAOYSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C2CCOCC2)c1[O-] ZINC001237681373 779160778 /nfs/dbraw/zinc/16/07/78/779160778.db2.gz OCJWBIAZZRAJKK-UHFFFAOYSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](O)[C@@H](F)CC2)c1[O-] ZINC001237681380 779160837 /nfs/dbraw/zinc/16/08/37/779160837.db2.gz ONNHXZCNZWFBRO-STQMWFEESA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](O)[C@@H](F)CC2)c1[O-] ZINC001237681380 779160842 /nfs/dbraw/zinc/16/08/42/779160842.db2.gz ONNHXZCNZWFBRO-STQMWFEESA-N 0 3 287.762 2.649 20 10 CFCDHN C[C@@H]1COCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933627 779209599 /nfs/dbraw/zinc/20/95/99/779209599.db2.gz FDGBISLGHXSQOK-VIFPVBQESA-N 0 3 273.735 2.653 20 10 CFCDHN C[C@@H]1COCC[N@@H+](Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933627 779209603 /nfs/dbraw/zinc/20/96/03/779209603.db2.gz FDGBISLGHXSQOK-VIFPVBQESA-N 0 3 273.735 2.653 20 10 CFCDHN Cc1cc(F)cc(CN(CCO)Cc2cccs2)c1O ZINC001238062853 779242192 /nfs/dbraw/zinc/24/21/92/779242192.db2.gz SWYBDQZWXJPZQS-UHFFFAOYSA-N 0 3 295.379 2.896 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1[O-] ZINC001238061070 779242763 /nfs/dbraw/zinc/24/27/63/779242763.db2.gz MUIWRUIBQVANIK-TVYUQYBPSA-N 0 3 253.292 2.772 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1[O-] ZINC001238061070 779242766 /nfs/dbraw/zinc/24/27/66/779242766.db2.gz MUIWRUIBQVANIK-TVYUQYBPSA-N 0 3 253.292 2.772 20 10 CFCDHN CCN(Cc1ccccc1O)Cc1cncnc1C ZINC001238175686 779269528 /nfs/dbraw/zinc/26/95/28/779269528.db2.gz QGOHOUCTKKDIHT-UHFFFAOYSA-N 0 3 257.337 2.513 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236786669 779637281 /nfs/dbraw/zinc/63/72/81/779637281.db2.gz DPEPVJGIZOXFEB-WFASDCNBSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236786669 779637287 /nfs/dbraw/zinc/63/72/87/779637287.db2.gz DPEPVJGIZOXFEB-WFASDCNBSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236786667 779637964 /nfs/dbraw/zinc/63/79/64/779637964.db2.gz DPEPVJGIZOXFEB-SWLSCSKDSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236786667 779637967 /nfs/dbraw/zinc/63/79/67/779637967.db2.gz DPEPVJGIZOXFEB-SWLSCSKDSA-N 0 3 263.381 2.954 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@@H](C)C1 ZINC001238065848 779739033 /nfs/dbraw/zinc/73/90/33/779739033.db2.gz FQDLTDXBRXLHPR-SMDDNHRTSA-N 0 3 267.344 2.839 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@@H](C)C1 ZINC001238065848 779739042 /nfs/dbraw/zinc/73/90/42/779739042.db2.gz FQDLTDXBRXLHPR-SMDDNHRTSA-N 0 3 267.344 2.839 20 10 CFCDHN CCOC1CCC([NH2+]Cc2ccc(OC)cc2[O-])CC1 ZINC000703804125 781064823 /nfs/dbraw/zinc/06/48/23/781064823.db2.gz LGCIAVXXTFQZAM-UHFFFAOYSA-N 0 3 279.380 2.838 20 10 CFCDHN COC1CCC([NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000703826623 781067856 /nfs/dbraw/zinc/06/78/56/781067856.db2.gz HKHVIYHFJZLVCI-JXQTWKCFSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CCC1)[C@H]1CCOC1 ZINC000711832345 781474851 /nfs/dbraw/zinc/47/48/51/781474851.db2.gz GQNGGHKLXLPGKS-HOCLYGCPSA-N 0 3 261.365 2.687 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]CCCO ZINC000067697191 346814593 /nfs/dbraw/zinc/81/45/93/346814593.db2.gz LMWHRUXBXGUTSY-UHFFFAOYSA-N 0 3 257.333 2.531 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H](O)C(F)F ZINC000295030250 199309901 /nfs/dbraw/zinc/30/99/01/199309901.db2.gz LOYDZMRIYVQWJY-CMPLNLGQSA-N 0 3 293.741 2.848 20 10 CFCDHN O=C(c1cccc2c1CCNC2)N1CCc2ccccc21 ZINC000124096867 539523654 /nfs/dbraw/zinc/52/36/54/539523654.db2.gz BSRTWTBOBICWSM-UHFFFAOYSA-N 0 3 278.355 2.535 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccccc1[O-] ZINC000295133706 199364352 /nfs/dbraw/zinc/36/43/52/199364352.db2.gz YMIJSHXCDJPFOA-WCQYABFASA-N 0 3 251.370 2.982 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H](CO)C(C)(C)C)c1[O-] ZINC000093821967 347684673 /nfs/dbraw/zinc/68/46/73/347684673.db2.gz RUXTVWHLSVDYDL-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)c1[O-] ZINC000093821967 347684675 /nfs/dbraw/zinc/68/46/75/347684675.db2.gz RUXTVWHLSVDYDL-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN Cc1ccc(O)c(CN2CCOCC23CCCC3)c1 ZINC000093840721 347685840 /nfs/dbraw/zinc/68/58/40/347685840.db2.gz NKFSSBITHMIUBE-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cc(Br)cc(C[NH2+]C(C)C)c1[O-] ZINC000157756634 348002602 /nfs/dbraw/zinc/00/26/02/348002602.db2.gz SSRVHUDLHZKDLB-UHFFFAOYSA-N 0 3 258.159 2.961 20 10 CFCDHN CC[C@H](CO)[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000295185224 199395056 /nfs/dbraw/zinc/39/50/56/199395056.db2.gz WLTCZCWSYJASHK-GFCCVEGCSA-N 0 3 257.761 2.557 20 10 CFCDHN CC[C@H](CO)[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000295185224 199395057 /nfs/dbraw/zinc/39/50/57/199395057.db2.gz WLTCZCWSYJASHK-GFCCVEGCSA-N 0 3 257.761 2.557 20 10 CFCDHN CC[C@H](O)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000293759975 198761418 /nfs/dbraw/zinc/76/14/18/198761418.db2.gz RZVJXOWAVCBYMY-FZMZJTMJSA-N 0 3 263.381 2.693 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)c1ccsc1)CC2 ZINC000297628913 200246049 /nfs/dbraw/zinc/24/60/49/200246049.db2.gz JFBFMFLOGDDQCN-TZMCWYRMSA-N 0 3 275.373 2.764 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)c1ccsc1)CC2 ZINC000297628904 200246562 /nfs/dbraw/zinc/24/65/62/200246562.db2.gz JFBFMFLOGDDQCN-GXTWGEPZSA-N 0 3 275.373 2.764 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000297737710 200271585 /nfs/dbraw/zinc/27/15/85/200271585.db2.gz NVUZRNHCEPUBQC-DOTOQJQBSA-N 0 3 299.370 2.711 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)o1 ZINC000297970297 200311086 /nfs/dbraw/zinc/31/10/86/200311086.db2.gz ZUQMXXRNUDLNDZ-JSGCOSHPSA-N 0 3 273.332 2.604 20 10 CFCDHN CC[C@H]([NH2+]CCN(CC)CC)c1ccccc1[O-] ZINC000019919526 372209967 /nfs/dbraw/zinc/20/99/67/372209967.db2.gz CVALQUDIJSUCGD-AWEZNQCLSA-N 0 3 250.386 2.775 20 10 CFCDHN COc1ccc(CN[C@H]2CCCc3c2cnn3C)cc1C ZINC000030908853 372401514 /nfs/dbraw/zinc/40/15/14/372401514.db2.gz ZPQKDVQHQJUXKC-HNNXBMFYSA-N 0 3 285.391 2.904 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1[O-] ZINC000037643960 372679421 /nfs/dbraw/zinc/67/94/21/372679421.db2.gz WIOIGWIIPLFCEA-DZGCQCFKSA-N 0 3 262.397 2.775 20 10 CFCDHN CC(C)(C)N1CCC([NH2+]Cc2ccccc2[O-])CC1 ZINC000037786355 372710341 /nfs/dbraw/zinc/71/03/41/372710341.db2.gz WUCKBCXIEBTVRY-UHFFFAOYSA-N 0 3 262.397 2.745 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2ccncc2)c([O-])c1 ZINC000048261581 373155919 /nfs/dbraw/zinc/15/59/19/373155919.db2.gz ZFOOPCFQTHPFHJ-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cccc(C)c2[O-])c1 ZINC000083422026 374744559 /nfs/dbraw/zinc/74/45/59/374744559.db2.gz ZNRUVPPPYNQTOS-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCN1CC[C@@H]([N@H+](C)Cc2cc(C)ccc2[O-])[C@H](C)C1 ZINC000093639522 375278322 /nfs/dbraw/zinc/27/83/22/375278322.db2.gz ATWSRSQQUSQXQL-GDBMZVCRSA-N 0 3 276.424 2.863 20 10 CFCDHN CCN1CC[C@@H]([N@@H+](C)Cc2cc(C)ccc2[O-])[C@H](C)C1 ZINC000093639522 375278325 /nfs/dbraw/zinc/27/83/25/375278325.db2.gz ATWSRSQQUSQXQL-GDBMZVCRSA-N 0 3 276.424 2.863 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000093838941 375319287 /nfs/dbraw/zinc/31/92/87/375319287.db2.gz WHJMXSOLISNPRC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000093838941 375319289 /nfs/dbraw/zinc/31/92/89/375319289.db2.gz WHJMXSOLISNPRC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000093506998 375258556 /nfs/dbraw/zinc/25/85/56/375258556.db2.gz SOVOQRYYXJVOPY-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000093506998 375258563 /nfs/dbraw/zinc/25/85/63/375258563.db2.gz SOVOQRYYXJVOPY-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000097996618 375589776 /nfs/dbraw/zinc/58/97/76/375589776.db2.gz CWNZDCVFWWEJMX-OKILXGFUSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000097996618 375589779 /nfs/dbraw/zinc/58/97/79/375589779.db2.gz CWNZDCVFWWEJMX-OKILXGFUSA-N 0 3 269.344 2.909 20 10 CFCDHN COc1ccc(CNCc2c(C)nn(C)c2C)cc1C ZINC000111363503 375840139 /nfs/dbraw/zinc/84/01/39/375840139.db2.gz XVSVMFDGPBIERR-UHFFFAOYSA-N 0 3 273.380 2.644 20 10 CFCDHN CCOc1cccc(CN2CCN(CC(C)C)CC2)c1O ZINC000112642534 375941024 /nfs/dbraw/zinc/94/10/24/375941024.db2.gz KNOCCXAYPZMGLL-UHFFFAOYSA-N 0 3 292.423 2.565 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1ccccc1[O-])c1ccc(F)cc1F ZINC000114509264 376072982 /nfs/dbraw/zinc/07/29/82/376072982.db2.gz CTTWUKPLGZXMQR-INIZCTEOSA-N 0 3 293.313 2.668 20 10 CFCDHN CCOC(=O)CCCCC[N@H+](C)Cc1ccccc1[O-] ZINC000117881605 376264947 /nfs/dbraw/zinc/26/49/47/376264947.db2.gz XNUHUCGGPURAIN-UHFFFAOYSA-N 0 3 279.380 2.948 20 10 CFCDHN CCOC(=O)CCCCC[N@@H+](C)Cc1ccccc1[O-] ZINC000117881605 376264956 /nfs/dbraw/zinc/26/49/56/376264956.db2.gz XNUHUCGGPURAIN-UHFFFAOYSA-N 0 3 279.380 2.948 20 10 CFCDHN Cc1c([C@H](C)NCc2cccc(C)c2O)cnn1C ZINC000124705373 377079510 /nfs/dbraw/zinc/07/95/10/377079510.db2.gz ZTQPIBXOSIYDSL-NSHDSACASA-N 0 3 259.353 2.593 20 10 CFCDHN CCOc1cccc(C[N@H+](C[C@H]2CCOC2)C2CC2)c1[O-] ZINC000129963045 377494577 /nfs/dbraw/zinc/49/45/77/377494577.db2.gz VRLCACICDCCBSC-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c1[O-] ZINC000129963045 377494585 /nfs/dbraw/zinc/49/45/85/377494585.db2.gz VRLCACICDCCBSC-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@@H]2CCSC2)cc1F ZINC000130534616 377572936 /nfs/dbraw/zinc/57/29/36/377572936.db2.gz OVPVFCSUTRGYCK-GFCCVEGCSA-N 0 3 268.401 2.829 20 10 CFCDHN C[C@H]1C[C@H](N(C)Cc2c([O-])cccc2Cl)CC[N@@H+]1C ZINC000130657513 377590199 /nfs/dbraw/zinc/59/01/99/377590199.db2.gz AUSXKDQBBUEAHV-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@H](N(C)Cc2c([O-])cccc2Cl)CC[N@H+]1C ZINC000130657513 377590204 /nfs/dbraw/zinc/59/02/04/377590204.db2.gz AUSXKDQBBUEAHV-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@H]([N@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657513 377590210 /nfs/dbraw/zinc/59/02/10/377590210.db2.gz AUSXKDQBBUEAHV-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@H]([N@@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657513 377590213 /nfs/dbraw/zinc/59/02/13/377590213.db2.gz AUSXKDQBBUEAHV-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCCC(=O)NC(C)C)cc1 ZINC000133798272 377958209 /nfs/dbraw/zinc/95/82/09/377958209.db2.gz YDDIOFUNZSQONW-CQSZACIVSA-N 0 3 291.439 2.708 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000153997633 378530962 /nfs/dbraw/zinc/53/09/62/378530962.db2.gz JQLHITXRPWBGHX-PXAZEXFGSA-N 0 3 287.359 2.785 20 10 CFCDHN CN1CCN(Cc2ccccc2O)[C@H](c2ccccc2)C1 ZINC000155227882 378617029 /nfs/dbraw/zinc/61/70/29/378617029.db2.gz HAVPGYQKGAMZTL-KRWDZBQOSA-N 0 3 282.387 2.881 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000177630970 380361188 /nfs/dbraw/zinc/36/11/88/380361188.db2.gz PZFSEQCYXYFSRS-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000177630970 380361193 /nfs/dbraw/zinc/36/11/93/380361193.db2.gz PZFSEQCYXYFSRS-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1ccccc1[O-] ZINC000178439126 380451291 /nfs/dbraw/zinc/45/12/91/380451291.db2.gz JMGXMHLSBCWUOK-ZTFRIQLXSA-N 0 3 269.344 2.701 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)C2CCCC2)cc1OC ZINC000179434532 380542990 /nfs/dbraw/zinc/54/29/90/380542990.db2.gz SIMBDSKHXSCEJA-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)C2CCCC2)cc1OC ZINC000179434532 380542998 /nfs/dbraw/zinc/54/29/98/380542998.db2.gz SIMBDSKHXSCEJA-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC000179780300 380580133 /nfs/dbraw/zinc/58/01/33/380580133.db2.gz DJIYJDWQXPORRT-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC000179780300 380580138 /nfs/dbraw/zinc/58/01/38/380580138.db2.gz DJIYJDWQXPORRT-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@](C)(O)C2)cc1F ZINC000180189514 380629844 /nfs/dbraw/zinc/62/98/44/380629844.db2.gz JVKLLNGKYRSCNX-MRXNPFEDSA-N 0 3 280.387 2.629 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000180204076 380631533 /nfs/dbraw/zinc/63/15/33/380631533.db2.gz VEFZZXFRMQAIOV-AWEZNQCLSA-N 0 3 292.398 2.839 20 10 CFCDHN CC[C@@H]1CN(Cc2cc(OC)ccc2O)CCS1 ZINC000180312584 380645109 /nfs/dbraw/zinc/64/51/09/380645109.db2.gz IXKGNQGVURNZJA-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2cc(OC)ccc2[O-])CCS1 ZINC000180312584 380645117 /nfs/dbraw/zinc/64/51/17/380645117.db2.gz IXKGNQGVURNZJA-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2cc(OC)ccc2[O-])CCS1 ZINC000180312584 380645122 /nfs/dbraw/zinc/64/51/22/380645122.db2.gz IXKGNQGVURNZJA-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccccc1F)c1ccccc1[O-] ZINC000179890687 380594472 /nfs/dbraw/zinc/59/44/72/380594472.db2.gz CZVBXHWWIZCTQI-BDJLRTHQSA-N 0 3 275.323 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000179924903 380597624 /nfs/dbraw/zinc/59/76/24/380597624.db2.gz LXSIHGLEFUWRKB-NSHDSACASA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000179924903 380597628 /nfs/dbraw/zinc/59/76/28/380597628.db2.gz LXSIHGLEFUWRKB-NSHDSACASA-N 0 3 265.328 2.532 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180158964 380625687 /nfs/dbraw/zinc/62/56/87/380625687.db2.gz BJFOCRIEHDGYNN-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180158964 380625692 /nfs/dbraw/zinc/62/56/92/380625692.db2.gz BJFOCRIEHDGYNN-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@H](C)CCSC)c1 ZINC000180349916 380647820 /nfs/dbraw/zinc/64/78/20/380647820.db2.gz PRPJNYOVWKWNCH-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@H](C)CCSC)c1 ZINC000180349916 380647823 /nfs/dbraw/zinc/64/78/23/380647823.db2.gz PRPJNYOVWKWNCH-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCSC(F)(F)F ZINC000180482768 380665841 /nfs/dbraw/zinc/66/58/41/380665841.db2.gz YYMKRRFKVOIZOS-UHFFFAOYSA-N 0 3 269.263 2.874 20 10 CFCDHN Cc1cccc(CN(C)[C@@H]2CCCc3c2cnn3C)c1O ZINC000180640591 380684387 /nfs/dbraw/zinc/68/43/87/380684387.db2.gz DCZRMEJQSJJWJH-OAHLLOKOSA-N 0 3 285.391 2.944 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2cc(F)ccc2[O-])c(C)o1 ZINC000180796489 380701812 /nfs/dbraw/zinc/70/18/12/380701812.db2.gz YZUZORLIHPFMGF-MRXNPFEDSA-N 0 3 293.338 2.738 20 10 CFCDHN CCC(O)(CC)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000181255576 380765999 /nfs/dbraw/zinc/76/59/99/380765999.db2.gz VTWLHHRPAYMCEA-UHFFFAOYSA-N 0 3 271.788 2.995 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccccc1[O-] ZINC000368103616 380927654 /nfs/dbraw/zinc/92/76/54/380927654.db2.gz XLQWJUNDWLBTJM-AAEUAGOBSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccccc1[O-] ZINC000368103616 380927662 /nfs/dbraw/zinc/92/76/62/380927662.db2.gz XLQWJUNDWLBTJM-AAEUAGOBSA-N 0 3 271.364 2.714 20 10 CFCDHN COc1ccncc1CN[C@@H](C)c1ccccc1O ZINC000287642391 380895090 /nfs/dbraw/zinc/89/50/90/380895090.db2.gz GHGSQBPPOSHBKI-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c1 ZINC000368100902 380924357 /nfs/dbraw/zinc/92/43/57/380924357.db2.gz IXXZJZWVKOKMDQ-RYUDHWBXSA-N 0 3 271.364 2.632 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cc(OCC)ccc1[O-] ZINC000288535274 381015782 /nfs/dbraw/zinc/01/57/82/381015782.db2.gz KLYWDRSZBWGZPK-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1cc(C)ccc1[O-] ZINC000289179956 381026430 /nfs/dbraw/zinc/02/64/30/381026430.db2.gz AKMBCOJVIPVOIP-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1cc(C)ccc1[O-] ZINC000289179956 381026442 /nfs/dbraw/zinc/02/64/42/381026442.db2.gz AKMBCOJVIPVOIP-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CC2CCC2)[C@@H](C)CO)c1 ZINC000289344982 381030429 /nfs/dbraw/zinc/03/04/29/381030429.db2.gz IIWHWVXYCIYEDK-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CC2CCC2)[C@@H](C)CO)c1 ZINC000289344982 381030436 /nfs/dbraw/zinc/03/04/36/381030436.db2.gz IIWHWVXYCIYEDK-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000182623381 381121615 /nfs/dbraw/zinc/12/16/15/381121615.db2.gz JGSDIWQTWRJNRO-AWEZNQCLSA-N 0 3 291.391 2.982 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000182623364 381121997 /nfs/dbraw/zinc/12/19/97/381121997.db2.gz JGSDIWQTWRJNRO-CQSZACIVSA-N 0 3 291.391 2.982 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000368819308 381142597 /nfs/dbraw/zinc/14/25/97/381142597.db2.gz SKPBHNDLRAKODK-QGZVFWFLSA-N 0 3 269.344 2.832 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000368819308 381142604 /nfs/dbraw/zinc/14/26/04/381142604.db2.gz SKPBHNDLRAKODK-QGZVFWFLSA-N 0 3 269.344 2.832 20 10 CFCDHN COc1ccc(O)c(CN(C)CCOc2ccccc2)c1 ZINC000183372506 381262257 /nfs/dbraw/zinc/26/22/57/381262257.db2.gz ASOUARMQJMXSDI-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCOc2ccccc2)c1 ZINC000183372506 381262262 /nfs/dbraw/zinc/26/22/62/381262262.db2.gz ASOUARMQJMXSDI-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCOc2ccccc2)c1 ZINC000183372506 381262269 /nfs/dbraw/zinc/26/22/69/381262269.db2.gz ASOUARMQJMXSDI-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000289926604 381220619 /nfs/dbraw/zinc/22/06/19/381220619.db2.gz XSIRWFYHVBBRJF-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000289926604 381220626 /nfs/dbraw/zinc/22/06/26/381220626.db2.gz XSIRWFYHVBBRJF-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](C3(C)OCCO3)C2)c1[O-] ZINC000183240996 381241848 /nfs/dbraw/zinc/24/18/48/381241848.db2.gz ABOVBSZWQSCRJS-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c1[O-] ZINC000183240996 381241853 /nfs/dbraw/zinc/24/18/53/381241853.db2.gz ABOVBSZWQSCRJS-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN CC[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)N1CCCC1 ZINC000296214843 381304641 /nfs/dbraw/zinc/30/46/41/381304641.db2.gz ZPMAVSQTYYBDDQ-LSDHHAIUSA-N 0 3 274.408 2.844 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccccc1[O-] ZINC000183518346 381281386 /nfs/dbraw/zinc/28/13/86/381281386.db2.gz AXUYWNWIHXRKTA-RYUDHWBXSA-N 0 3 251.370 2.840 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCCO)c([O-])c1 ZINC000296313008 381342586 /nfs/dbraw/zinc/34/25/86/381342586.db2.gz GLPPXQMWXCNIAW-STQMWFEESA-N 0 3 251.370 2.902 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@@H]1CCCCO1)CC2 ZINC000296574943 381456267 /nfs/dbraw/zinc/45/62/67/381456267.db2.gz VJPGWAJWVQHBQZ-UONOGXRCSA-N 0 3 261.365 2.928 20 10 CFCDHN CC(C)N1CCC([NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000296814855 381545581 /nfs/dbraw/zinc/54/55/81/381545581.db2.gz LXKPYOMUXWITRI-HNNXBMFYSA-N 0 3 274.408 2.842 20 10 CFCDHN CC1(C)[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)[C@H]2CCO[C@@H]21 ZINC000297965883 381575759 /nfs/dbraw/zinc/57/57/59/381575759.db2.gz ZPCGFIWRJNUONS-BHTHQVBYSA-N 0 3 273.376 2.783 20 10 CFCDHN Cc1nccn1CCCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297913844 381575849 /nfs/dbraw/zinc/57/58/49/381575849.db2.gz WTCRNLDGMHELLD-HNNXBMFYSA-N 0 3 285.391 2.954 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCNC(=O)OC(C)(C)C)c1 ZINC000185266896 381582260 /nfs/dbraw/zinc/58/22/60/381582260.db2.gz KJTCYSXFEXLAOM-GFCCVEGCSA-N 0 3 294.395 2.876 20 10 CFCDHN Oc1cc2c(cc1CN1CC3(C1)CCCCC3)OCO2 ZINC000297494648 381563140 /nfs/dbraw/zinc/56/31/40/381563140.db2.gz UKEINLANGJDJOX-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)O)c1cc2c(cc1[O-])CCCC2 ZINC000185413915 381626217 /nfs/dbraw/zinc/62/62/17/381626217.db2.gz NDTIOBGKGRQBLF-NSHDSACASA-N 0 3 263.381 2.693 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c1 ZINC000185475067 381643710 /nfs/dbraw/zinc/64/37/10/381643710.db2.gz JZKICPYQGQAUOA-GIPWTMENSA-N 0 3 299.436 2.599 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c1 ZINC000185474885 381643786 /nfs/dbraw/zinc/64/37/86/381643786.db2.gz CUMJPXJJXLONOX-BLVKFPJESA-N 0 3 283.437 2.898 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000185534542 381660087 /nfs/dbraw/zinc/66/00/87/381660087.db2.gz WNDMTYPBJJYHHM-LPGAHRBXSA-N 0 3 291.391 2.865 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000185534481 381660325 /nfs/dbraw/zinc/66/03/25/381660325.db2.gz WNDMTYPBJJYHHM-SPGJAERMSA-N 0 3 291.391 2.865 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)CCO)c1 ZINC000185608674 381681728 /nfs/dbraw/zinc/68/17/28/381681728.db2.gz VHXZXPCUPVIMLO-GFCCVEGCSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672032 381699665 /nfs/dbraw/zinc/69/96/65/381699665.db2.gz JULNFZHBOKVGFW-MJBXVCDLSA-N 0 3 274.408 2.976 20 10 CFCDHN CC(C)[N@H+](Cc1cc(F)ccc1[O-])[C@H]1CCOC1 ZINC000291309108 381744309 /nfs/dbraw/zinc/74/43/09/381744309.db2.gz RKGKBAITDNPWOU-ZDUSSCGKSA-N 0 3 253.317 2.531 20 10 CFCDHN CC(C)[N@@H+](Cc1cc(F)ccc1[O-])[C@H]1CCOC1 ZINC000291309108 381744316 /nfs/dbraw/zinc/74/43/16/381744316.db2.gz RKGKBAITDNPWOU-ZDUSSCGKSA-N 0 3 253.317 2.531 20 10 CFCDHN C[C@@H]1CCC[N@@H+]1C1CCN(Cc2ccccc2[O-])CC1 ZINC000360041988 381745760 /nfs/dbraw/zinc/74/57/60/381745760.db2.gz SMUFQPLOJZSOAY-CQSZACIVSA-N 0 3 274.408 2.841 20 10 CFCDHN C[C@@H]1CCC[N@H+]1C1CCN(Cc2ccccc2[O-])CC1 ZINC000360041988 381745763 /nfs/dbraw/zinc/74/57/63/381745763.db2.gz SMUFQPLOJZSOAY-CQSZACIVSA-N 0 3 274.408 2.841 20 10 CFCDHN C[N@@H+]1CC[C@@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000292865145 381872727 /nfs/dbraw/zinc/87/27/27/381872727.db2.gz VRSOUTMLYOPBFF-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000292865145 381872731 /nfs/dbraw/zinc/87/27/31/381872731.db2.gz VRSOUTMLYOPBFF-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC(OCC3CC3)CC2)c1 ZINC000373229146 381955606 /nfs/dbraw/zinc/95/56/06/381955606.db2.gz LXWUYKATJJALJG-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c([O-])c1C ZINC000373266201 381964345 /nfs/dbraw/zinc/96/43/45/381964345.db2.gz LXKUVQWZEWCLOO-OCCSQVGLSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1ncc2c(n1)CC[C@H]([NH2+][C@H](C)c1ccccc1[O-])C2 ZINC000374713863 382052490 /nfs/dbraw/zinc/05/24/90/382052490.db2.gz WYSVRYAQTKFEIY-RISCZKNCSA-N 0 3 283.375 2.699 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])[C@@H]2CCCO[C@@H]21 ZINC000374904668 382059253 /nfs/dbraw/zinc/05/92/53/382059253.db2.gz UNTAJUFXRCCCPS-CFVMTHIKSA-N 0 3 279.355 2.825 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCC12CCOCC2 ZINC000374896935 382059841 /nfs/dbraw/zinc/05/98/41/382059841.db2.gz LPNRYBXMHNYXAJ-UHFFFAOYSA-N 0 3 265.328 2.676 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCC12CCOCC2 ZINC000374896935 382059848 /nfs/dbraw/zinc/05/98/48/382059848.db2.gz LPNRYBXMHNYXAJ-UHFFFAOYSA-N 0 3 265.328 2.676 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC([C@@H]3CCOC3)CC2)c1 ZINC000374931121 382061805 /nfs/dbraw/zinc/06/18/05/382061805.db2.gz SVQMJVCZGPRTSX-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000374997582 382063336 /nfs/dbraw/zinc/06/33/36/382063336.db2.gz KKWODAQLLAUVRX-DZGCQCFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000374997582 382063339 /nfs/dbraw/zinc/06/33/39/382063339.db2.gz KKWODAQLLAUVRX-DZGCQCFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000375015903 382065283 /nfs/dbraw/zinc/06/52/83/382065283.db2.gz DBYNJKNGERBFJF-GJZGRUSLSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000375015903 382065293 /nfs/dbraw/zinc/06/52/93/382065293.db2.gz DBYNJKNGERBFJF-GJZGRUSLSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCN3C)c1[O-] ZINC000373529396 382018782 /nfs/dbraw/zinc/01/87/82/382018782.db2.gz NCYZFPKPWAQEAI-UHFFFAOYSA-N 0 3 282.387 2.983 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000373566511 382020525 /nfs/dbraw/zinc/02/05/25/382020525.db2.gz CWUKFQYBLBEWNS-UHFFFAOYSA-N 0 3 279.355 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000373566511 382020532 /nfs/dbraw/zinc/02/05/32/382020532.db2.gz CWUKFQYBLBEWNS-UHFFFAOYSA-N 0 3 279.355 2.924 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968642 382113258 /nfs/dbraw/zinc/11/32/58/382113258.db2.gz NGZVINRBWHRKHQ-TUAOUCFPSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968642 382113259 /nfs/dbraw/zinc/11/32/59/382113259.db2.gz NGZVINRBWHRKHQ-TUAOUCFPSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968642 382113264 /nfs/dbraw/zinc/11/32/64/382113264.db2.gz NGZVINRBWHRKHQ-TUAOUCFPSA-N 0 3 296.361 2.948 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000375298179 382075692 /nfs/dbraw/zinc/07/56/92/382075692.db2.gz ACJPPGPMCUGXKU-HNNXBMFYSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000375298179 382075699 /nfs/dbraw/zinc/07/56/99/382075699.db2.gz ACJPPGPMCUGXKU-HNNXBMFYSA-N 0 3 279.355 2.922 20 10 CFCDHN COc1cccc(C[NH2+]CC2(OC)CCCCC2)c1[O-] ZINC000187443489 382184670 /nfs/dbraw/zinc/18/46/70/382184670.db2.gz MBFWMDDLZNUHLI-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](CO)C2CCCCC2)c1[O-] ZINC000293550068 382170617 /nfs/dbraw/zinc/17/06/17/382170617.db2.gz DVDVDLOFQRDTSX-MRXNPFEDSA-N 0 3 277.408 2.979 20 10 CFCDHN CCOc1cccc(CN2CC=C(COC)CC2)c1O ZINC000187612770 382226761 /nfs/dbraw/zinc/22/67/61/382226761.db2.gz QOAJLDLUYZNHMC-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCc2nccnc2C)c1[O-] ZINC000293787028 382278863 /nfs/dbraw/zinc/27/88/63/382278863.db2.gz ZOSSLSUVMPLKPZ-UHFFFAOYSA-N 0 3 291.782 2.785 20 10 CFCDHN CN1CC=C(C[NH2+]Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000293765122 382268980 /nfs/dbraw/zinc/26/89/80/382268980.db2.gz ZJEIJXGXYPSBEI-UHFFFAOYSA-N 0 3 284.762 2.536 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000377697450 382323509 /nfs/dbraw/zinc/32/35/09/382323509.db2.gz LLIJZZJGUWOHNA-HIFRSBDPSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOCC2(CC2)C1 ZINC000377702980 382325627 /nfs/dbraw/zinc/32/56/27/382325627.db2.gz QBNKQWOJVPAFBU-AWEZNQCLSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOCC2(CC2)C1 ZINC000377702980 382325631 /nfs/dbraw/zinc/32/56/31/382325631.db2.gz QBNKQWOJVPAFBU-AWEZNQCLSA-N 0 3 261.365 2.956 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c1 ZINC000294025094 382382686 /nfs/dbraw/zinc/38/26/86/382382686.db2.gz NTWLQPXLXWZQKQ-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)c1 ZINC000294025094 382382687 /nfs/dbraw/zinc/38/26/87/382382687.db2.gz NTWLQPXLXWZQKQ-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](C)[C@H](OC)C2)c1[O-] ZINC000188319610 382392262 /nfs/dbraw/zinc/39/22/62/382392262.db2.gz FSQOEUOQLISKKJ-SWLSCSKDSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](C)[C@H](OC)C2)c1[O-] ZINC000188319610 382392264 /nfs/dbraw/zinc/39/22/64/382392264.db2.gz FSQOEUOQLISKKJ-SWLSCSKDSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](O)CC2)c1[O-] ZINC000294074270 382405424 /nfs/dbraw/zinc/40/54/24/382405424.db2.gz QQBYBJYQQPNSDH-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](O)CC2)c1[O-] ZINC000294074270 382405429 /nfs/dbraw/zinc/40/54/29/382405429.db2.gz QQBYBJYQQPNSDH-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCOCC(F)F)c1 ZINC000188757123 382470363 /nfs/dbraw/zinc/47/03/63/382470363.db2.gz HSBSPADCAWNWSO-SNVBAGLBSA-N 0 3 259.296 2.633 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC23CCC(CO)CC3)c1[O-] ZINC000378445882 382462388 /nfs/dbraw/zinc/46/23/88/382462388.db2.gz VHLHFZUMMXTQKO-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC23CCC(CO)CC3)c1[O-] ZINC000378445882 382462392 /nfs/dbraw/zinc/46/23/92/382462392.db2.gz VHLHFZUMMXTQKO-UHFFFAOYSA-N 0 3 275.392 2.828 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000294223440 382467021 /nfs/dbraw/zinc/46/70/21/382467021.db2.gz LZZYSVKYFMOKOC-KBPBESRZSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000294223440 382467025 /nfs/dbraw/zinc/46/70/25/382467025.db2.gz LZZYSVKYFMOKOC-KBPBESRZSA-N 0 3 298.789 2.901 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cc(C)ccc1[O-])C(C)C ZINC000188868549 382495805 /nfs/dbraw/zinc/49/58/05/382495805.db2.gz PQEANOWNIYVYKB-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN CO[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000378631877 382495966 /nfs/dbraw/zinc/49/59/66/382495966.db2.gz KDGVIZSNYHMRMH-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN Cc1nnc([C@H]2CC23CC[NH+](Cc2ccccc2[O-])CC3)o1 ZINC000378495565 382473286 /nfs/dbraw/zinc/47/32/86/382473286.db2.gz MXDAFVZQUXNXDD-CQSZACIVSA-N 0 3 299.374 2.853 20 10 CFCDHN COCCO[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000188829431 382487446 /nfs/dbraw/zinc/48/74/46/382487446.db2.gz MBLPLZPHQPOAGZ-AWEZNQCLSA-N 0 3 299.798 2.591 20 10 CFCDHN COCCO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000188829431 382487452 /nfs/dbraw/zinc/48/74/52/382487452.db2.gz MBLPLZPHQPOAGZ-AWEZNQCLSA-N 0 3 299.798 2.591 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CC(c2ccccn2)C1 ZINC000367319689 382563742 /nfs/dbraw/zinc/56/37/42/382563742.db2.gz WPWZCWCAIALEBH-UHFFFAOYSA-N 0 3 254.333 2.823 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)[C@H](C(=O)OC)C1 ZINC000367306940 382563768 /nfs/dbraw/zinc/56/37/68/382563768.db2.gz BTEZHUVYAJGBDY-BNOWGMLFSA-N 0 3 277.364 2.584 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)[C@H](C(=O)OC)C1 ZINC000367306940 382563771 /nfs/dbraw/zinc/56/37/71/382563771.db2.gz BTEZHUVYAJGBDY-BNOWGMLFSA-N 0 3 277.364 2.584 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCSC[C@H](C)C2)c1 ZINC000190847823 382682575 /nfs/dbraw/zinc/68/25/75/382682575.db2.gz LCEFKVZOWBBICL-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCSC[C@H](C)C2)c1 ZINC000190847823 382682576 /nfs/dbraw/zinc/68/25/76/382682576.db2.gz LCEFKVZOWBBICL-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCCC[C@H]2O)c1 ZINC000246913511 383120611 /nfs/dbraw/zinc/12/06/11/383120611.db2.gz HXMYDZCWDGYCKC-KCQAQPDRSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000247053144 383137064 /nfs/dbraw/zinc/13/70/64/383137064.db2.gz QXQUJISCGIZCNG-KCQAQPDRSA-N 0 3 263.381 2.902 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000248754958 383288431 /nfs/dbraw/zinc/28/84/31/383288431.db2.gz IJMACXIEDMCDRM-KGLIPLIRSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H]2OCCC[C@@H]12)c1cc(F)ccc1[O-] ZINC000251848013 383397567 /nfs/dbraw/zinc/39/75/67/383397567.db2.gz NGRDPKOUTBNGJO-SQWGHXPGSA-N 0 3 265.328 2.749 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H]2CCCc3c[nH]nc32)c1 ZINC000268867157 384680148 /nfs/dbraw/zinc/68/01/48/384680148.db2.gz UHFNFYQUAPYNMO-CYBMUJFWSA-N 0 3 257.337 2.591 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@](C)(O)c2ccc(F)cc2)c1 ZINC000270246937 385029496 /nfs/dbraw/zinc/02/94/96/385029496.db2.gz FCXGSLDSOYYVSS-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN CC[C@@H](NCc1ccc(N(C)C)cc1)[C@@H](O)C(F)(F)F ZINC000271026946 385307918 /nfs/dbraw/zinc/30/79/18/385307918.db2.gz VYGGJIMRKKUPFV-CHWSQXEVSA-N 0 3 290.329 2.544 20 10 CFCDHN CC[C@H](NCc1ccc(N(C)C)cc1)[C@@H](O)C(F)(F)F ZINC000271026949 385308561 /nfs/dbraw/zinc/30/85/61/385308561.db2.gz VYGGJIMRKKUPFV-QWHCGFSZSA-N 0 3 290.329 2.544 20 10 CFCDHN OC1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000271042802 385315554 /nfs/dbraw/zinc/31/55/54/385315554.db2.gz OZVNHBXPZBJJFF-UHFFFAOYSA-N 0 3 274.408 2.634 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c1 ZINC000282390060 385299068 /nfs/dbraw/zinc/29/90/68/385299068.db2.gz RCUUKPCZMPFTOP-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](OC)C[C@H]2C)c1 ZINC000282390060 385299072 /nfs/dbraw/zinc/29/90/72/385299072.db2.gz RCUUKPCZMPFTOP-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1ccccc1[O-] ZINC000271720844 385388760 /nfs/dbraw/zinc/38/87/60/385388760.db2.gz XROWGIXGPNXCNB-ZDUSSCGKSA-N 0 3 298.386 2.945 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](C(=O)OC)C2)cc1 ZINC000271099476 385335682 /nfs/dbraw/zinc/33/56/82/385335682.db2.gz OQRZUAWXQFXZIJ-OAHLLOKOSA-N 0 3 290.407 2.528 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2cccc(C)c2[O-])c(C)o1 ZINC000271770326 385390879 /nfs/dbraw/zinc/39/08/79/385390879.db2.gz BOIVYSSZRUEXAP-QGZVFWFLSA-N 0 3 289.375 2.908 20 10 CFCDHN C[C@@H](NC[C@](C)(O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000271450044 385382971 /nfs/dbraw/zinc/38/29/71/385382971.db2.gz FZXJNABFYGSSFJ-MFKMUULPSA-N 0 3 290.329 2.717 20 10 CFCDHN COc1ccc([C@H](CO)[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000271460147 385382985 /nfs/dbraw/zinc/38/29/85/385382985.db2.gz WZWMGWIUMKLCFS-INIZCTEOSA-N 0 3 287.359 2.566 20 10 CFCDHN COc1ccc([C@H](CO)[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000271460147 385382989 /nfs/dbraw/zinc/38/29/89/385382989.db2.gz WZWMGWIUMKLCFS-INIZCTEOSA-N 0 3 287.359 2.566 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1[O-] ZINC000271504844 385383893 /nfs/dbraw/zinc/38/38/93/385383893.db2.gz LCXKZFPUCDSLFU-UKRRQHHQSA-N 0 3 279.380 2.694 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H](CCO)c1ccccc1 ZINC000271468479 385384128 /nfs/dbraw/zinc/38/41/28/385384128.db2.gz YMPNPMBREVAQIV-INIZCTEOSA-N 0 3 271.360 2.948 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H](CCO)c1ccccc1 ZINC000271468479 385384129 /nfs/dbraw/zinc/38/41/29/385384129.db2.gz YMPNPMBREVAQIV-INIZCTEOSA-N 0 3 271.360 2.948 20 10 CFCDHN Cc1cccc(CN[C@H]2CCCc3nn(C)cc32)c1O ZINC000283126731 385438834 /nfs/dbraw/zinc/43/88/34/385438834.db2.gz VSJLXGSBOPOTNI-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCCc3nn(C)cc32)c1[O-] ZINC000283126731 385438839 /nfs/dbraw/zinc/43/88/39/385438839.db2.gz VSJLXGSBOPOTNI-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H](O)c1cccc(F)c1 ZINC000272239338 385484730 /nfs/dbraw/zinc/48/47/30/385484730.db2.gz AJZOTPNQNWZXLJ-MGPLVRAMSA-N 0 3 293.313 2.882 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H]3CCN(C)C[C@H]32)cc1C ZINC000272329876 385512661 /nfs/dbraw/zinc/51/26/61/385512661.db2.gz VKWRRRCRMBWPFB-GDBMZVCRSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H]3CCN(C)C[C@H]32)cc1C ZINC000272329876 385512666 /nfs/dbraw/zinc/51/26/66/385512666.db2.gz VKWRRRCRMBWPFB-GDBMZVCRSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc(C[NH2+]Cc2cc(Cl)cc(C)c2[O-])n(C)n1 ZINC000284378349 385548514 /nfs/dbraw/zinc/54/85/14/385548514.db2.gz OFUMKCSAVGCRCY-UHFFFAOYSA-N 0 3 279.771 2.686 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c1 ZINC000284128880 385538550 /nfs/dbraw/zinc/53/85/50/385538550.db2.gz CUIIYILSWRCCRB-ZENOOKHLSA-N 0 3 295.423 2.509 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c([O-])c1 ZINC000285008352 385551079 /nfs/dbraw/zinc/55/10/79/385551079.db2.gz HBLVWTCXJQWMSG-JMERFSKESA-N 0 3 283.437 2.817 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285321031 385553831 /nfs/dbraw/zinc/55/38/31/385553831.db2.gz TVYVWENRLXMJSN-CBCUQQMYSA-N 0 3 293.407 2.590 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC[C@@H](C)O)c([O-])c1 ZINC000285279284 385554413 /nfs/dbraw/zinc/55/44/13/385554413.db2.gz REOJPQDMXSEEPP-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H]2CCOC[C@H]2C)c([O-])c1 ZINC000285406305 385555710 /nfs/dbraw/zinc/55/57/10/385555710.db2.gz FMCNETRVDPFKPZ-KGLIPLIRSA-N 0 3 293.407 2.943 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CCN(C)C)c1ccc(F)cc1[O-] ZINC000286001693 385559734 /nfs/dbraw/zinc/55/97/34/385559734.db2.gz IRMOWPVCGFVAAT-BXUZGUMPSA-N 0 3 268.376 2.912 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)cc1C ZINC000272704525 385591317 /nfs/dbraw/zinc/59/13/17/385591317.db2.gz ZKMWRXHTTUIKSV-GOEBONIOSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)cc1C ZINC000272704525 385591318 /nfs/dbraw/zinc/59/13/18/385591318.db2.gz ZKMWRXHTTUIKSV-GOEBONIOSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@H]2CCCC[C@H]2O)cc1C ZINC000272704523 385591741 /nfs/dbraw/zinc/59/17/41/385591741.db2.gz ZKMWRXHTTUIKSV-GDBMZVCRSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)cc1C ZINC000272704523 385591748 /nfs/dbraw/zinc/59/17/48/385591748.db2.gz ZKMWRXHTTUIKSV-GDBMZVCRSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cccc(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000273147306 385671872 /nfs/dbraw/zinc/67/18/72/385671872.db2.gz GPBILEUSJBPPHY-HOTGVXAUSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000273147310 385672184 /nfs/dbraw/zinc/67/21/84/385672184.db2.gz GPBILEUSJBPPHY-HZPDHXFCSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc([C@@H](C)NC[C@](C)(O)C(F)(F)F)c(O)c1C ZINC000273349502 385676493 /nfs/dbraw/zinc/67/64/93/385676493.db2.gz BLSWJFSGGVIYQP-MFKMUULPSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1C ZINC000273349502 385676498 /nfs/dbraw/zinc/67/64/98/385676498.db2.gz BLSWJFSGGVIYQP-MFKMUULPSA-N 0 3 291.313 2.973 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273303158 385677104 /nfs/dbraw/zinc/67/71/04/385677104.db2.gz CDBIYWIYEVWKAF-TZMCWYRMSA-N 0 3 292.423 2.964 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@@H]2C)c([O-])c1 ZINC000273368892 385679694 /nfs/dbraw/zinc/67/96/94/385679694.db2.gz CANHCWJABDTMPK-XEZPLFJOSA-N 0 3 274.408 2.834 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2ccccc2[O-])C[C@@H]1O ZINC000273446131 385682690 /nfs/dbraw/zinc/68/26/90/385682690.db2.gz XNRBDEUNXWZOLU-HIFRSBDPSA-N 0 3 263.381 2.621 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@@H]1O ZINC000273446131 385682691 /nfs/dbraw/zinc/68/26/91/385682691.db2.gz XNRBDEUNXWZOLU-HIFRSBDPSA-N 0 3 263.381 2.621 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000273430120 385682919 /nfs/dbraw/zinc/68/29/19/385682919.db2.gz VHSUQRZHCZXJLJ-CYBMUJFWSA-N 0 3 273.380 2.946 20 10 CFCDHN COC(=O)N1CCC([NH2+][C@H](C)c2ccc(C)cc2[O-])CC1 ZINC000273440122 385682961 /nfs/dbraw/zinc/68/29/61/385682961.db2.gz YCJAKKGRHWXNCN-GFCCVEGCSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496052 385686050 /nfs/dbraw/zinc/68/60/50/385686050.db2.gz PBLFQZZTJISEJK-NOZJJQNGSA-N 0 3 275.327 2.983 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc(C)cc2[O-])o1 ZINC000273589311 385690007 /nfs/dbraw/zinc/69/00/07/385690007.db2.gz OSBDRTPIGQZTTG-IUODEOHRSA-N 0 3 275.348 2.986 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1cc(F)ccc1[O-] ZINC000273596449 385691488 /nfs/dbraw/zinc/69/14/88/385691488.db2.gz QVEXHFBTISRPSY-IAQYHMDHSA-N 0 3 298.427 2.619 20 10 CFCDHN CNC(=O)C1CCC([NH2+][C@@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273621876 385692788 /nfs/dbraw/zinc/69/27/88/385692788.db2.gz ZJFRFCYDBYZYAQ-HSBZDZAISA-N 0 3 290.407 2.656 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273619984 385692854 /nfs/dbraw/zinc/69/28/54/385692854.db2.gz YSYUZZAPGNKUFQ-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)CC2 ZINC000297050336 285292032 /nfs/dbraw/zinc/29/20/32/285292032.db2.gz VNTMZHYZKMDOBA-MRVWCRGKSA-N 0 3 261.365 2.520 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCO[C@H](C3CC3)C1)CC2 ZINC000296247066 285397715 /nfs/dbraw/zinc/39/77/15/285397715.db2.gz BBBWXBFDKGGHAZ-LZWOXQAQSA-N 0 3 273.376 2.927 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@H](C3CC3)C2)cc1OC ZINC000372391929 393448106 /nfs/dbraw/zinc/44/81/06/393448106.db2.gz QBFIFLIUXGSQLD-LBPRGKRZSA-N 0 3 277.364 2.641 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@H](C3CC3)C2)cc1OC ZINC000372391929 393448113 /nfs/dbraw/zinc/44/81/13/393448113.db2.gz QBFIFLIUXGSQLD-LBPRGKRZSA-N 0 3 277.364 2.641 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCO[C@]2(CCOC2)C1)c1ccccc1[O-] ZINC000372470885 393449932 /nfs/dbraw/zinc/44/99/32/393449932.db2.gz GVEUYLRVLYDEAJ-JLJPHGGASA-N 0 3 291.391 2.771 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1[O-] ZINC000374156481 393486672 /nfs/dbraw/zinc/48/66/72/393486672.db2.gz GLHCNNPVXFTHRB-APHBMKBZSA-N 0 3 291.391 2.694 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC(=O)N2CCCC[C@@H]12)c1ccccc1[O-] ZINC000374508095 393498248 /nfs/dbraw/zinc/49/82/48/393498248.db2.gz UFWHBEDPCIXKDO-KKUMJFAQSA-N 0 3 288.391 2.586 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CC(=O)N3CCCC[C@H]23)c([O-])c1 ZINC000374504881 393498536 /nfs/dbraw/zinc/49/85/36/393498536.db2.gz MLOXYYZMBOVMRI-NWANDNLSSA-N 0 3 288.391 2.505 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000190683770 393583888 /nfs/dbraw/zinc/58/38/88/393583888.db2.gz QMXXGYBGMGHFEC-SNVBAGLBSA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000190683770 393583896 /nfs/dbraw/zinc/58/38/96/393583896.db2.gz QMXXGYBGMGHFEC-SNVBAGLBSA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1[O-] ZINC000105447134 393863509 /nfs/dbraw/zinc/86/35/09/393863509.db2.gz KSIFAIQNMIIBRB-GFCCVEGCSA-N 0 3 257.333 2.819 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c1[O-] ZINC000271728846 394022912 /nfs/dbraw/zinc/02/29/12/394022912.db2.gz MPAQTJFHUCISJQ-AWEZNQCLSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c1[O-] ZINC000271728846 394022917 /nfs/dbraw/zinc/02/29/17/394022917.db2.gz MPAQTJFHUCISJQ-AWEZNQCLSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(=O)N2CCCCC2)c([O-])c1 ZINC000123723058 393986619 /nfs/dbraw/zinc/98/66/19/393986619.db2.gz BVZPQKYMQFCHLH-CQSZACIVSA-N 0 3 290.407 2.754 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCOCC[C@@H]2C)c1[O-] ZINC000367706617 394261153 /nfs/dbraw/zinc/26/11/53/394261153.db2.gz NVRGGUDFGDFWQJ-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCOCC[C@@H]2C)c1[O-] ZINC000367706617 394261158 /nfs/dbraw/zinc/26/11/58/394261158.db2.gz NVRGGUDFGDFWQJ-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccncc2)c1 ZINC000020140033 171026692 /nfs/dbraw/zinc/02/66/92/171026692.db2.gz OPPJIAABVXYJPT-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000020146151 171031896 /nfs/dbraw/zinc/03/18/96/171031896.db2.gz ORKNIAXBYYWZIC-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCOC(C)C)c1 ZINC000020198127 171061665 /nfs/dbraw/zinc/06/16/65/171061665.db2.gz HRASJCXOOWQWJE-GFCCVEGCSA-N 0 3 267.369 2.867 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCc3c2cnn3C)cc1 ZINC000030908579 171626783 /nfs/dbraw/zinc/62/67/83/171626783.db2.gz CLRUDTBNPLCOLR-INIZCTEOSA-N 0 3 284.407 2.653 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](O)c2ccccc2)c1[O-] ZINC000035601312 172289910 /nfs/dbraw/zinc/28/99/10/172289910.db2.gz UCYHINXBNQZISQ-OAHLLOKOSA-N 0 3 287.359 2.614 20 10 CFCDHN Cc1ccc2c(c1)N(C(=O)c1cccc3c1CCNC3)CC2 ZINC000662547930 414563002 /nfs/dbraw/zinc/56/30/02/414563002.db2.gz BSKIZHCGWYLWDU-UHFFFAOYSA-N 0 3 292.382 2.844 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCn2ccnc2)c1 ZINC000035629005 260030895 /nfs/dbraw/zinc/03/08/95/260030895.db2.gz DDRSZXLQBAIQSQ-CYBMUJFWSA-N 0 3 259.353 2.638 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2NCc1ccc2c(c1)CCO2 ZINC000037363415 260094971 /nfs/dbraw/zinc/09/49/71/260094971.db2.gz UTIGXPVCSBMOKO-OAHLLOKOSA-N 0 3 283.375 2.522 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](CO)Cc2ccccc2)cc1C ZINC000152709273 261068220 /nfs/dbraw/zinc/06/82/20/261068220.db2.gz NMPLAQFGSPOGRH-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2[C@H]3COC[C@H]32)c([O-])c1C ZINC000367696118 267109592 /nfs/dbraw/zinc/10/95/92/267109592.db2.gz DXDSLBDTYTYCOH-NGFQHRJXSA-N 0 3 261.365 2.552 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@](F)(CO)C1 ZINC000367691079 267109602 /nfs/dbraw/zinc/10/96/02/267109602.db2.gz ZYLGXLVHOLPIGX-UKRRQHHQSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@](F)(CO)C1 ZINC000367691079 267109605 /nfs/dbraw/zinc/10/96/05/267109605.db2.gz ZYLGXLVHOLPIGX-UKRRQHHQSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCN2CCC1CC2 ZINC000367690599 267109733 /nfs/dbraw/zinc/10/97/33/267109733.db2.gz ULADCNIRMGMJNU-HNNXBMFYSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCN2CCC1CC2 ZINC000367690599 267109736 /nfs/dbraw/zinc/10/97/36/267109736.db2.gz ULADCNIRMGMJNU-HNNXBMFYSA-N 0 3 260.381 2.623 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@H]3OCC[C@H]32)c1 ZINC000368052872 267143054 /nfs/dbraw/zinc/14/30/54/267143054.db2.gz ZRCZRYJVVZBZBL-SGIREYDYSA-N 0 3 277.364 2.715 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@H]3OCC[C@H]32)c1 ZINC000368052872 267143055 /nfs/dbraw/zinc/14/30/55/267143055.db2.gz ZRCZRYJVVZBZBL-SGIREYDYSA-N 0 3 277.364 2.715 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCO[C@@]2(CCCOC2)C1 ZINC000368052470 267143078 /nfs/dbraw/zinc/14/30/78/267143078.db2.gz WDOVNGZKCWIWSH-RDJZCZTQSA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCO[C@@]2(CCCOC2)C1 ZINC000368052470 267143080 /nfs/dbraw/zinc/14/30/80/267143080.db2.gz WDOVNGZKCWIWSH-RDJZCZTQSA-N 0 3 291.391 2.725 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000368593395 267189983 /nfs/dbraw/zinc/18/99/83/267189983.db2.gz SRXDCJYRCIERMZ-ZDUSSCGKSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000368593395 267189988 /nfs/dbraw/zinc/18/99/88/267189988.db2.gz SRXDCJYRCIERMZ-ZDUSSCGKSA-N 0 3 279.355 2.780 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000368667202 267196185 /nfs/dbraw/zinc/19/61/85/267196185.db2.gz QDGXCLZSISPYTE-SUMWQHHRSA-N 0 3 293.407 2.802 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000368667202 267196187 /nfs/dbraw/zinc/19/61/87/267196187.db2.gz QDGXCLZSISPYTE-SUMWQHHRSA-N 0 3 293.407 2.802 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[NH+]1CCC2(CCOC2=O)CC1 ZINC000368800044 267206425 /nfs/dbraw/zinc/20/64/25/267206425.db2.gz ZXVHCXHNUDQLDL-CQSZACIVSA-N 0 3 289.375 2.872 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[NH+]1CCC2(CCOC2=O)CC1 ZINC000368800043 267206735 /nfs/dbraw/zinc/20/67/35/267206735.db2.gz ZXVHCXHNUDQLDL-AWEZNQCLSA-N 0 3 289.375 2.872 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2CCN(C)[C@@H]2C1 ZINC000369930739 267277104 /nfs/dbraw/zinc/27/71/04/267277104.db2.gz OOYBWGVBOWVQER-FVQBIDKESA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H]2CCN(C)[C@@H]2C1 ZINC000369930739 267277105 /nfs/dbraw/zinc/27/71/05/267277105.db2.gz OOYBWGVBOWVQER-FVQBIDKESA-N 0 3 274.408 2.869 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c1 ZINC000370394025 267315950 /nfs/dbraw/zinc/31/59/50/267315950.db2.gz DHJLBBGYTKNAGQ-AAEUAGOBSA-N 0 3 271.364 2.632 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCO[C@H]2C2CC2)cc1F ZINC000371206325 267370802 /nfs/dbraw/zinc/37/08/02/267370802.db2.gz FTMYNHGYNAPRBM-HOCLYGCPSA-N 0 3 278.371 2.549 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCO[C@@H]2C2CC2)c([O-])c1 ZINC000371219339 267374717 /nfs/dbraw/zinc/37/47/17/267374717.db2.gz KVRGKQCQGLVCLD-NVXWUHKLSA-N 0 3 291.391 2.838 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](c3ccco3)C2)c1[O-] ZINC000371331520 267392333 /nfs/dbraw/zinc/39/23/33/267392333.db2.gz IOEQVJAMUZPOQE-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](c3ccco3)C2)c1[O-] ZINC000371331520 267392336 /nfs/dbraw/zinc/39/23/36/267392336.db2.gz IOEQVJAMUZPOQE-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@]1(O)CCc3ccccc31)CC2 ZINC000297050646 275061602 /nfs/dbraw/zinc/06/16/02/275061602.db2.gz VOVZWRCIVKOXOV-LPHOPBHVSA-N 0 3 295.382 2.803 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000245887697 276175066 /nfs/dbraw/zinc/17/50/66/276175066.db2.gz MKSNWQUOPSUOSJ-DGCLKSJQSA-N 0 3 266.360 2.666 20 10 CFCDHN CN(C)c1ccc(CNC[C@@H]2COC3(CCCC3)O2)cc1 ZINC000271411661 276802239 /nfs/dbraw/zinc/80/22/39/276802239.db2.gz KFYONHNMTMNMRP-MRXNPFEDSA-N 0 3 290.407 2.528 20 10 CFCDHN CC(C)n1ncc2c1C[C@H]([NH2+]Cc1ccccc1[O-])CC2 ZINC000365142819 278144834 /nfs/dbraw/zinc/14/48/34/278144834.db2.gz UFEKRPNPHZRVQR-OAHLLOKOSA-N 0 3 285.391 2.817 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@@H](C)N(C3CC3)C2)c1 ZINC000185672188 295168417 /nfs/dbraw/zinc/16/84/17/295168417.db2.gz GYXVUFZSAMXEHD-FRRDWIJNSA-N 0 3 290.407 2.677 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1COc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000367996696 327087513 /nfs/dbraw/zinc/08/75/13/327087513.db2.gz ITFHRDSQSOYJFN-HDMKZQKVSA-N 0 3 299.370 2.928 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+]Cc2cc(OC)ccc2[O-])C12CCC2 ZINC000181966074 329238448 /nfs/dbraw/zinc/23/84/48/329238448.db2.gz FRBIUUTUOBPLGV-CVEARBPZSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000527934408 330297751 /nfs/dbraw/zinc/29/77/51/330297751.db2.gz WSLFMUSRWQDRHJ-RYUDHWBXSA-N 0 3 267.344 2.999 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2Cc3ccccc3NC2=O)c([O-])c1 ZINC000528000718 330299995 /nfs/dbraw/zinc/29/99/95/330299995.db2.gz NWWJUSDMWIELJA-LRDDRELGSA-N 0 3 296.370 2.915 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2Cc3ccccc3NC2=O)c([O-])c1 ZINC000528000720 330300091 /nfs/dbraw/zinc/30/00/91/330300091.db2.gz NWWJUSDMWIELJA-WBMJQRKESA-N 0 3 296.370 2.915 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC23CC(C2)CO3)c([O-])c1 ZINC000527976776 330302086 /nfs/dbraw/zinc/30/20/86/330302086.db2.gz CVEDACXPRHNJFY-VEAWUBTESA-N 0 3 261.365 2.839 20 10 CFCDHN C[C@@H]1C[C@H](N[C@@H]2CC[NH2+]C23CCC3)c2c1c(F)ccc2[O-] ZINC000530215987 333528393 /nfs/dbraw/zinc/52/83/93/333528393.db2.gz LKAQJOGNPKZXSG-SCDSUCTJSA-N 0 3 290.382 2.954 20 10 CFCDHN CC[C@@H](C)C[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000096477779 521972715 /nfs/dbraw/zinc/97/27/15/521972715.db2.gz UXDCGUHQZNLLDE-SNVBAGLBSA-N 0 3 251.326 2.599 20 10 CFCDHN CC[C@@H](C)C[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000096477779 521972730 /nfs/dbraw/zinc/97/27/30/521972730.db2.gz UXDCGUHQZNLLDE-SNVBAGLBSA-N 0 3 251.326 2.599 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](C)N(C)C2CC2)c1[O-] ZINC000230934461 522541324 /nfs/dbraw/zinc/54/13/24/522541324.db2.gz SKGSLICAPHOOBL-SNVBAGLBSA-N 0 3 298.814 2.627 20 10 CFCDHN CCC1(O)CCN(Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000292679636 519847179 /nfs/dbraw/zinc/84/71/79/519847179.db2.gz BRBIVNFVRPEVRR-UHFFFAOYSA-N 0 3 276.424 2.798 20 10 CFCDHN CC(C)n1cc(CNCc2ccc(N(C)C)cc2)cn1 ZINC000226239282 519956596 /nfs/dbraw/zinc/95/65/96/519956596.db2.gz GFOLYBFUGKGAGS-UHFFFAOYSA-N 0 3 272.396 2.820 20 10 CFCDHN CCOCc1cc(CN[C@]2(C)CCOC2)ccc1OC ZINC000270188606 520187998 /nfs/dbraw/zinc/18/79/98/520187998.db2.gz XTTAWOADCNSYRQ-MRXNPFEDSA-N 0 3 279.380 2.500 20 10 CFCDHN CCN(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(C)c(C)c1O ZINC000276583726 520214780 /nfs/dbraw/zinc/21/47/80/520214780.db2.gz INBAWVLERCVKRU-STQMWFEESA-N 0 3 278.396 2.526 20 10 CFCDHN CCN(C)CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293826311 520236917 /nfs/dbraw/zinc/23/69/17/520236917.db2.gz SGBXDSWZTRSEJI-CYBMUJFWSA-N 0 3 250.386 2.611 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC([C@@H](C)O)CC2)c([O-])c1 ZINC000092970496 520347913 /nfs/dbraw/zinc/34/79/13/520347913.db2.gz UGFDCYFBNBDGHI-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H](C)CCCO)c([O-])c1 ZINC000294668609 520365458 /nfs/dbraw/zinc/36/54/58/520365458.db2.gz APVBZUHRVCQORP-ZDUSSCGKSA-N 0 3 281.396 2.679 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@@]12CCCO2 ZINC000274251218 520434253 /nfs/dbraw/zinc/43/42/53/520434253.db2.gz SHWAVSXJTPZENF-SJWGOKEGSA-N 0 3 291.391 2.769 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])[C@H]1[C@H]1CCCO1 ZINC000291658501 520482763 /nfs/dbraw/zinc/48/27/63/520482763.db2.gz VFHJTQBMSDAFOP-CABCVRRESA-N 0 3 261.365 2.782 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])[C@H]1[C@H]1CCCO1 ZINC000291658501 520482767 /nfs/dbraw/zinc/48/27/67/520482767.db2.gz VFHJTQBMSDAFOP-CABCVRRESA-N 0 3 261.365 2.782 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+]Cc1cccc(C)c1[O-] ZINC000224876014 520702028 /nfs/dbraw/zinc/70/20/28/520702028.db2.gz FBZPERWAHBPNNK-ZDUSSCGKSA-N 0 3 251.370 2.589 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+]Cc1cccc(OCC)c1[O-] ZINC000231391826 520702247 /nfs/dbraw/zinc/70/22/47/520702247.db2.gz LEBXYLPVSSFPHN-ZDUSSCGKSA-N 0 3 281.396 2.679 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000278734090 520957432 /nfs/dbraw/zinc/95/74/32/520957432.db2.gz QSVROVIWHGZOHY-HNNXBMFYSA-N 0 3 267.344 2.658 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000278734090 520957441 /nfs/dbraw/zinc/95/74/41/520957441.db2.gz QSVROVIWHGZOHY-HNNXBMFYSA-N 0 3 267.344 2.658 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000290065105 520966140 /nfs/dbraw/zinc/96/61/40/520966140.db2.gz FMOIPRUGFZDGPZ-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000290065105 520966147 /nfs/dbraw/zinc/96/61/47/520966147.db2.gz FMOIPRUGFZDGPZ-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280247426 521139191 /nfs/dbraw/zinc/13/91/91/521139191.db2.gz WJFBDGMFBKWNBI-HIFRSBDPSA-N 0 3 290.407 2.752 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2cccc(C)c2[O-])C1 ZINC000280774700 521140465 /nfs/dbraw/zinc/14/04/65/521140465.db2.gz PBSFAGFNRODKLE-OCCSQVGLSA-N 0 3 277.364 2.522 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@@H]2CCCOC2)c1[O-] ZINC000156031372 521330680 /nfs/dbraw/zinc/33/06/80/521330680.db2.gz NBSBRCUNORYBHE-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@@H]2CCCOC2)c1[O-] ZINC000156031372 521330688 /nfs/dbraw/zinc/33/06/88/521330688.db2.gz NBSBRCUNORYBHE-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[NH2+]CCC(OCC)OCC)c1[O-] ZINC000276198423 521362891 /nfs/dbraw/zinc/36/28/91/521362891.db2.gz JCGSKSQUSMVRST-UHFFFAOYSA-N 0 3 297.395 2.670 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@]2(O)CCCC2(C)C)c1[O-] ZINC000293064839 521364043 /nfs/dbraw/zinc/36/40/43/521364043.db2.gz UXGXPFUOBGKPFB-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN CCOC(CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-])OCC ZINC000276516398 521629903 /nfs/dbraw/zinc/62/99/03/521629903.db2.gz LMAZAUQEBHRVPY-LBPRGKRZSA-N 0 3 297.395 2.841 20 10 CFCDHN CCOC(CC[NH2+]Cc1cc(C)ccc1[O-])OCC ZINC000276202851 521630040 /nfs/dbraw/zinc/63/00/40/521630040.db2.gz JVWRGZXSXZMYIK-UHFFFAOYSA-N 0 3 267.369 2.579 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000087014143 521657510 /nfs/dbraw/zinc/65/75/10/521657510.db2.gz RAVGLYGDIRBYGV-LBPRGKRZSA-N 0 3 251.370 2.902 20 10 CFCDHN CCOCC(C)(C)NCc1ccc(N(C)C)c(F)c1 ZINC000293095357 521670716 /nfs/dbraw/zinc/67/07/16/521670716.db2.gz XHHCRMWPNJKPPW-UHFFFAOYSA-N 0 3 268.376 2.796 20 10 CFCDHN CN(C)Cc1ccc(C(=O)N(C)Cc2ccccc2O)cc1 ZINC000101645714 521892327 /nfs/dbraw/zinc/89/23/27/521892327.db2.gz UGIOVBQFGSWFAY-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN CC[C@H](C[NH2+]Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000227711729 522198932 /nfs/dbraw/zinc/19/89/32/522198932.db2.gz UJCZHKCYNJWSGU-CYBMUJFWSA-N 0 3 294.395 2.785 20 10 CFCDHN CC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000094949416 522510029 /nfs/dbraw/zinc/51/00/29/522510029.db2.gz SBVALKVSFPENMC-STQMWFEESA-N 0 3 251.370 2.760 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273792561 522539867 /nfs/dbraw/zinc/53/98/67/522539867.db2.gz VLRPCWBHNDYOCR-QWRGUYRKSA-N 0 3 299.798 2.959 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(C)CC1)c1ccc(C)cc1[O-] ZINC000280138209 522559029 /nfs/dbraw/zinc/55/90/29/522559029.db2.gz PMKAMWIWXTXBDB-HNNXBMFYSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000280040323 522610280 /nfs/dbraw/zinc/61/02/80/522610280.db2.gz IUGADNPSAIUXSM-DOTOQJQBSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccccc1[O-] ZINC000085976815 522631804 /nfs/dbraw/zinc/63/18/04/522631804.db2.gz DSVIBOAPIOQPGF-SNPRPXQTSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@@H]1CCCO1)c1ccccc1[O-] ZINC000278946034 522709926 /nfs/dbraw/zinc/70/99/26/522709926.db2.gz YUPFRDRZGYVUME-DZKIICNBSA-N 0 3 279.380 2.627 20 10 CFCDHN COCC(C)(C)CCC[NH2+]Cc1cc(OC)ccc1[O-] ZINC000290593626 522805334 /nfs/dbraw/zinc/80/53/34/522805334.db2.gz VLLMXKFFHWWWHB-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CN(CC[N@H+](C)C1CC1)Cc1c([O-])cccc1Cl ZINC000290315014 522810141 /nfs/dbraw/zinc/81/01/41/522810141.db2.gz CKXLJTDMDBPRDV-UHFFFAOYSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(CC[N@@H+](C)C1CC1)Cc1c([O-])cccc1Cl ZINC000290315014 522810152 /nfs/dbraw/zinc/81/01/52/522810152.db2.gz CKXLJTDMDBPRDV-UHFFFAOYSA-N 0 3 268.788 2.572 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1ccccc1[O-] ZINC000274783145 522857144 /nfs/dbraw/zinc/85/71/44/522857144.db2.gz PPORFCHAHKPOOV-ZYHUDNBSSA-N 0 3 277.286 2.746 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)C(C)C)c1ccc(C)cc1[O-] ZINC000280063978 522860691 /nfs/dbraw/zinc/86/06/91/522860691.db2.gz KOAZPWNDLZIRFZ-HIFRSBDPSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@@H](NCc1ccc(OC)c(C)c1)[C@@H](O)C(F)(F)F ZINC000270864472 522877183 /nfs/dbraw/zinc/87/71/83/522877183.db2.gz FAPZZNBYJNYOIO-DGCLKSJQSA-N 0 3 291.313 2.795 20 10 CFCDHN CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCO1 ZINC000102675120 523261846 /nfs/dbraw/zinc/26/18/46/523261846.db2.gz ALMDOPOTMRPCCN-INIZCTEOSA-N 0 3 262.397 2.754 20 10 CFCDHN CC[C@@H]1CN(Cc2cccc(OC)c2O)CCS1 ZINC000093502295 523455580 /nfs/dbraw/zinc/45/55/80/523455580.db2.gz LEFHEHQSOZARGL-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4cccc(C)c4[O-])[C@H]1[C@H]3C2 ZINC000289706181 523789536 /nfs/dbraw/zinc/78/95/36/523789536.db2.gz ORXDSXFAJXHNLV-WNZSCWOMSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4cccc(C)c4[O-])[C@H]1[C@H]3C2 ZINC000289706181 523789540 /nfs/dbraw/zinc/78/95/40/523789540.db2.gz ORXDSXFAJXHNLV-WNZSCWOMSA-N 0 3 273.376 2.556 20 10 CFCDHN C[C@H](CCc1ccco1)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879518 524260236 /nfs/dbraw/zinc/26/02/36/524260236.db2.gz DHVFRAUGECYONT-LLVKDONJSA-N 0 3 289.331 2.825 20 10 CFCDHN Cc1cccc(C[NH2+]Cc2cc3c(cc2[O-])OCO3)c1 ZINC000042879476 524432670 /nfs/dbraw/zinc/43/26/70/524432670.db2.gz IOTZCUGYWJMFBN-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1cccc(C[NH2+]CC2CCSCC2)c1[O-] ZINC000164691527 524432879 /nfs/dbraw/zinc/43/28/79/524432879.db2.gz DZFLODNYLNXLKY-UHFFFAOYSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)c1[O-] ZINC000291609381 524433358 /nfs/dbraw/zinc/43/33/58/524433358.db2.gz QXODIJHZVYCOLP-MJGOQNOKSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc(CN[C@]2(CO)CCc3ccccc32)c1O ZINC000305772255 524440357 /nfs/dbraw/zinc/44/03/57/524440357.db2.gz HVDDNHCVDLRMJE-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc(C[NH2+][C@]2(CO)CCc3ccccc32)c1[O-] ZINC000305772255 524440363 /nfs/dbraw/zinc/44/03/63/524440363.db2.gz HVDDNHCVDLRMJE-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1ccc(C[NH2+]Cc2cc3c(cc2[O-])OCO3)s1 ZINC000050225406 524583547 /nfs/dbraw/zinc/58/35/47/524583547.db2.gz JTSPYIQENJBIKG-UHFFFAOYSA-N 0 3 277.345 2.781 20 10 CFCDHN C[C@H]1CN2CCCC[C@@H]2C[N@@H+]1Cc1cccc(F)c1[O-] ZINC000166378276 524686294 /nfs/dbraw/zinc/68/62/94/524686294.db2.gz SRYYGSGQIAFOEU-GXTWGEPZSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@H]1CN2CCCC[C@@H]2C[N@H+]1Cc1cccc(F)c1[O-] ZINC000166378276 524686298 /nfs/dbraw/zinc/68/62/98/524686298.db2.gz SRYYGSGQIAFOEU-GXTWGEPZSA-N 0 3 278.371 2.590 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2cccc(C)n2)c1 ZINC000280295956 524762865 /nfs/dbraw/zinc/76/28/65/524762865.db2.gz ZOBBJXLEZBTADU-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccncc2)c1 ZINC000048261373 524763334 /nfs/dbraw/zinc/76/33/34/524763334.db2.gz NURGHSJULIDHLA-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](CO)c2ccccc2)c1 ZINC000062999302 524766514 /nfs/dbraw/zinc/76/65/14/524766514.db2.gz IMOUEOXLPKIPAJ-MLGOLLRUSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2cccc(C)n2)c1 ZINC000280295960 524769182 /nfs/dbraw/zinc/76/91/82/524769182.db2.gz ZOBBJXLEZBTADU-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(C)CCOCC2)c1 ZINC000230668271 524769210 /nfs/dbraw/zinc/76/92/10/524769210.db2.gz MSMKKQUWORDOMA-LBPRGKRZSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@H](C)C2)c1 ZINC000273523034 524775268 /nfs/dbraw/zinc/77/52/68/524775268.db2.gz UTSMTQJMBAHBGR-GRYCIOLGSA-N 0 3 265.353 2.619 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@]2(O)CCC[C@@H]2C)cc1C ZINC000292903020 525323943 /nfs/dbraw/zinc/32/39/43/525323943.db2.gz DWYLGBKPDFLUNY-XJKSGUPXSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000071408289 525349626 /nfs/dbraw/zinc/34/96/26/525349626.db2.gz MTKYLIANTWULHU-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000368766938 525350111 /nfs/dbraw/zinc/35/01/11/525350111.db2.gz VPIDIMIHMDHWME-SJORKVTESA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](CCO)c2ccccc2)c1 ZINC000077468172 525355031 /nfs/dbraw/zinc/35/50/31/525355031.db2.gz ZDQMKJQAAYQZOC-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1ccc(O)c(CN[C@H](CO)c2ccccc2)c1 ZINC000071409383 525355603 /nfs/dbraw/zinc/35/56/03/525355603.db2.gz DQSUQDSLXVKSOU-OAHLLOKOSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCN3CCCC[C@@H]23)c1 ZINC000217698108 525365370 /nfs/dbraw/zinc/36/53/70/525365370.db2.gz MAUUJODTONCJNA-IMJJTQAJSA-N 0 3 274.408 2.978 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)c1 ZINC000037649022 525365726 /nfs/dbraw/zinc/36/57/26/525365726.db2.gz UQVBBUDVRYXAIR-UONOGXRCSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1cc(F)ccc1[O-] ZINC000245866178 525386413 /nfs/dbraw/zinc/38/64/13/525386413.db2.gz FDEQAEWHGDNXAK-COPLHBTASA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094617094 525478694 /nfs/dbraw/zinc/47/86/94/525478694.db2.gz UVBNOISXRMQYMS-BDJLRTHQSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094617092 525496866 /nfs/dbraw/zinc/49/68/66/525496866.db2.gz UVBNOISXRMQYMS-BZNIZROVSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000290207531 525585361 /nfs/dbraw/zinc/58/53/61/525585361.db2.gz HCJYMYQTDKMCAQ-FABXCBLPSA-N 0 3 285.343 2.537 20 10 CFCDHN C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000222484705 525660424 /nfs/dbraw/zinc/66/04/24/525660424.db2.gz UNFKFOZKKUBGNX-VXGBXAGGSA-N 0 3 258.369 2.888 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCc3nccn3C2)c([O-])c1 ZINC000278952748 525730963 /nfs/dbraw/zinc/73/09/63/525730963.db2.gz LNSLBUFJXDFGAN-ZIAGYGMSSA-N 0 3 285.391 2.810 20 10 CFCDHN C[C@H](O)C[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000291101807 525739759 /nfs/dbraw/zinc/73/97/59/525739759.db2.gz RIYJMJQNCFUAOJ-ZDUSSCGKSA-N 0 3 271.360 2.872 20 10 CFCDHN C[C@H](O)C[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000291101807 525739769 /nfs/dbraw/zinc/73/97/69/525739769.db2.gz RIYJMJQNCFUAOJ-ZDUSSCGKSA-N 0 3 271.360 2.872 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)CC(C)C)c([O-])c1 ZINC000040774947 525747948 /nfs/dbraw/zinc/74/79/48/525747948.db2.gz BRSGHCLYFQJBHA-OLZOCXBDSA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000280415659 525839069 /nfs/dbraw/zinc/83/90/69/525839069.db2.gz IHFORCZWUZGMAB-BXUZGUMPSA-N 0 3 267.344 2.657 20 10 CFCDHN C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000280415659 525839078 /nfs/dbraw/zinc/83/90/78/525839078.db2.gz IHFORCZWUZGMAB-BXUZGUMPSA-N 0 3 267.344 2.657 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccccc3[C@@H]2O)c([O-])c1 ZINC000290399799 525941262 /nfs/dbraw/zinc/94/12/62/525941262.db2.gz SUZGEZDCEDVIML-PNPHSEOMSA-N 0 3 299.370 2.846 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)CC(C)C)c([O-])c1 ZINC000040774949 525942481 /nfs/dbraw/zinc/94/24/81/525942481.db2.gz BRSGHCLYFQJBHA-STQMWFEESA-N 0 3 251.370 2.758 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@@H](O)c2ccccc2)c1[O-] ZINC000289562271 526016234 /nfs/dbraw/zinc/01/62/34/526016234.db2.gz YTYSHZPMIVRLFS-OAHLLOKOSA-N 0 3 287.359 2.614 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H]2CCCCN2C2CC2)c1[O-] ZINC000277436714 526020115 /nfs/dbraw/zinc/02/01/15/526020115.db2.gz DBQSINGAYYZXHJ-OAHLLOKOSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H](C)c2nccs2)c1[O-] ZINC000230694791 526021156 /nfs/dbraw/zinc/02/11/56/526021156.db2.gz UQZAGQIPIAWJIU-JTQLQIEISA-N 0 3 278.377 2.751 20 10 CFCDHN Oc1cc2c(cc1CN[C@@H]1CCCc3occc31)OCO2 ZINC000042879594 526336331 /nfs/dbraw/zinc/33/63/31/526336331.db2.gz OSLJLOVUQRPUQH-GFCCVEGCSA-N 0 3 287.315 2.881 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H]1CCc3ccccc31)OCO2 ZINC000042879467 526336749 /nfs/dbraw/zinc/33/67/49/526336749.db2.gz HOGNKKSNGVFDHP-CQSZACIVSA-N 0 3 283.327 2.898 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293612060 526349904 /nfs/dbraw/zinc/34/99/04/526349904.db2.gz KBAHDADCSJPMLF-MRXNPFEDSA-N 0 3 291.366 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293612060 526349909 /nfs/dbraw/zinc/34/99/09/526349909.db2.gz KBAHDADCSJPMLF-MRXNPFEDSA-N 0 3 291.366 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000272363546 526351790 /nfs/dbraw/zinc/35/17/90/526351790.db2.gz FRVBEBYUSZXICP-ZDUSSCGKSA-N 0 3 265.328 2.723 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccncc1)CC2 ZINC000297098206 526369095 /nfs/dbraw/zinc/36/90/95/526369095.db2.gz XPAQMLKSXKYCEF-CQSZACIVSA-N 0 3 254.333 2.607 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000291731648 526374749 /nfs/dbraw/zinc/37/47/49/526374749.db2.gz NUCFDBFHQVKYRR-CQSZACIVSA-N 0 3 286.350 2.900 20 10 CFCDHN Cc1nc(CC[NH2+]Cc2cc(C)ccc2[O-])cs1 ZINC000226645987 526826072 /nfs/dbraw/zinc/82/60/72/526826072.db2.gz SGHSGQPBRHYDMJ-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN [O-]c1ccccc1[C@H](CCc1ccccc1)[NH2+]CCO ZINC000293219771 527555578 /nfs/dbraw/zinc/55/55/78/527555578.db2.gz AIBFXKWRQWBTOD-INIZCTEOSA-N 0 3 271.360 2.648 20 10 CFCDHN CN(C)c1ccc(CNCc2n[nH]c3ccccc23)cc1 ZINC000727464658 574051408 /nfs/dbraw/zinc/05/14/08/574051408.db2.gz VFNNQDMLTZUHSL-UHFFFAOYSA-N 0 3 280.375 2.919 20 10 CFCDHN CN(C)c1ccc(CNCc2[nH]nc3ccccc32)cc1 ZINC000727464658 574051412 /nfs/dbraw/zinc/05/14/12/574051412.db2.gz VFNNQDMLTZUHSL-UHFFFAOYSA-N 0 3 280.375 2.919 20 10 CFCDHN CC(C)N1CCC[N@H+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000727823224 574066837 /nfs/dbraw/zinc/06/68/37/574066837.db2.gz DFKDUNULWFQLDH-UHFFFAOYSA-N 0 3 299.418 2.857 20 10 CFCDHN CC(C)N1CCC[N@@H+](Cc2c([O-])ccc3ccncc32)CC1 ZINC000727823224 574066839 /nfs/dbraw/zinc/06/68/39/574066839.db2.gz DFKDUNULWFQLDH-UHFFFAOYSA-N 0 3 299.418 2.857 20 10 CFCDHN Cc1cc(CN(C)c2ccc(OCCN(C)C)cc2)no1 ZINC000732410455 574156866 /nfs/dbraw/zinc/15/68/66/574156866.db2.gz AAQDURPEYCNITM-UHFFFAOYSA-N 0 3 289.379 2.560 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@](C)(O)[C@H](C)CC)c([O-])c1 ZINC000732820961 574173223 /nfs/dbraw/zinc/17/32/23/574173223.db2.gz QSOJMCABRFRREQ-MLGOLLRUSA-N 0 3 281.396 2.678 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)CC2CCOCC2)c([O-])c1 ZINC000747100920 574179609 /nfs/dbraw/zinc/17/96/09/574179609.db2.gz YFQOMTQLNHHZKV-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)CC2CCOCC2)c1[O-] ZINC000747100840 574179948 /nfs/dbraw/zinc/17/99/48/574179948.db2.gz VYZNQLAHAAEVQA-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN CCn1nc(C)c(CNCc2cc(C)ccc2O)c1C ZINC000733327196 574221636 /nfs/dbraw/zinc/22/16/36/574221636.db2.gz PKFFNFPYDWYXJS-UHFFFAOYSA-N 0 3 273.380 2.824 20 10 CFCDHN Cc1ccc(O)c(CNCc2cccc3c2OCCO3)c1 ZINC000733332284 574222841 /nfs/dbraw/zinc/22/28/41/574222841.db2.gz XEAOGTRAZWSUAY-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN CC(C)(C)c1cc(O)c(O)c(CN2CCCOCC2)c1 ZINC000748073307 574227057 /nfs/dbraw/zinc/22/70/57/574227057.db2.gz XTQQKVDXYBRDAR-UHFFFAOYSA-N 0 3 279.380 2.618 20 10 CFCDHN COC[C@H](C)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756342665 574227212 /nfs/dbraw/zinc/22/72/12/574227212.db2.gz UFUKQBYOYOBDTK-NWDGAFQWSA-N 0 3 263.381 2.957 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000756356075 574228685 /nfs/dbraw/zinc/22/86/85/574228685.db2.gz ZZODYIJGOLAOBZ-FOGDFJRCSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756397260 574233710 /nfs/dbraw/zinc/23/37/10/574233710.db2.gz QDTNULQWLVAZMV-DGCLKSJQSA-N 0 3 289.354 2.956 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756455755 574238847 /nfs/dbraw/zinc/23/88/47/574238847.db2.gz KQURDJXZXCTCCF-JQWIXIFHSA-N 0 3 294.370 2.538 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCCC(=O)N(C)C)c2c1c(F)ccc2[O-] ZINC000756480148 574240253 /nfs/dbraw/zinc/24/02/53/574240253.db2.gz REORXHAIMDWJAG-ZYHUDNBSSA-N 0 3 294.370 2.538 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cc(F)ccc1[O-] ZINC000756550453 574246447 /nfs/dbraw/zinc/24/64/47/574246447.db2.gz HTBDQFBKVUJAKA-FZMZJTMJSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@](C)(O)C2CC2)c2c1c(F)ccc2[O-] ZINC000756568626 574248726 /nfs/dbraw/zinc/24/87/26/574248726.db2.gz GYJVSQLAZHSCMP-VYROHLMNSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2(C)COC2)c2c1c(F)ccc2[O-] ZINC000756570575 574248772 /nfs/dbraw/zinc/24/87/72/574248772.db2.gz ALLSPWMTQOTDLR-MWLCHTKSSA-N 0 3 265.328 2.706 20 10 CFCDHN C[C@H]([NH2+]CCOc1cccnc1)c1cc(F)ccc1[O-] ZINC000756570198 574248811 /nfs/dbraw/zinc/24/88/11/574248811.db2.gz BJKSEHVGGKHNPX-NSHDSACASA-N 0 3 276.311 2.656 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@H]2CCCO2)c([O-])c1 ZINC000756585110 574250345 /nfs/dbraw/zinc/25/03/45/574250345.db2.gz XHJCDNASPUAGRT-UONOGXRCSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CC[C@H](C)C2)c([O-])c1 ZINC000756626219 574253440 /nfs/dbraw/zinc/25/34/40/574253440.db2.gz AXLCEGMEWGLSPP-KBPBESRZSA-N 0 3 262.397 2.693 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)C[C@@H]2CCOC2)c1 ZINC000756644954 574254995 /nfs/dbraw/zinc/25/49/95/574254995.db2.gz DJNCGFTTWAZOOC-AVGNSLFASA-N 0 3 279.380 2.867 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000756647684 574255103 /nfs/dbraw/zinc/25/51/03/574255103.db2.gz QZPZVGLNHTZWCK-XEZPLFJOSA-N 0 3 274.408 2.834 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756659231 574255872 /nfs/dbraw/zinc/25/58/72/574255872.db2.gz PVPBKRZCJKXVQP-JFGNBEQYSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](CO)Cc2ccco2)c1 ZINC000756659733 574256180 /nfs/dbraw/zinc/25/61/80/574256180.db2.gz FNRIUEOFABUZLH-UONOGXRCSA-N 0 3 289.375 2.795 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)Cc2ccco2)c([O-])c1 ZINC000756661189 574256316 /nfs/dbraw/zinc/25/63/16/574256316.db2.gz PMINSCLLLRBTDY-KGLIPLIRSA-N 0 3 289.375 2.795 20 10 CFCDHN CCn1cnnc1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756732758 574259664 /nfs/dbraw/zinc/25/96/64/574259664.db2.gz LDHZJFUZHIFCCV-ZDUSSCGKSA-N 0 3 288.395 2.514 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CCO)C2CC2)c([O-])c1C ZINC000756738758 574260102 /nfs/dbraw/zinc/26/01/02/574260102.db2.gz KXHNHYRLMDFOFX-IUODEOHRSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1cc(CN[C@@H]2C[C@@H](C)c3c2c(O)ccc3F)ncn1 ZINC000756775427 574261639 /nfs/dbraw/zinc/26/16/39/574261639.db2.gz HKSATHZMGAAFAA-NOZJJQNGSA-N 0 3 287.338 2.968 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cnccn2)c([O-])c1C ZINC000756788920 574263435 /nfs/dbraw/zinc/26/34/35/574263435.db2.gz YZGKKXSRDAHQTG-ZDUSSCGKSA-N 0 3 271.364 2.692 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H](C)c2ccncc2)c1[O-] ZINC000749295134 574288271 /nfs/dbraw/zinc/28/82/71/574288271.db2.gz ISUJIQKYRSVYTI-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN CC[C@@H](C)C[N@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891693624 617714345 /nfs/dbraw/zinc/71/43/45/617714345.db2.gz GNEINCMGZDTWDV-LLVKDONJSA-N 0 3 267.369 2.887 20 10 CFCDHN CC[C@@H](C)C[N@@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891693624 617714346 /nfs/dbraw/zinc/71/43/46/617714346.db2.gz GNEINCMGZDTWDV-LLVKDONJSA-N 0 3 267.369 2.887 20 10 CFCDHN Cc1cc(N)nc(NCc2ccc(N3CCCC3)cc2)n1 ZINC000891796840 617757793 /nfs/dbraw/zinc/75/77/93/617757793.db2.gz QZJBWRGEMCOSCA-UHFFFAOYSA-N 0 3 283.379 2.580 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)CCS1 ZINC000892068163 617936979 /nfs/dbraw/zinc/93/69/79/617936979.db2.gz ZVJVHEAFONQTRX-LBPRGKRZSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cccc(CNCc2ccccc2[N+](=O)[O-])c1O ZINC000050015529 618060215 /nfs/dbraw/zinc/06/02/15/618060215.db2.gz CLGZBUNHNFLUPN-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc(F)cc2F)c1 ZINC000051016675 618190511 /nfs/dbraw/zinc/19/05/11/618190511.db2.gz ZHHJPCGTTMDODC-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN COc1ccc(C[NH+]2CCCCCC2)c([O-])c1OC ZINC000891444479 618207414 /nfs/dbraw/zinc/20/74/14/618207414.db2.gz PFQAISCOHGODQS-UHFFFAOYSA-N 0 3 265.353 2.785 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@H](CC)c1ccccc1[O-] ZINC000229554674 618218115 /nfs/dbraw/zinc/21/81/15/618218115.db2.gz QQVRBELDSFOZGQ-UKRRQHHQSA-N 0 3 251.370 2.984 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000840879710 618360579 /nfs/dbraw/zinc/36/05/79/618360579.db2.gz HFASSFMIMYTRDU-JSGCOSHPSA-N 0 3 289.350 2.958 20 10 CFCDHN CCN(C)c1ccc(CNCc2ccc(N(C)C)cc2)cn1 ZINC000190698245 618379463 /nfs/dbraw/zinc/37/94/63/618379463.db2.gz KFAFBORODYYZIV-UHFFFAOYSA-N 0 3 298.434 2.894 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCO)CSC)c1ccc(C)cc1[O-] ZINC000794802379 618456452 /nfs/dbraw/zinc/45/64/52/618456452.db2.gz NMPVZABVRSKVQU-GXTWGEPZSA-N 0 3 283.437 2.855 20 10 CFCDHN CC1=NO[C@H](CNCc2ccc(N3CCCCC3)cc2)C1 ZINC000895312139 618527162 /nfs/dbraw/zinc/52/71/62/618527162.db2.gz URJYJAAWZQOZAV-KRWDZBQOSA-N 0 3 287.407 2.931 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2CCc3cccnc32)c1 ZINC000895392955 618565220 /nfs/dbraw/zinc/56/52/20/618565220.db2.gz WYMAVSHVWNFGJV-AWEZNQCLSA-N 0 3 254.333 2.873 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000311028070 618673716 /nfs/dbraw/zinc/67/37/16/618673716.db2.gz DMOGAWGCYGAQJL-QWHCGFSZSA-N 0 3 250.386 2.772 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@H](C)C(=O)NC(C)C)cc1 ZINC000840890307 618724466 /nfs/dbraw/zinc/72/44/66/618724466.db2.gz LYXBAMVYODRXOQ-UONOGXRCSA-N 0 3 291.439 2.706 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)CC2 ZINC000312013518 618854263 /nfs/dbraw/zinc/85/42/63/618854263.db2.gz JJRXBEMAWFNASZ-MRVWCRGKSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000185028495 618921498 /nfs/dbraw/zinc/92/14/98/618921498.db2.gz APQSWZBLOCXNCK-OLZOCXBDSA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@H]([NH2+][C@H]1COCC1(C)C)c1cc(F)ccc1[O-] ZINC000313061266 618974103 /nfs/dbraw/zinc/97/41/03/618974103.db2.gz HZMMKTWVRFKMCT-ZANVPECISA-N 0 3 253.317 2.607 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1ccn(C)n1 ZINC000840975232 619200283 /nfs/dbraw/zinc/20/02/83/619200283.db2.gz DYFCDSHTMPCPQN-CQSZACIVSA-N 0 3 286.423 2.515 20 10 CFCDHN Cc1ncoc1CNCCCSc1nccs1 ZINC000894304147 619319077 /nfs/dbraw/zinc/31/90/77/619319077.db2.gz OLIMLNDQTWFUJV-UHFFFAOYSA-N 0 3 269.395 2.712 20 10 CFCDHN CC[C@H](CSC)[N@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000894497194 619400433 /nfs/dbraw/zinc/40/04/33/619400433.db2.gz VMAPZIIQNJURTQ-GFCCVEGCSA-N 0 3 299.436 2.983 20 10 CFCDHN CC[C@H](CSC)[N@@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000894497194 619400434 /nfs/dbraw/zinc/40/04/34/619400434.db2.gz VMAPZIIQNJURTQ-GFCCVEGCSA-N 0 3 299.436 2.983 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)Cc1ccccc1F ZINC000895749387 619595368 /nfs/dbraw/zinc/59/53/68/619595368.db2.gz NYAWIMXKDATUMP-CQSZACIVSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@@]1(Br)C[C@H]1CN1Cc2cccc(O)c2C1 ZINC000895786067 619606705 /nfs/dbraw/zinc/60/67/05/619606705.db2.gz WXKRQUKEDFYQSF-GXFFZTMASA-N 0 3 282.181 2.881 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)C3)O2)c([O-])c1 ZINC000895817198 619614178 /nfs/dbraw/zinc/61/41/78/619614178.db2.gz HAJZANDGEJGBPV-KMFMINBZSA-N 0 3 291.391 2.517 20 10 CFCDHN CCn1cc(C[NH2+][C@@H](C)c2ccccc2[O-])c(C)n1 ZINC000895852695 619623317 /nfs/dbraw/zinc/62/33/17/619623317.db2.gz YMBCFTQUJRIYQK-LBPRGKRZSA-N 0 3 259.353 2.768 20 10 CFCDHN COc1cc2c(cc1O)CCN(Cc1ccc(C)cc1O)C2 ZINC000895888717 619628045 /nfs/dbraw/zinc/62/80/45/619628045.db2.gz VPBIGYFFOGXGIY-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN CCc1cccc(CNCc2cc(N(C)C)ccn2)c1O ZINC000896299068 619711898 /nfs/dbraw/zinc/71/18/98/619711898.db2.gz QCZPJAIFWSZDCV-UHFFFAOYSA-N 0 3 285.391 2.705 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](CO)CCc1ccccc1 ZINC000896522675 619756054 /nfs/dbraw/zinc/75/60/54/619756054.db2.gz PTDBENLGGKXTCN-INIZCTEOSA-N 0 3 289.350 2.615 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCC2(CCOCC2)O1 ZINC000896921903 619889720 /nfs/dbraw/zinc/88/97/20/619889720.db2.gz UFAQXOKODRZMRZ-CQSZACIVSA-N 0 3 291.391 2.518 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(OC)c2O)C[C@@H]1C ZINC000228663068 620040481 /nfs/dbraw/zinc/04/04/81/620040481.db2.gz WQPGAPAZOVHHCV-NSHDSACASA-N 0 3 298.814 2.580 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@H]1O ZINC000897684284 620270966 /nfs/dbraw/zinc/27/09/66/620270966.db2.gz LZWOIOCDGIXUJL-FZKQIMNGSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C[C@H]1O ZINC000897684284 620270968 /nfs/dbraw/zinc/27/09/68/620270968.db2.gz LZWOIOCDGIXUJL-FZKQIMNGSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@H]1CC2(CC([NH2+]Cc3cc(F)ccc3[O-])C2)CO1 ZINC000897780540 620284046 /nfs/dbraw/zinc/28/40/46/620284046.db2.gz XIRVBZWKBGXHOH-KKJMOOEGSA-N 0 3 265.328 2.579 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC000897972692 620306688 /nfs/dbraw/zinc/30/66/88/620306688.db2.gz HIMDQSQPWOYZAV-UHFFFAOYSA-N 0 3 291.391 2.838 20 10 CFCDHN CCO[C@]12CCC[C@@]1([NH2+]Cc1ccc(C)cc1[O-])CCO2 ZINC000897973711 620306781 /nfs/dbraw/zinc/30/67/81/620306781.db2.gz XUNCZUNRVZFOQQ-SJORKVTESA-N 0 3 291.391 2.866 20 10 CFCDHN COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c([O-])c1OC ZINC000898071534 620333011 /nfs/dbraw/zinc/33/30/11/620333011.db2.gz NZDNJBSDJSFENU-TXEJJXNPSA-N 0 3 277.364 2.641 20 10 CFCDHN COc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c([O-])c1OC ZINC000898071534 620333012 /nfs/dbraw/zinc/33/30/12/620333012.db2.gz NZDNJBSDJSFENU-TXEJJXNPSA-N 0 3 277.364 2.641 20 10 CFCDHN Cc1ncccc1CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000898255536 620357861 /nfs/dbraw/zinc/35/78/61/620357861.db2.gz LKVWYWLOLPJMRC-UHFFFAOYSA-N 0 3 260.312 2.567 20 10 CFCDHN COC(=O)C1CCC([NH2+]Cc2c(C)cccc2[O-])CC1 ZINC000898611070 620483506 /nfs/dbraw/zinc/48/35/06/620483506.db2.gz PXYPKZSECRRKSZ-UHFFFAOYSA-N 0 3 277.364 2.522 20 10 CFCDHN CC[C@H]([NH2+]CC1(N)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000902406099 621054844 /nfs/dbraw/zinc/05/48/44/621054844.db2.gz LJRMDWXAZOZBFN-NSHDSACASA-N 0 3 288.313 2.943 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CC1)c1ccc2ccccc2c1[O-] ZINC000902407776 621056250 /nfs/dbraw/zinc/05/62/50/621056250.db2.gz UHRHMGWVMWWYFR-LLVKDONJSA-N 0 3 256.349 2.687 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1N)c1ccccc1[O-] ZINC000902438322 621080095 /nfs/dbraw/zinc/08/00/95/621080095.db2.gz MNHNALFQQPZCTE-RGYTYGDFSA-N 0 3 268.360 2.668 20 10 CFCDHN C[C@@H](N[C@@H]1C[NH2+]CC1(C)C)c1cc(Cl)ccc1[O-] ZINC000902450786 621091574 /nfs/dbraw/zinc/09/15/74/621091574.db2.gz UKEYVLKADNNRDP-NOZJJQNGSA-N 0 3 268.788 2.694 20 10 CFCDHN C[C@@H](NC[C@@H]1CCCCC[NH2+]1)c1ccc(F)cc1[O-] ZINC000902484533 621111047 /nfs/dbraw/zinc/11/10/47/621111047.db2.gz WCXRRIYCKOYJSV-YPMHNXCESA-N 0 3 266.360 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C)[C@@H]1C)c1ccc(C)cc1[O-] ZINC000903299802 621314495 /nfs/dbraw/zinc/31/44/95/621314495.db2.gz FCWXVPAJLWDBJT-SNPRPXQTSA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCN2C)c1[O-] ZINC000903318664 621331948 /nfs/dbraw/zinc/33/19/48/621331948.db2.gz ROIOHKQOOGTAGG-ZYHUDNBSSA-N 0 3 268.788 2.709 20 10 CFCDHN COc1nn(C)cc1CN[C@H](C)c1c(C)cc(C)cc1O ZINC000903336779 621333207 /nfs/dbraw/zinc/33/32/07/621333207.db2.gz DUYNNSSVPVLMKU-GFCCVEGCSA-N 0 3 289.379 2.602 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@H](O)C1CC1)c1ccc(C)cc1[O-] ZINC000903408527 621363985 /nfs/dbraw/zinc/36/39/85/621363985.db2.gz SBLFYSUKJOEKDR-CABCVRRESA-N 0 3 263.381 2.902 20 10 CFCDHN Cn1nccc1[C@@H]1CCCN1Cc1cc2c(cc1O)CCC2 ZINC000905740576 621841981 /nfs/dbraw/zinc/84/19/81/621841981.db2.gz KVVAXKWDYOQYDK-KRWDZBQOSA-N 0 3 297.402 2.952 20 10 CFCDHN Cc1ccc(O)c(CNC(=O)C(C)(C)N2CCCCC2)c1 ZINC000913000274 622816524 /nfs/dbraw/zinc/81/65/24/622816524.db2.gz FZAWNFYBWGECEH-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN Oc1ccc(F)cc1CNCc1cccc2c1OCO2 ZINC000226585883 623083472 /nfs/dbraw/zinc/08/34/72/623083472.db2.gz ZCHZNEHHULQNBG-UHFFFAOYSA-N 0 3 275.279 2.550 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1cccc2c1OCO2 ZINC000226585883 623083476 /nfs/dbraw/zinc/08/34/76/623083476.db2.gz ZCHZNEHHULQNBG-UHFFFAOYSA-N 0 3 275.279 2.550 20 10 CFCDHN CS[C@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000226612670 623084489 /nfs/dbraw/zinc/08/44/89/623084489.db2.gz JIRMMMCNLQXZCQ-RYUDHWBXSA-N 0 3 255.358 2.905 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)c([O-])c1 ZINC000822476718 623112724 /nfs/dbraw/zinc/11/27/24/623112724.db2.gz UMUVYECJADGZAA-XBRFFFJOSA-N 0 3 291.391 2.694 20 10 CFCDHN C[C@@H](CNC(=O)OC(C)(C)C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000227685744 623116864 /nfs/dbraw/zinc/11/68/64/623116864.db2.gz YGWQRTSFWBYXOT-RYUDHWBXSA-N 0 3 294.395 2.956 20 10 CFCDHN C[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000230650181 623288798 /nfs/dbraw/zinc/28/87/98/623288798.db2.gz SBDWMNWQXHOPPF-GHMZBOCLSA-N 0 3 263.337 2.647 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000062748332 623296005 /nfs/dbraw/zinc/29/60/05/623296005.db2.gz GUVPYCYVGAKTHA-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H](O)C2)c1[O-] ZINC000230934894 623310440 /nfs/dbraw/zinc/31/04/40/623310440.db2.gz DHMALYXWXRJOPD-MFKMUULPSA-N 0 3 299.798 2.695 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@H](N2CC=CC2)C1 ZINC000172932804 623322434 /nfs/dbraw/zinc/32/24/34/623322434.db2.gz MSDYNJIYEDGRRV-MRXNPFEDSA-N 0 3 294.398 2.992 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@H](N2CC=CC2)C1 ZINC000172932804 623322441 /nfs/dbraw/zinc/32/24/41/623322441.db2.gz MSDYNJIYEDGRRV-MRXNPFEDSA-N 0 3 294.398 2.992 20 10 CFCDHN C[C@H](CC(F)(F)F)[NH2+]Cc1cc(F)ccc1[O-] ZINC000231901510 623376078 /nfs/dbraw/zinc/37/60/78/623376078.db2.gz HIUNZTCEJMUWPC-SSDOTTSWSA-N 0 3 251.223 2.962 20 10 CFCDHN CC[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637707 623537433 /nfs/dbraw/zinc/53/74/33/623537433.db2.gz ZGWYEVADXONRMC-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637707 623537435 /nfs/dbraw/zinc/53/74/35/623537435.db2.gz ZGWYEVADXONRMC-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN CC[C@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637183 623537990 /nfs/dbraw/zinc/53/79/90/623537990.db2.gz WNWBHONHRHDVMG-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637183 623537995 /nfs/dbraw/zinc/53/79/95/623537995.db2.gz WNWBHONHRHDVMG-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C(=O)N(C)CC)C(C)C)c1ccccc1[O-] ZINC000824683675 623545713 /nfs/dbraw/zinc/54/57/13/623545713.db2.gz UHGTUBQBAJSVJP-ZBFHGGJFSA-N 0 3 292.423 2.936 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000824750242 623557639 /nfs/dbraw/zinc/55/76/39/623557639.db2.gz FPWQSBSEOZMHOL-CYBMUJFWSA-N 0 3 291.391 2.840 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C(C)C)[C@@H](CO)C(C)C ZINC000824846421 623576340 /nfs/dbraw/zinc/57/63/40/623576340.db2.gz RRARTVHYPHUQRM-YOEHRIQHSA-N 0 3 295.423 2.780 20 10 CFCDHN CNC(=O)C[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000825068663 623622393 /nfs/dbraw/zinc/62/23/93/623622393.db2.gz USYJDLZDPZLVDV-CYBMUJFWSA-N 0 3 298.386 2.673 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)[C@H](OC)C2CC2)c([O-])c1 ZINC000825099070 623629947 /nfs/dbraw/zinc/62/99/47/623629947.db2.gz TZWNCKVOSUGMDO-ZBEGNZNMSA-N 0 3 279.380 2.694 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000825321863 623670778 /nfs/dbraw/zinc/67/07/78/623670778.db2.gz PMQQBEUXHIUUQV-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000825321863 623670780 /nfs/dbraw/zinc/67/07/80/623670780.db2.gz PMQQBEUXHIUUQV-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1[O-] ZINC000827151659 623955150 /nfs/dbraw/zinc/95/51/50/623955150.db2.gz HRLHDFHFKZNEOZ-YABSGUDNSA-N 0 3 283.799 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1[O-] ZINC000827151659 623955153 /nfs/dbraw/zinc/95/51/53/623955153.db2.gz HRLHDFHFKZNEOZ-YABSGUDNSA-N 0 3 283.799 2.803 20 10 CFCDHN COc1ccc(O)c(CN2CCc3cc(OC)ccc3C2)c1 ZINC000827300671 623984025 /nfs/dbraw/zinc/98/40/25/623984025.db2.gz VKPLONIEFMIJDG-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN C[C@H](CN1CCC(C)CC1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000827352759 623991776 /nfs/dbraw/zinc/99/17/76/623991776.db2.gz PGRPHDJZRSFLMQ-CYBMUJFWSA-N 0 3 280.387 2.741 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834503549 625697632 /nfs/dbraw/zinc/69/76/32/625697632.db2.gz ZRARXZXSDCUUCS-OAHLLOKOSA-N 0 3 285.391 2.562 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000827849404 624109944 /nfs/dbraw/zinc/10/99/44/624109944.db2.gz GANUTQYAVXRXMS-CALCHBBNSA-N 0 3 291.366 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000827849404 624109947 /nfs/dbraw/zinc/10/99/47/624109947.db2.gz GANUTQYAVXRXMS-CALCHBBNSA-N 0 3 291.366 2.924 20 10 CFCDHN COc1cccc(O)c1CN[C@@H](c1ccccc1)[C@@H](C)O ZINC000827855428 624112046 /nfs/dbraw/zinc/11/20/46/624112046.db2.gz CUFUYBXEWBZQQT-SJKOYZFVSA-N 0 3 287.359 2.613 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)c1ccccc1F)CC2 ZINC000834526746 625702223 /nfs/dbraw/zinc/70/22/23/625702223.db2.gz OLEWNFIDTRCDLX-HOCLYGCPSA-N 0 3 287.334 2.842 20 10 CFCDHN CCOc1ncccc1CN[C@H]1CCc2cccc(O)c21 ZINC000834508512 625699214 /nfs/dbraw/zinc/69/92/14/625699214.db2.gz MZYAAGDFKOZZHU-AWEZNQCLSA-N 0 3 284.359 2.963 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCCc2n[nH]cc2C1 ZINC000828008576 624153403 /nfs/dbraw/zinc/15/34/03/624153403.db2.gz DHYUWXLLUPJZCI-UHFFFAOYSA-N 0 3 284.407 2.733 20 10 CFCDHN Cn1ncc2c1CC(C)(C)C[N@H+](Cc1ccccc1[O-])C2 ZINC000828018369 624154578 /nfs/dbraw/zinc/15/45/78/624154578.db2.gz JAFDKGUPYMXTDU-UHFFFAOYSA-N 0 3 285.391 2.710 20 10 CFCDHN Cn1ncc2c1CC(C)(C)C[N@@H+](Cc1ccccc1[O-])C2 ZINC000828018369 624154579 /nfs/dbraw/zinc/15/45/79/624154579.db2.gz JAFDKGUPYMXTDU-UHFFFAOYSA-N 0 3 285.391 2.710 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)NCc1ccccc1)c1ccccc1[O-] ZINC000154124289 624272335 /nfs/dbraw/zinc/27/23/35/624272335.db2.gz LNXFBDVNMKKBFL-CQSZACIVSA-N 0 3 298.386 2.749 20 10 CFCDHN Cc1n[nH]cc1[C@H](C)NCc1ccc(N(C)C)cc1 ZINC000180010924 624989377 /nfs/dbraw/zinc/98/93/77/624989377.db2.gz RTWLYGUOQOMCRE-NSHDSACASA-N 0 3 258.369 2.635 20 10 CFCDHN CCCCN(C)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834582261 625726074 /nfs/dbraw/zinc/72/60/74/625726074.db2.gz YONHZUQBZZFGTM-AWEZNQCLSA-N 0 3 262.397 2.701 20 10 CFCDHN C[C@H](Cc1ccncc1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834615870 625736362 /nfs/dbraw/zinc/73/63/62/625736362.db2.gz JKONIAYWVOBSRN-IUODEOHRSA-N 0 3 268.360 2.995 20 10 CFCDHN COc1cc(Br)cc(CN2CCCC2)c1O ZINC000101590279 625744368 /nfs/dbraw/zinc/74/43/68/625744368.db2.gz AQUHOYRWFIATAA-UHFFFAOYSA-N 0 3 286.169 2.759 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)[C@@H](C)O ZINC000834886622 625909570 /nfs/dbraw/zinc/90/95/70/625909570.db2.gz DYFUFYNSZWKIFO-PKZYVASSSA-N 0 3 267.344 2.829 20 10 CFCDHN C[C@@H](NCc1cnn(CCF)c1)c1ccc(N(C)C)cc1 ZINC000922014416 626196093 /nfs/dbraw/zinc/19/60/93/626196093.db2.gz HIEXRGDVJAAGCP-CYBMUJFWSA-N 0 3 290.386 2.769 20 10 CFCDHN C[C@@H](NCc1c2c(nn1C)CCC2)c1ccc(N(C)C)cc1 ZINC000922015499 626196633 /nfs/dbraw/zinc/19/66/33/626196633.db2.gz QQSFGLIZGRVDFT-CYBMUJFWSA-N 0 3 298.434 2.826 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1 ZINC000922692933 626343732 /nfs/dbraw/zinc/34/37/32/626343732.db2.gz CHYUNKGYRMUEBH-DGCLKSJQSA-N 0 3 289.297 2.982 20 10 CFCDHN CCN(C)c1ccc(CN2CCOCC3(CC3)C2)cc1 ZINC000773832126 626395551 /nfs/dbraw/zinc/39/55/51/626395551.db2.gz NCMAZWPEYUDGID-UHFFFAOYSA-N 0 3 274.408 2.755 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](COC)C(C)C)c([O-])c1 ZINC000922949885 626431814 /nfs/dbraw/zinc/43/18/14/626431814.db2.gz WDQSKOJWSWRYIA-CQSZACIVSA-N 0 3 281.396 2.799 20 10 CFCDHN CCOc1cccc(CNCc2c(C)noc2CC)c1O ZINC000922988850 626440178 /nfs/dbraw/zinc/44/01/78/626440178.db2.gz VLOCFBOVTPCBAT-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN C[C@@H](C[N@H+](C)Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000839193262 626530919 /nfs/dbraw/zinc/53/09/19/626530919.db2.gz QYKPTTVMGKMUFN-NSHDSACASA-N 0 3 297.370 2.941 20 10 CFCDHN C[C@@H](C[N@@H+](C)Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000839193262 626530920 /nfs/dbraw/zinc/53/09/20/626530920.db2.gz QYKPTTVMGKMUFN-NSHDSACASA-N 0 3 297.370 2.941 20 10 CFCDHN COc1ccc(CN(C)Cc2cccc(C)c2O)cn1 ZINC000757917794 626567807 /nfs/dbraw/zinc/56/78/07/626567807.db2.gz PLRVZTNSSMQLBW-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000761500610 626841071 /nfs/dbraw/zinc/84/10/71/626841071.db2.gz XPFLLMOPJGSIJY-GDBMZVCRSA-N 0 3 274.408 2.917 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCS[C@H](C)C2)c([O-])c1 ZINC000769320399 627423731 /nfs/dbraw/zinc/42/37/31/627423731.db2.gz NCDWWMUWZYSBMW-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCS[C@H](C)C2)c([O-])c1 ZINC000769320399 627423732 /nfs/dbraw/zinc/42/37/32/627423732.db2.gz NCDWWMUWZYSBMW-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCSC(C)(C)C1 ZINC000769447744 627439926 /nfs/dbraw/zinc/43/99/26/627439926.db2.gz KKUVEWWXTFFSCO-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCSC(C)(C)C1 ZINC000769447744 627439930 /nfs/dbraw/zinc/43/99/30/627439930.db2.gz KKUVEWWXTFFSCO-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](CO)c2ccsc2)c1 ZINC000769990604 627494479 /nfs/dbraw/zinc/49/44/79/627494479.db2.gz VBTXVEQRPUEECJ-YGRLFVJLSA-N 0 3 293.388 2.847 20 10 CFCDHN Cc1cc(N[C@H](C)c2ccc(N(C)C)cc2)nc(N)n1 ZINC000772298848 627699272 /nfs/dbraw/zinc/69/92/72/627699272.db2.gz SSINKRASDZOOFE-LLVKDONJSA-N 0 3 271.368 2.606 20 10 CFCDHN C=Cn1cc(CNCc2ccc(N(C)C)cc2C)cn1 ZINC000774988174 627983293 /nfs/dbraw/zinc/98/32/93/627983293.db2.gz BZULUZUSTGZREC-UHFFFAOYSA-N 0 3 270.380 2.648 20 10 CFCDHN CC1(C)CCCN(CC[NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000775183139 627998334 /nfs/dbraw/zinc/99/83/34/627998334.db2.gz IALNYEPTEGVGLF-UHFFFAOYSA-N 0 3 280.387 2.743 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)Cc1cnccn1)c1ccccc1[O-] ZINC000775495830 628031600 /nfs/dbraw/zinc/03/16/00/628031600.db2.gz CSWFKSOCLSIKEM-DOMZBBRYSA-N 0 3 271.364 2.854 20 10 CFCDHN CCc1cc(C[NH2+][C@@H](CC)c2ccccc2[O-])[nH]n1 ZINC000775507035 628032229 /nfs/dbraw/zinc/03/22/29/628032229.db2.gz GEBNMULJFDVTPS-AWEZNQCLSA-N 0 3 259.353 2.919 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCC[C@H]1C)c1ccccc1[O-] ZINC000775509000 628032515 /nfs/dbraw/zinc/03/25/15/628032515.db2.gz MIIIEKIDJROZRX-HIFRSBDPSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1ccccc1[O-] ZINC000775512858 628032972 /nfs/dbraw/zinc/03/29/72/628032972.db2.gz CTMXURTYRZYAGN-BBRMVZONSA-N 0 3 289.375 2.877 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](CO)Cc1ccco1)c1ccccc1[O-] ZINC000775512859 628033309 /nfs/dbraw/zinc/03/33/09/628033309.db2.gz CTMXURTYRZYAGN-CJNGLKHVSA-N 0 3 289.375 2.877 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nc(C)n[nH]1)c1cc(Cl)ccc1[O-] ZINC000775548419 628036335 /nfs/dbraw/zinc/03/63/35/628036335.db2.gz ZLXOJODXEFUXQN-GFCCVEGCSA-N 0 3 294.786 2.756 20 10 CFCDHN CCCN1CCN(Cc2cc(Cl)cc(C)c2O)CC1 ZINC000775636440 628048874 /nfs/dbraw/zinc/04/88/74/628048874.db2.gz BTHIRDVHOSYCGZ-UHFFFAOYSA-N 0 3 282.815 2.882 20 10 CFCDHN COC(=O)/C(C)=C/CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775836631 628073793 /nfs/dbraw/zinc/07/37/93/628073793.db2.gz OQMKKBRYDVVXGL-RSKUSDAESA-N 0 3 276.380 2.523 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)[C@H](C)[C@@H]2C)c1O ZINC000775984027 628091304 /nfs/dbraw/zinc/09/13/04/628091304.db2.gz FBDLIGSNMWRTDS-MNOVXSKESA-N 0 3 298.814 2.579 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCCN(C)C2)c1[O-] ZINC000776042799 628096897 /nfs/dbraw/zinc/09/68/97/628096897.db2.gz VCMDAJUWMHTEKE-ZDUSSCGKSA-N 0 3 268.788 2.538 20 10 CFCDHN COc1cc(O)c(CNCc2ccoc2C)cc1OC ZINC000776039374 628097055 /nfs/dbraw/zinc/09/70/55/628097055.db2.gz SQGHWHJDHYFEQX-UHFFFAOYSA-N 0 3 277.320 2.601 20 10 CFCDHN CC[C@@H](COC)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000776212412 628117293 /nfs/dbraw/zinc/11/72/93/628117293.db2.gz KKGJGVZMTBXEDQ-LBPRGKRZSA-N 0 3 257.761 2.869 20 10 CFCDHN CSC[C@@H](O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000778088907 628276916 /nfs/dbraw/zinc/27/69/16/628276916.db2.gz MSWOUUHIDTWINW-HNNXBMFYSA-N 0 3 295.448 2.861 20 10 CFCDHN CSC[C@@H](O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000778088907 628276919 /nfs/dbraw/zinc/27/69/19/628276919.db2.gz MSWOUUHIDTWINW-HNNXBMFYSA-N 0 3 295.448 2.861 20 10 CFCDHN Oc1ccc2c(c1)CN(Cc1ccccc1O)CC2 ZINC000779000476 628344176 /nfs/dbraw/zinc/34/41/76/628344176.db2.gz XXGSMQMFPBMNGA-UHFFFAOYSA-N 0 3 255.317 2.656 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000779007916 628344739 /nfs/dbraw/zinc/34/47/39/628344739.db2.gz NNDMFAASTJBEQK-CQSZACIVSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000779007916 628344740 /nfs/dbraw/zinc/34/47/40/628344740.db2.gz NNDMFAASTJBEQK-CQSZACIVSA-N 0 3 275.327 2.565 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1cc(F)ccc1[O-])CC1CC1 ZINC000779001243 628344807 /nfs/dbraw/zinc/34/48/07/628344807.db2.gz DZSLOWUWUJKTJD-UHFFFAOYSA-N 0 3 295.354 2.697 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1cc(F)ccc1[O-])CC1CC1 ZINC000779001243 628344808 /nfs/dbraw/zinc/34/48/08/628344808.db2.gz DZSLOWUWUJKTJD-UHFFFAOYSA-N 0 3 295.354 2.697 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H](O)c1c(F)cccc1F ZINC000779089240 628351403 /nfs/dbraw/zinc/35/14/03/628351403.db2.gz VWAMYLXVZQWGHV-AWEZNQCLSA-N 0 3 297.276 2.633 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1ccc2c(c1)COC2 ZINC000779095589 628352463 /nfs/dbraw/zinc/35/24/63/628352463.db2.gz XVBHCAHKAJFVTP-UHFFFAOYSA-N 0 3 273.307 2.851 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1cnc(C2CC2)nc1 ZINC000779103644 628352710 /nfs/dbraw/zinc/35/27/10/628352710.db2.gz XLWVUYMMCKYKHW-UHFFFAOYSA-N 0 3 287.338 2.531 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCn3ccnc3C2)c1[O-] ZINC000779192939 628358766 /nfs/dbraw/zinc/35/87/66/628358766.db2.gz RCQGGSLQLOCDKJ-CYBMUJFWSA-N 0 3 291.782 2.655 20 10 CFCDHN COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000779605719 628389846 /nfs/dbraw/zinc/38/98/46/628389846.db2.gz XSXLUQJRTQPHCO-AWEZNQCLSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000779605719 628389849 /nfs/dbraw/zinc/38/98/49/628389849.db2.gz XSXLUQJRTQPHCO-AWEZNQCLSA-N 0 3 291.391 2.803 20 10 CFCDHN C[C@H](NCc1cc2c(cc1O)OCO2)c1cncc(F)c1 ZINC000781639303 628568307 /nfs/dbraw/zinc/56/83/07/628568307.db2.gz QFRRSZGQTOFBQG-VIFPVBQESA-N 0 3 290.294 2.506 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)c1ccccc1[O-] ZINC000783508234 628714732 /nfs/dbraw/zinc/71/47/32/628714732.db2.gz HQIJGSCVBXMZLN-WDEREUQCSA-N 0 3 288.313 2.679 20 10 CFCDHN Cc1cnccc1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000783519380 628715670 /nfs/dbraw/zinc/71/56/70/628715670.db2.gz SNGFTKJBSPPXPZ-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccc(CO)cc1)c1ccccc1[O-] ZINC000783525501 628716904 /nfs/dbraw/zinc/71/69/04/628716904.db2.gz KHOKLHWUVXWAET-CYBMUJFWSA-N 0 3 271.360 2.778 20 10 CFCDHN C[C@H]([NH2+]CCc1ccc(CO)cc1)c1ccccc1[O-] ZINC000783525503 628716990 /nfs/dbraw/zinc/71/69/90/628716990.db2.gz KHOKLHWUVXWAET-ZDUSSCGKSA-N 0 3 271.360 2.778 20 10 CFCDHN COc1ccccc1[C@H](CO)N[C@@H](C)c1ccccc1O ZINC000783524286 628717141 /nfs/dbraw/zinc/71/71/41/628717141.db2.gz YSPYTTBFQOWBGS-WFASDCNBSA-N 0 3 287.359 2.785 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)[C@H](OC)C2)c([O-])c1 ZINC000784667109 628835466 /nfs/dbraw/zinc/83/54/66/628835466.db2.gz DYKLUDVNNDITOZ-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)[C@H](OC)C2)c([O-])c1 ZINC000784667109 628835467 /nfs/dbraw/zinc/83/54/67/628835467.db2.gz DYKLUDVNNDITOZ-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN CO[C@H](C)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000785572421 628894400 /nfs/dbraw/zinc/89/44/00/628894400.db2.gz GSCGOLGKEAYBQM-IQJOONFLSA-N 0 3 253.317 2.704 20 10 CFCDHN CO[C@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000785572422 628894455 /nfs/dbraw/zinc/89/44/55/628894455.db2.gz GSCGOLGKEAYBQM-KKZNHRDASA-N 0 3 253.317 2.704 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)[C@@H]1C ZINC000787242181 629001726 /nfs/dbraw/zinc/00/17/26/629001726.db2.gz UOABLHMBYPGIGT-TZMCWYRMSA-N 0 3 299.370 2.929 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)[C@@H]1C ZINC000787242181 629001729 /nfs/dbraw/zinc/00/17/29/629001729.db2.gz UOABLHMBYPGIGT-TZMCWYRMSA-N 0 3 299.370 2.929 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@H](O)C[C@H]2C)cc1F ZINC000788270838 629054447 /nfs/dbraw/zinc/05/44/47/629054447.db2.gz SOGOTXMNYHCXBP-TZMCWYRMSA-N 0 3 280.387 2.627 20 10 CFCDHN C[C@H](C[N@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000788492252 629074595 /nfs/dbraw/zinc/07/45/95/629074595.db2.gz BYZNLDDWIDOTKN-GFCCVEGCSA-N 0 3 279.380 2.802 20 10 CFCDHN C[C@H](C[N@@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000788492252 629074597 /nfs/dbraw/zinc/07/45/97/629074597.db2.gz BYZNLDDWIDOTKN-GFCCVEGCSA-N 0 3 279.380 2.802 20 10 CFCDHN CCN(C)c1ccc(CN2CCC3=C(CCC(=O)N3)C2)cc1 ZINC000852295878 634713774 /nfs/dbraw/zinc/71/37/74/634713774.db2.gz LIOONXVJAFBJQS-UHFFFAOYSA-N 0 3 299.418 2.513 20 10 CFCDHN C[C@H](CC[NH+](C)C)NCc1c([O-])ccc(Cl)c1F ZINC000790962156 629274662 /nfs/dbraw/zinc/27/46/62/629274662.db2.gz GPTLUPNNJLXVHR-SECBINFHSA-N 0 3 274.767 2.615 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790962156 629274666 /nfs/dbraw/zinc/27/46/66/629274666.db2.gz GPTLUPNNJLXVHR-SECBINFHSA-N 0 3 274.767 2.615 20 10 CFCDHN COc1ccc(CNC/C=C/c2ccc(N(C)C)cc2)cn1 ZINC000835035176 629328755 /nfs/dbraw/zinc/32/87/55/629328755.db2.gz GKHFXJMEJJQONW-SNAWJCMRSA-N 0 3 297.402 2.959 20 10 CFCDHN C[C@@H](NC/C=C\c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000835041561 629334846 /nfs/dbraw/zinc/33/48/46/629334846.db2.gz YFOUTMMBBTVLGL-GEXIGZQTSA-N 0 3 284.407 2.850 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CC([C@H]3CCOC3)C2)cc1 ZINC000835054392 629356228 /nfs/dbraw/zinc/35/62/28/629356228.db2.gz ORTOEZLKAHBWQA-CWDCEQMOSA-N 0 3 286.419 2.734 20 10 CFCDHN CCn1ccc(C[N@H+](C)Cc2cc(F)ccc2[O-])c1 ZINC000792182954 629406485 /nfs/dbraw/zinc/40/64/85/629406485.db2.gz JIDKIJUJPCHPBN-UHFFFAOYSA-N 0 3 262.328 2.985 20 10 CFCDHN CCn1ccc(C[N@@H+](C)Cc2cc(F)ccc2[O-])c1 ZINC000792182954 629406489 /nfs/dbraw/zinc/40/64/89/629406489.db2.gz JIDKIJUJPCHPBN-UHFFFAOYSA-N 0 3 262.328 2.985 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCN2CC=CCC2)c1[O-] ZINC000793319099 629525921 /nfs/dbraw/zinc/52/59/21/629525921.db2.gz MTXQRTDYJVBQEA-UHFFFAOYSA-N 0 3 280.799 2.706 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)ccc2[O-])c(O)c1 ZINC000793387347 629536017 /nfs/dbraw/zinc/53/60/17/629536017.db2.gz DPVZUUOEVXLZMR-UHFFFAOYSA-N 0 3 277.295 2.535 20 10 CFCDHN CCc1nncn1CC[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794804856 629687743 /nfs/dbraw/zinc/68/77/43/629687743.db2.gz VQFIQGMKYOKHTM-AWEZNQCLSA-N 0 3 288.395 2.595 20 10 CFCDHN CC[C@H]([NH2+]C[C@]1(CCO)CCOC1)c1ccc(C)cc1[O-] ZINC000794811572 629688972 /nfs/dbraw/zinc/68/89/72/629688972.db2.gz RQMVXQMGDBMNJO-RDJZCZTQSA-N 0 3 293.407 2.530 20 10 CFCDHN CC[C@@H]([NH2+]CCc1ccnn1C)c1ccc(C)cc1[O-] ZINC000794818922 629690399 /nfs/dbraw/zinc/69/03/99/629690399.db2.gz ZIFMQTCKGNCBBZ-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)CO)c1ccc(C)cc1[O-] ZINC000794819656 629690800 /nfs/dbraw/zinc/69/08/00/629690800.db2.gz WZUHCXRCGDUNEP-ZDUSSCGKSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@@H]([NH2+]CCC1CC(O)C1)c1ccc(C)cc1[O-] ZINC000794827495 629691068 /nfs/dbraw/zinc/69/10/68/629691068.db2.gz JNCMCUSJTSNSGR-SSDMNJCBSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCN2CC=CCC2)c2c1c(F)ccc2[O-] ZINC000794834422 629692419 /nfs/dbraw/zinc/69/24/19/629692419.db2.gz NJOMGQKOAYCRIB-OCCSQVGLSA-N 0 3 290.382 2.931 20 10 CFCDHN COC(=O)c1cccc(CNCc2ccc3c(c2)CCO3)c1 ZINC000795911702 629848580 /nfs/dbraw/zinc/84/85/80/629848580.db2.gz MIZMUPNKIVQWDZ-UHFFFAOYSA-N 0 3 297.354 2.698 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CSC[C@H]2C)c([O-])c1 ZINC000796485756 629925463 /nfs/dbraw/zinc/92/54/63/629925463.db2.gz ZKRPHSLLDQXBER-MFKMUULPSA-N 0 3 267.394 2.632 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000796758382 629961205 /nfs/dbraw/zinc/96/12/05/629961205.db2.gz DHLULDRVQCEDCX-SWLSCSKDSA-N 0 3 280.387 2.914 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCO[C@@H](CC)C2)c([O-])c1 ZINC000798964137 630265284 /nfs/dbraw/zinc/26/52/84/630265284.db2.gz IURODNVWSHMBPD-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCO[C@@H](CC)C2)c([O-])c1 ZINC000798964137 630265288 /nfs/dbraw/zinc/26/52/88/630265288.db2.gz IURODNVWSHMBPD-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)CN(C)CCC ZINC000801547918 630457008 /nfs/dbraw/zinc/45/70/08/630457008.db2.gz FHOBMEOQWSMCTG-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN C[C@@H](CN(C)C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806169920 630779527 /nfs/dbraw/zinc/77/95/27/630779527.db2.gz MAOHUPDJLNPQNO-JFGNBEQYSA-N 0 3 266.360 2.619 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccnn2C)c1[O-] ZINC000808675890 631026737 /nfs/dbraw/zinc/02/67/37/631026737.db2.gz WVKNBTYYCFRQCV-SNVBAGLBSA-N 0 3 279.771 2.938 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cnn(C)c2)c1[O-] ZINC000808679921 631027641 /nfs/dbraw/zinc/02/76/41/631027641.db2.gz FEZXJIUODUNSEW-SNVBAGLBSA-N 0 3 279.771 2.938 20 10 CFCDHN COC[C@H](C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-])OC ZINC000808714273 631033264 /nfs/dbraw/zinc/03/32/64/631033264.db2.gz UDJJRJYFFRADGO-JQWIXIFHSA-N 0 3 287.787 2.666 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1ccccc1[O-] ZINC000840886349 631250811 /nfs/dbraw/zinc/25/08/11/631250811.db2.gz CSOISBBEXDHCEK-BZPMIXESSA-N 0 3 285.334 2.982 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@@H]1CCn2ccnc21 ZINC000840894307 631254434 /nfs/dbraw/zinc/25/44/34/631254434.db2.gz PXZDAYPPGXVHJW-RHSMWYFYSA-N 0 3 298.434 2.923 20 10 CFCDHN Cc1ccc(CNCCCSc2nccs2)nn1 ZINC000840899057 631255899 /nfs/dbraw/zinc/25/58/99/631255899.db2.gz KTMSWUQTXFNVSU-UHFFFAOYSA-N 0 3 280.422 2.514 20 10 CFCDHN Cc1cc([O-])c(CN2CCC([NH+](C)C)CC2)c(Cl)c1 ZINC000840910709 631260494 /nfs/dbraw/zinc/26/04/94/631260494.db2.gz QMFGWRYCJVVCEA-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1[O-] ZINC000809688622 631263747 /nfs/dbraw/zinc/26/37/47/631263747.db2.gz NJQIKADVUSRXJF-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1[O-] ZINC000809688622 631263755 /nfs/dbraw/zinc/26/37/55/631263755.db2.gz NJQIKADVUSRXJF-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCCOC2)c1[O-] ZINC000809692772 631265407 /nfs/dbraw/zinc/26/54/07/631265407.db2.gz GMJXERLXBBFWLZ-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCCOC2)c1[O-] ZINC000809692772 631265412 /nfs/dbraw/zinc/26/54/12/631265412.db2.gz GMJXERLXBBFWLZ-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(C)c2O)[C@H](C)C1 ZINC000809698025 631267188 /nfs/dbraw/zinc/26/71/88/631267188.db2.gz UFMHLKHQQWXBPE-GFCCVEGCSA-N 0 3 282.815 2.880 20 10 CFCDHN C[C@H]1CNCC[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841062808 631327315 /nfs/dbraw/zinc/32/73/15/631327315.db2.gz CORTYXCDABCKIX-UFBFGSQYSA-N 0 3 289.206 2.787 20 10 CFCDHN NC[C@@H]([NH2+]Cc1cc(Cl)ccc1[O-])C1CCCC1 ZINC000841085692 631333814 /nfs/dbraw/zinc/33/38/14/631333814.db2.gz ATPLJLFRFKOJDI-CYBMUJFWSA-N 0 3 268.788 2.653 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000841089966 631336684 /nfs/dbraw/zinc/33/66/84/631336684.db2.gz SKFNTFIWTWABBY-GFCCVEGCSA-N 0 3 298.789 2.949 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2cn[nH]c2)c1[O-] ZINC000810248568 631349640 /nfs/dbraw/zinc/34/96/40/631349640.db2.gz XRPUHOZSNBJVSJ-SNVBAGLBSA-N 0 3 279.771 2.970 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1cn(C)cn1 ZINC000842222265 631567571 /nfs/dbraw/zinc/56/75/71/631567571.db2.gz GMKQNXJILMLVMO-CQSZACIVSA-N 0 3 286.423 2.515 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@@H]3CCCC[C@@H]31)[C@H](O)CO2 ZINC000842618790 631682408 /nfs/dbraw/zinc/68/24/08/631682408.db2.gz QQAPIRJGFOOXDC-HZUKXOBISA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@@H]3CCCC[C@@H]31)[C@H](O)CO2 ZINC000842618790 631682412 /nfs/dbraw/zinc/68/24/12/631682412.db2.gz QQAPIRJGFOOXDC-HZUKXOBISA-N 0 3 289.375 2.583 20 10 CFCDHN OCC[C@H](NCc1ccccc1O)c1ccccc1F ZINC000842762753 631732825 /nfs/dbraw/zinc/73/28/25/631732825.db2.gz JEVTVSWIZUUXMI-HNNXBMFYSA-N 0 3 275.323 2.745 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1=O)c1cc(F)ccc1[O-] ZINC000842886441 631773363 /nfs/dbraw/zinc/77/33/63/631773363.db2.gz SAJKDYRLGCDNJF-GXFFZTMASA-N 0 3 294.370 2.581 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000842913667 631781805 /nfs/dbraw/zinc/78/18/05/631781805.db2.gz CXOVJNYRMNIOTJ-YNEHKIRRSA-N 0 3 251.370 2.840 20 10 CFCDHN CCC[C@H]1C[NH2+]CCN1Cc1cc(Cl)ccc1[O-] ZINC000843057740 631820684 /nfs/dbraw/zinc/82/06/84/631820684.db2.gz HRPNCKIOKGHEMT-ZDUSSCGKSA-N 0 3 268.788 2.620 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000843123199 631843306 /nfs/dbraw/zinc/84/33/06/631843306.db2.gz IWDHCMHKWSEOFY-HNNXBMFYSA-N 0 3 280.799 2.621 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(Cl)c1 ZINC000843128455 631847397 /nfs/dbraw/zinc/84/73/97/631847397.db2.gz XQURSJROGBYHAB-RISCZKNCSA-N 0 3 280.799 2.538 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843415180 631947290 /nfs/dbraw/zinc/94/72/90/631947290.db2.gz BBKGDBNUKZILTB-SWLSCSKDSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843415180 631947317 /nfs/dbraw/zinc/94/73/17/631947317.db2.gz BBKGDBNUKZILTB-SWLSCSKDSA-N 0 3 279.355 2.922 20 10 CFCDHN Cc1nnsc1C[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816617308 632496208 /nfs/dbraw/zinc/49/62/08/632496208.db2.gz UXASCBSLNUNVDP-UHFFFAOYSA-N 0 3 285.372 2.995 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)[C@H]2CCCOC2)c([O-])c1 ZINC000846051416 632624143 /nfs/dbraw/zinc/62/41/43/632624143.db2.gz DZIMLJALCVBTLT-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)[C@H]2CCCOC2)c([O-])c1 ZINC000846051416 632624147 /nfs/dbraw/zinc/62/41/47/632624147.db2.gz DZIMLJALCVBTLT-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](O)CC[C@H]2C)c1[O-] ZINC000817414183 632625558 /nfs/dbraw/zinc/62/55/58/632625558.db2.gz GZCVASVALIPLQU-MFKMUULPSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c1[O-] ZINC000817414183 632625559 /nfs/dbraw/zinc/62/55/59/632625559.db2.gz GZCVASVALIPLQU-MFKMUULPSA-N 0 3 269.772 2.699 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H](CCO)CC2)c1[O-] ZINC000817418762 632627543 /nfs/dbraw/zinc/62/75/43/632627543.db2.gz FOAGSBOGWQPGQS-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H](CCO)CC2)c1[O-] ZINC000817418762 632627545 /nfs/dbraw/zinc/62/75/45/632627545.db2.gz FOAGSBOGWQPGQS-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])[C@@H](Cc2ccccc2)C1 ZINC000846067841 632628392 /nfs/dbraw/zinc/62/83/92/632628392.db2.gz YNBYHHDXYOBITJ-SFHVURJKSA-N 0 3 296.414 2.751 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])[C@@H](Cc2ccccc2)C1 ZINC000846067841 632628395 /nfs/dbraw/zinc/62/83/95/632628395.db2.gz YNBYHHDXYOBITJ-SFHVURJKSA-N 0 3 296.414 2.751 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@]2(O)CCOC2)c1[O-] ZINC000846194156 632658557 /nfs/dbraw/zinc/65/85/57/632658557.db2.gz RMIBCEXMUFADGU-NHYWBVRUSA-N 0 3 299.798 2.546 20 10 CFCDHN COC1([C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000817588818 632672092 /nfs/dbraw/zinc/67/20/92/632672092.db2.gz ROQXPQNSHUJGNF-JSGCOSHPSA-N 0 3 291.391 2.553 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000817588867 632672468 /nfs/dbraw/zinc/67/24/68/632672468.db2.gz RZMYVGSKPUYIHE-UONOGXRCSA-N 0 3 293.407 2.935 20 10 CFCDHN CCCN1CCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O ZINC000846473627 632715658 /nfs/dbraw/zinc/71/56/58/632715658.db2.gz VDJMNTCBBDARBQ-CYBMUJFWSA-N 0 3 296.798 2.536 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCNCc1cccnc1)CC2 ZINC000817941329 632745701 /nfs/dbraw/zinc/74/57/01/632745701.db2.gz STTZSJKERYUPOW-INIZCTEOSA-N 0 3 297.402 2.544 20 10 CFCDHN C[C@@H](NC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1[O-] ZINC000817951678 632751903 /nfs/dbraw/zinc/75/19/03/632751903.db2.gz JIZYKXKGEIQXJG-KOLCDFICSA-N 0 3 299.212 2.557 20 10 CFCDHN CC(=O)c1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2N)c1[O-] ZINC000818340412 632832061 /nfs/dbraw/zinc/83/20/61/632832061.db2.gz MDNBJXQBHPWGBD-ZIAGYGMSSA-N 0 3 296.798 2.608 20 10 CFCDHN CCOc1cncc(CNCc2ccc(N(C)C)cc2)c1 ZINC000856764902 635849296 /nfs/dbraw/zinc/84/92/96/635849296.db2.gz ROAJHPNMWYGXJB-UHFFFAOYSA-N 0 3 285.391 2.836 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c1[O-] ZINC000857062164 635921848 /nfs/dbraw/zinc/92/18/48/635921848.db2.gz YSWWUUJPOIWXRR-GXFFZTMASA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)c1[O-] ZINC000857062164 635921850 /nfs/dbraw/zinc/92/18/50/635921850.db2.gz YSWWUUJPOIWXRR-GXFFZTMASA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1ncncc1[C@H](C)NCc1ccc(N(C)C)cc1 ZINC000848516167 633271126 /nfs/dbraw/zinc/27/11/26/633271126.db2.gz AIULGXXKHVUNLZ-LBPRGKRZSA-N 0 3 270.380 2.702 20 10 CFCDHN COC[C@@H](CC(C)(C)C)[NH2+]Cc1c([O-])cccc1OC ZINC000848567658 633291604 /nfs/dbraw/zinc/29/16/04/633291604.db2.gz ZDYYYKVQTAETPS-GFCCVEGCSA-N 0 3 281.396 2.942 20 10 CFCDHN CCc1cccc(C[NH2+]CC2(CCO)CCCC2)c1[O-] ZINC000848897227 633387504 /nfs/dbraw/zinc/38/75/04/633387504.db2.gz GRWQKDBQKNCEGL-UHFFFAOYSA-N 0 3 277.408 2.987 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848925479 633408896 /nfs/dbraw/zinc/40/88/96/633408896.db2.gz WKYBSPIHQAJUEM-HNNXBMFYSA-N 0 3 261.365 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848925479 633408901 /nfs/dbraw/zinc/40/89/01/633408901.db2.gz WKYBSPIHQAJUEM-HNNXBMFYSA-N 0 3 261.365 2.926 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc(O[C@H]2CCOC2)cc1 ZINC000850113299 633845630 /nfs/dbraw/zinc/84/56/30/633845630.db2.gz BIGKBJIRQZGUBI-KRWDZBQOSA-N 0 3 299.370 2.850 20 10 CFCDHN C[C@H](NCc1cnn2c1CCC2)c1ccc(N(C)C)cc1 ZINC000850251670 633913576 /nfs/dbraw/zinc/91/35/76/633913576.db2.gz BWIJISHMUNTZBP-ZDUSSCGKSA-N 0 3 284.407 2.746 20 10 CFCDHN Oc1ccccc1CNCc1cccnc1N1CCCC1 ZINC000850352744 633951671 /nfs/dbraw/zinc/95/16/71/633951671.db2.gz GZYDDAIYVOXNMV-UHFFFAOYSA-N 0 3 283.375 2.677 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cccnc1N1CCCC1 ZINC000850352744 633951674 /nfs/dbraw/zinc/95/16/74/633951674.db2.gz GZYDDAIYVOXNMV-UHFFFAOYSA-N 0 3 283.375 2.677 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000850370951 633961123 /nfs/dbraw/zinc/96/11/23/633961123.db2.gz GWMSMGMPOJKFQX-GOEBONIOSA-N 0 3 255.317 2.660 20 10 CFCDHN COc1cccc(O)c1CN[C@@H]1C[C@@H](O)c2ccccc21 ZINC000850370981 633961518 /nfs/dbraw/zinc/96/15/18/633961518.db2.gz HGRYBUWVLBOIPQ-GDBMZVCRSA-N 0 3 285.343 2.669 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCOC2(C)C)c([O-])c1 ZINC000850409729 633981684 /nfs/dbraw/zinc/98/16/84/633981684.db2.gz ZHSAIJLPKWLGNK-CYBMUJFWSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccccc2[O-])c1C ZINC000850416115 633983073 /nfs/dbraw/zinc/98/30/73/633983073.db2.gz BHGXEWHAZLUPKY-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN C[C@H](O)[C@H](NCc1ccc(N(C)C)cc1)c1ccccc1 ZINC000850421535 633985698 /nfs/dbraw/zinc/98/56/98/633985698.db2.gz YGQUETZTVPFZKI-KSSFIOAISA-N 0 3 284.403 2.964 20 10 CFCDHN CN1CCCc2cc(CN[C@@H]3CCCn4nccc43)ccc21 ZINC000850431621 633989119 /nfs/dbraw/zinc/98/91/19/633989119.db2.gz ZOFBOXDVYSBLQM-MRXNPFEDSA-N 0 3 296.418 2.890 20 10 CFCDHN C[C@@H](COCC1CC1)NCc1cc(F)c(N(C)C)cc1F ZINC000858183987 636149137 /nfs/dbraw/zinc/14/91/37/636149137.db2.gz LLOYNHLVOGPHTK-NSHDSACASA-N 0 3 298.377 2.936 20 10 CFCDHN CC(=O)NCc1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000850484896 634013528 /nfs/dbraw/zinc/01/35/28/634013528.db2.gz UBCCLUOBZRDCRV-ZDUSSCGKSA-N 0 3 298.386 2.879 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C/C=C\CO)c1[O-] ZINC000850506552 634022767 /nfs/dbraw/zinc/02/27/67/634022767.db2.gz ANMAYYSPGRDWBM-UMBAGQNISA-N 0 3 255.745 2.553 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C/C=C/CO)c1[O-] ZINC000850506548 634023096 /nfs/dbraw/zinc/02/30/96/634023096.db2.gz ANMAYYSPGRDWBM-FSIBCCDJSA-N 0 3 255.745 2.553 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CO)CCC(C)C)c([O-])c1 ZINC000858241530 636161648 /nfs/dbraw/zinc/16/16/48/636161648.db2.gz XADQUSPCTIPVKG-CQSZACIVSA-N 0 3 281.396 2.678 20 10 CFCDHN CC(=O)N1CC[C@@H]([NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])C1 ZINC000857084338 635927399 /nfs/dbraw/zinc/92/73/99/635927399.db2.gz NDUJNZKHKWRHPC-ZWNOBZJWSA-N 0 3 296.798 2.625 20 10 CFCDHN CCOCC(C)(C)NCc1cc(F)c(N(C)C)cc1F ZINC000858168528 636145811 /nfs/dbraw/zinc/14/58/11/636145811.db2.gz VMWSIGQSCYOAPN-UHFFFAOYSA-N 0 3 286.366 2.936 20 10 CFCDHN CC[C@@H]1OCC[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858178284 636148140 /nfs/dbraw/zinc/14/81/40/636148140.db2.gz UDCPDRMIBRXBBC-HIFRSBDPSA-N 0 3 284.350 2.688 20 10 CFCDHN Cc1cccc2c1C[C@@H]([NH2+]Cc1ccccc1[O-])CO2 ZINC000858215649 636157061 /nfs/dbraw/zinc/15/70/61/636157061.db2.gz LBEZFCBSKKWWRI-CQSZACIVSA-N 0 3 269.344 2.794 20 10 CFCDHN CC1(C)CCC[C@](CO)([NH2+]Cc2ccccc2[O-])C1 ZINC000858251127 636163633 /nfs/dbraw/zinc/16/36/33/636163633.db2.gz KYGYLUQISTZGFA-INIZCTEOSA-N 0 3 263.381 2.813 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000858285636 636175941 /nfs/dbraw/zinc/17/59/41/636175941.db2.gz NKYQSXIPSOYVNA-CQSZACIVSA-N 0 3 290.407 2.507 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000858508383 636277570 /nfs/dbraw/zinc/27/75/70/636277570.db2.gz NIQSKSYJVWQNOK-UONOGXRCSA-N 0 3 287.359 2.621 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)c1ccccc1[O-] ZINC000858603236 636305621 /nfs/dbraw/zinc/30/56/21/636305621.db2.gz VDDRSCWHDCUTNM-GJZGRUSLSA-N 0 3 288.391 2.586 20 10 CFCDHN CCCCCCN(C)CC(=O)NCc1cc(C)ccc1O ZINC000862759320 637482164 /nfs/dbraw/zinc/48/21/64/637482164.db2.gz BNYKXZHNTXFONQ-UHFFFAOYSA-N 0 3 292.423 2.829 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](C)[S@](C)=O)c1ccccc1[O-] ZINC000119212563 637532868 /nfs/dbraw/zinc/53/28/68/637532868.db2.gz MPOGSPFBJRPGKS-RRUGBERISA-N 0 3 269.410 2.590 20 10 CFCDHN COc1cnccc1[C@H](C)NCc1cccc(C)c1O ZINC000189011605 650356670 /nfs/dbraw/zinc/35/66/70/650356670.db2.gz DUDKZUKHKWENFA-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COC[C@H](C)C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000189540699 650387341 /nfs/dbraw/zinc/38/73/41/650387341.db2.gz XCGAZIWQVPCZEY-ZBFHGGJFSA-N 0 3 293.407 2.656 20 10 CFCDHN COC[C@H](C)C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000189540699 650387343 /nfs/dbraw/zinc/38/73/43/650387343.db2.gz XCGAZIWQVPCZEY-ZBFHGGJFSA-N 0 3 293.407 2.656 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CCSC1 ZINC000865654674 638491402 /nfs/dbraw/zinc/49/14/02/638491402.db2.gz RHCAIRYSRUYKBV-NSHDSACASA-N 0 3 267.394 2.634 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000865779517 638569922 /nfs/dbraw/zinc/56/99/22/638569922.db2.gz XECVUKHDFONHTI-CYBMUJFWSA-N 0 3 291.391 2.697 20 10 CFCDHN C[C@@H](CCc1cccnc1)[NH2+]Cc1ccccc1[O-] ZINC000866253831 638781251 /nfs/dbraw/zinc/78/12/51/638781251.db2.gz NPCROQMNVWHEIP-ZDUSSCGKSA-N 0 3 256.349 2.898 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC[C@@H](O)C(F)F)c2c1c(F)ccc2[O-] ZINC000866442478 638821910 /nfs/dbraw/zinc/82/19/10/638821910.db2.gz MNUKUNCKGHBHMS-BCMRRPTOSA-N 0 3 289.297 2.685 20 10 CFCDHN CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1[O-])[C@H](O)C(F)(F)F ZINC000866462889 638825744 /nfs/dbraw/zinc/82/57/44/638825744.db2.gz CHNQHAAVUMEQCH-XDTLVQLUSA-N 0 3 291.313 2.991 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CC2(CO1)CCOCC2)c1ccccc1[O-] ZINC000866530867 638836718 /nfs/dbraw/zinc/83/67/18/638836718.db2.gz BRMNMLVSOYSIHL-UONOGXRCSA-N 0 3 291.391 2.629 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](C)c2ccnn2C)c1 ZINC000866614173 638854776 /nfs/dbraw/zinc/85/47/76/638854776.db2.gz LJUSCWSJBJPGBI-QWRGUYRKSA-N 0 3 275.352 2.546 20 10 CFCDHN COc1cccc([C@H](C)N[C@H](C)c2ccnn2C)c1O ZINC000866615925 638855453 /nfs/dbraw/zinc/85/54/53/638855453.db2.gz XUHRBAJGDOOXAX-WDEREUQCSA-N 0 3 275.352 2.546 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccnn1C)c1ccccc1[O-] ZINC000866614952 638855530 /nfs/dbraw/zinc/85/55/30/638855530.db2.gz QRACDCCRLFYBQF-YPMHNXCESA-N 0 3 259.353 2.928 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCCn3nccc31)CC2 ZINC000866632943 638858117 /nfs/dbraw/zinc/85/81/17/638858117.db2.gz DKERXHDIXWNBNN-QWHCGFSZSA-N 0 3 269.348 2.701 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1CCCc2c1cnn2C ZINC000122805097 639440108 /nfs/dbraw/zinc/44/01/08/639440108.db2.gz GMORVWLUIRNVOG-QGZVFWFLSA-N 0 3 298.434 2.962 20 10 CFCDHN Cc1cc(CN2CCO[C@H](C(F)F)CC2)ccc1N(C)C ZINC000872273363 641732706 /nfs/dbraw/zinc/73/27/06/641732706.db2.gz ZKHCLTXUULVUJG-HNNXBMFYSA-N 0 3 298.377 2.917 20 10 CFCDHN CCCN(Cc1cncnc1)Cc1ccccc1O ZINC000124035849 641743885 /nfs/dbraw/zinc/74/38/85/641743885.db2.gz DGVCAFSJGQSGSC-UHFFFAOYSA-N 0 3 257.337 2.594 20 10 CFCDHN CCc1nn(C)cc1CN[C@H](C)c1cc(OC)ccc1O ZINC000125499081 642649509 /nfs/dbraw/zinc/64/95/09/642649509.db2.gz CRPGCGMTTKMKOB-LLVKDONJSA-N 0 3 289.379 2.548 20 10 CFCDHN CC[C@H](C)[C@H](C[N@H+](C)Cc1ccccc1[O-])OC ZINC000876615412 642946132 /nfs/dbraw/zinc/94/61/32/642946132.db2.gz DTODTETUHWTWBM-WFASDCNBSA-N 0 3 251.370 2.885 20 10 CFCDHN CC[C@H](C)[C@H](C[N@@H+](C)Cc1ccccc1[O-])OC ZINC000876615412 642946136 /nfs/dbraw/zinc/94/61/36/642946136.db2.gz DTODTETUHWTWBM-WFASDCNBSA-N 0 3 251.370 2.885 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000876738653 642987948 /nfs/dbraw/zinc/98/79/48/642987948.db2.gz IZKLHWFUTXPEDG-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000876738653 642987954 /nfs/dbraw/zinc/98/79/54/642987954.db2.gz IZKLHWFUTXPEDG-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc(O)c1CNCc1cccc2c1OCCO2 ZINC000876875797 643045326 /nfs/dbraw/zinc/04/53/26/643045326.db2.gz AVSXOOKEPBMYDB-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN COc1ccc(OCC[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876901678 643057851 /nfs/dbraw/zinc/05/78/51/643057851.db2.gz HCIUNFVQVIUPMX-UHFFFAOYSA-N 0 3 287.359 2.878 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc(O)cc1 ZINC000876982680 643091922 /nfs/dbraw/zinc/09/19/22/643091922.db2.gz CSIUCRODLKKUFN-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)c1ccccc1 ZINC000877039642 643115411 /nfs/dbraw/zinc/11/54/11/643115411.db2.gz HYEPXFVNTKCRKH-KRWDZBQOSA-N 0 3 271.360 2.698 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)c1ccsc1 ZINC000877052145 643122378 /nfs/dbraw/zinc/12/23/78/643122378.db2.gz SHEQZORYGZVBTK-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCC(=O)OC(C)(C)C ZINC000877058911 643126216 /nfs/dbraw/zinc/12/62/16/643126216.db2.gz OAZSTMKSFCRIJZ-UHFFFAOYSA-N 0 3 265.353 2.522 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2ccc(C)cc2[O-])c(C)o1 ZINC000877060655 643127340 /nfs/dbraw/zinc/12/73/40/643127340.db2.gz MKENPZWCOJRHDP-QGZVFWFLSA-N 0 3 289.375 2.908 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](CO)c2ccccc2)c([O-])c1 ZINC000877073169 643135144 /nfs/dbraw/zinc/13/51/44/643135144.db2.gz DNFSCFLSVNWNPR-MRXNPFEDSA-N 0 3 271.360 2.566 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000877090157 643146551 /nfs/dbraw/zinc/14/65/51/643146551.db2.gz SDZWKBKZXWXQFA-CQSZACIVSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@]3(CCSC3)C2)c([O-])c1 ZINC000877094574 643150708 /nfs/dbraw/zinc/15/07/08/643150708.db2.gz KIMNUKGZUAQTGY-GOEBONIOSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000877115420 643158852 /nfs/dbraw/zinc/15/88/52/643158852.db2.gz FIQSYOKRHWGABO-WMLDXEAASA-N 0 3 285.387 2.782 20 10 CFCDHN CCC(CC)(CO)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877120233 643161446 /nfs/dbraw/zinc/16/14/46/643161446.db2.gz FAQFZVVFDUMSLB-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000877124360 643163844 /nfs/dbraw/zinc/16/38/44/643163844.db2.gz NFIXPDLNGRNNGN-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN CCOc1ncccc1CNCc1c(C)cccc1O ZINC000877145538 643176177 /nfs/dbraw/zinc/17/61/77/643176177.db2.gz KEAXQGYUJSJXEB-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN COCC1(C)CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000877171341 643187525 /nfs/dbraw/zinc/18/75/25/643187525.db2.gz DRHYMCUIOXXAJA-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([O-])c1 ZINC000877316346 643233835 /nfs/dbraw/zinc/23/38/35/643233835.db2.gz VNQDQRJFWWDYDD-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([O-])c1 ZINC000877316346 643233842 /nfs/dbraw/zinc/23/38/42/643233842.db2.gz VNQDQRJFWWDYDD-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCO[C@H]1C1CC1 ZINC000877395686 643257665 /nfs/dbraw/zinc/25/76/65/643257665.db2.gz LZIGCADOTHEWAE-DLBZAZTESA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(CN[C@@H](CCO)c2ccco2)c(O)c1 ZINC000877400193 643259470 /nfs/dbraw/zinc/25/94/70/643259470.db2.gz VEHTXNDXXWLTQT-ZDUSSCGKSA-N 0 3 261.321 2.507 20 10 CFCDHN COc1cnccc1[C@H](C)NCc1ccc(C)cc1O ZINC000877461453 643281247 /nfs/dbraw/zinc/28/12/47/643281247.db2.gz AFJOVCNLEHQTGR-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)NC(=O)OC(C)(C)C)c([O-])c1 ZINC000877486134 643301754 /nfs/dbraw/zinc/30/17/54/643301754.db2.gz FFRZNIPXEOPDKM-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2cnc(C)nc2C)c([O-])c1 ZINC000877493681 643306998 /nfs/dbraw/zinc/30/69/98/643306998.db2.gz ORNBBIRMLOKUEV-SNVBAGLBSA-N 0 3 287.363 2.658 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)CCc2cccnc2)c([O-])c1 ZINC000877493653 643307519 /nfs/dbraw/zinc/30/75/19/643307519.db2.gz NMYNQMXYTDBARA-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2c(C)cccc2[O-])C1 ZINC000877496020 643308451 /nfs/dbraw/zinc/30/84/51/643308451.db2.gz LLGWBQUZJAJNCT-OLZOCXBDSA-N 0 3 277.364 2.522 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1COc2ccccc21 ZINC000877537686 643341220 /nfs/dbraw/zinc/34/12/20/643341220.db2.gz OWIJGVOSIASHTF-CYBMUJFWSA-N 0 3 269.344 2.966 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1ccc(C)cc1[O-])OC ZINC000877547550 643347372 /nfs/dbraw/zinc/34/73/72/643347372.db2.gz AHEHQPDMIBRSIP-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1c(C)cccc1[O-])OC ZINC000877558302 643358359 /nfs/dbraw/zinc/35/83/59/643358359.db2.gz CJFDGLISJNIZKW-NHYWBVRUSA-N 0 3 251.370 2.851 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2c(C)cccc2[O-])[C@@H]1SC ZINC000877606393 643392966 /nfs/dbraw/zinc/39/29/66/643392966.db2.gz AENRZCRKWFXZRH-YUELXQCFSA-N 0 3 281.421 2.699 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](C)C(=O)OC(C)(C)C ZINC000877618377 643404746 /nfs/dbraw/zinc/40/47/46/643404746.db2.gz REBHKUWBJRVMOW-GFCCVEGCSA-N 0 3 279.380 2.768 20 10 CFCDHN Cc1ccc(CN2CCO[C@@](C)(C3CC3)C2)c(O)c1 ZINC000877622137 643409116 /nfs/dbraw/zinc/40/91/16/643409116.db2.gz GKSFEIGIIIWLFH-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCC1SCCS1 ZINC000877637590 643421066 /nfs/dbraw/zinc/42/10/66/643421066.db2.gz WYSLYEBABXNYPN-UHFFFAOYSA-N 0 3 269.435 2.986 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])OCC ZINC000877648211 643429908 /nfs/dbraw/zinc/42/99/08/643429908.db2.gz LUGLGZSLANNFDJ-AWEZNQCLSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)CC2(C)OCCO2)c([O-])c1 ZINC000877670153 643443709 /nfs/dbraw/zinc/44/37/09/643443709.db2.gz HOWSJDKRYYGVTD-ZDUSSCGKSA-N 0 3 279.380 2.579 20 10 CFCDHN CCOC(=O)C(CC)(CC)C[NH2+]Cc1ccccc1[O-] ZINC000877680449 643449235 /nfs/dbraw/zinc/44/92/35/643449235.db2.gz VTCFNSYEEYQAGW-UHFFFAOYSA-N 0 3 279.380 2.851 20 10 CFCDHN Cc1ccc(O)c(C[N@@H+]2Cc3cccc([O-])c3C2)c1 ZINC000877702923 643467247 /nfs/dbraw/zinc/46/72/47/643467247.db2.gz JZZRTRKKMREQQG-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN Cc1ccc(O)c(C[N@H+]2Cc3cccc([O-])c3C2)c1 ZINC000877702923 643467251 /nfs/dbraw/zinc/46/72/51/643467251.db2.gz JZZRTRKKMREQQG-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN C[N@@H+]1CC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000877743376 643518826 /nfs/dbraw/zinc/51/88/26/643518826.db2.gz KERHMRBQMCYBLA-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000877743376 643518830 /nfs/dbraw/zinc/51/88/30/643518830.db2.gz KERHMRBQMCYBLA-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCn1cccn1)c1ccccc1[O-] ZINC000877755557 643535442 /nfs/dbraw/zinc/53/54/42/643535442.db2.gz FOYBNSJVRGKMLQ-QWHCGFSZSA-N 0 3 259.353 2.718 20 10 CFCDHN CC(=O)NCC1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000877757683 643538539 /nfs/dbraw/zinc/53/85/39/643538539.db2.gz QZPNKSBNTPKIQO-LRVUVFPRSA-N 0 3 290.407 2.738 20 10 CFCDHN COC(=O)c1oc(CN[C@@H](C)c2ccccc2O)cc1C ZINC000877757999 643539225 /nfs/dbraw/zinc/53/92/25/643539225.db2.gz CGBNXHVMOYRMJT-NSHDSACASA-N 0 3 289.331 2.931 20 10 CFCDHN C[C@H](NCc1cc(C(F)(F)F)nn1C)c1ccccc1O ZINC000877758349 643539267 /nfs/dbraw/zinc/53/92/67/643539267.db2.gz UYDLVNVSUUKFKB-VIFPVBQESA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(C(F)(F)F)nn1C)c1ccccc1[O-] ZINC000877758349 643539274 /nfs/dbraw/zinc/53/92/74/643539274.db2.gz UYDLVNVSUUKFKB-VIFPVBQESA-N 0 3 299.296 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H](O)C2CCCC2)c([O-])c1 ZINC000877779272 643555342 /nfs/dbraw/zinc/55/53/42/643555342.db2.gz VKOIQXLYHIYWNQ-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(CCC2)O1 ZINC000878241520 643804679 /nfs/dbraw/zinc/80/46/79/643804679.db2.gz HDCNCKQVAKGQKZ-AWEZNQCLSA-N 0 3 261.365 2.926 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCC2(CCC2)O1 ZINC000878241520 643804681 /nfs/dbraw/zinc/80/46/81/643804681.db2.gz HDCNCKQVAKGQKZ-AWEZNQCLSA-N 0 3 261.365 2.926 20 10 CFCDHN C[N@H+](CCCOC(F)(F)F)Cc1ccccc1[O-] ZINC000878242486 643804850 /nfs/dbraw/zinc/80/48/50/643804850.db2.gz RXLTXYFNQITAJS-UHFFFAOYSA-N 0 3 263.259 2.751 20 10 CFCDHN C[N@@H+](CCCOC(F)(F)F)Cc1ccccc1[O-] ZINC000878242486 643804855 /nfs/dbraw/zinc/80/48/55/643804855.db2.gz RXLTXYFNQITAJS-UHFFFAOYSA-N 0 3 263.259 2.751 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CC2(CCC2)CO1 ZINC000878241510 643805071 /nfs/dbraw/zinc/80/50/71/643805071.db2.gz GYGORTDICOWMSE-CQSZACIVSA-N 0 3 261.365 2.783 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CC2(CCC2)CO1 ZINC000878241510 643805077 /nfs/dbraw/zinc/80/50/77/643805077.db2.gz GYGORTDICOWMSE-CQSZACIVSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)NCC1CCCCC1)c1ccccc1[O-] ZINC000879647970 644361679 /nfs/dbraw/zinc/36/16/79/644361679.db2.gz TVVXRJIGFQMLCF-CYBMUJFWSA-N 0 3 290.407 2.739 20 10 CFCDHN COCCSCCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649424 644362526 /nfs/dbraw/zinc/36/25/26/644362526.db2.gz SHWFYGFDEIVSKX-GFCCVEGCSA-N 0 3 269.410 2.813 20 10 CFCDHN C[C@@H]([NH2+]CC[S@@](=O)c1ccccc1)c1ccccc1[O-] ZINC000879649778 644362823 /nfs/dbraw/zinc/36/28/23/644362823.db2.gz UPIBUCBOTDLSRZ-ZUOKHONESA-N 0 3 289.400 2.851 20 10 CFCDHN C[C@H]([NH2+]CC1(Br)CC1)c1ccccc1[O-] ZINC000879650319 644363982 /nfs/dbraw/zinc/36/39/82/644363982.db2.gz UFERPUUMNBRDGY-VIFPVBQESA-N 0 3 270.170 2.970 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)NC1CCCCC1 ZINC000879651695 644364513 /nfs/dbraw/zinc/36/45/13/644364513.db2.gz HQHMKMDMMNYSHZ-STQMWFEESA-N 0 3 290.407 2.880 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CC2(CCC2)C(=O)O1)c1ccccc1[O-] ZINC000879650878 644365172 /nfs/dbraw/zinc/36/51/72/644365172.db2.gz VGWFQHUKXMCJOF-NWDGAFQWSA-N 0 3 275.348 2.529 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2c(C)noc2C)c1 ZINC000092326776 650918442 /nfs/dbraw/zinc/91/84/42/650918442.db2.gz HZWRLYAROBURKM-SECBINFHSA-N 0 3 276.336 2.856 20 10 CFCDHN CN(C)c1ccc(CN[C@@]2(c3ccccc3)C[C@@H](O)C2)cc1 ZINC000880222940 644587877 /nfs/dbraw/zinc/58/78/77/644587877.db2.gz OPDHVSGUFMBTEI-KDURUIRLSA-N 0 3 296.414 2.892 20 10 CFCDHN CC[C@H](O)CN(Cc1ccco1)Cc1ccccc1O ZINC000128422900 644705718 /nfs/dbraw/zinc/70/57/18/644705718.db2.gz CSIYWPPLVSLHHM-AWEZNQCLSA-N 0 3 275.348 2.758 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618027 650960453 /nfs/dbraw/zinc/96/04/53/650960453.db2.gz YFJIWNZXTJSDDR-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN Oc1ccccc1CN1CCOc2ccccc2C1 ZINC000134093649 646280697 /nfs/dbraw/zinc/28/06/97/646280697.db2.gz MFYXVNRHVRBOKD-UHFFFAOYSA-N 0 3 255.317 2.787 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cnn(-c2ccccc2)c1 ZINC000134226274 646308655 /nfs/dbraw/zinc/30/86/55/646308655.db2.gz IINBZVOKGOOJSK-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886520524 647027072 /nfs/dbraw/zinc/02/70/72/647027072.db2.gz GSSLYWNCMLKIHO-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H](C)[N@H+](C)CCN[C@H](C)c1c([O-])cccc1F ZINC000886520524 647027076 /nfs/dbraw/zinc/02/70/76/647027076.db2.gz GSSLYWNCMLKIHO-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H](C)[N@@H+](C)CCN[C@H](C)c1c([O-])cccc1F ZINC000886520524 647027077 /nfs/dbraw/zinc/02/70/77/647027077.db2.gz GSSLYWNCMLKIHO-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CC[C@@]2(CO[C@H](C)C2)O1)c1ccccc1[O-] ZINC000886764409 647130433 /nfs/dbraw/zinc/13/04/33/647130433.db2.gz SFIYPRKSBBUJSF-VMUDFCTBSA-N 0 3 291.391 2.769 20 10 CFCDHN CC1(C)O[C@@H]2C[C@@H]([NH2+][C@H]3CCc4cccc([O-])c43)C[C@@H]2O1 ZINC000927057790 648693050 /nfs/dbraw/zinc/69/30/50/648693050.db2.gz UDVUUYMDKLOTLN-NZBPQXDJSA-N 0 3 289.375 2.652 20 10 CFCDHN COC[C@@H](C[N@H+](C)Cc1ccccc1[O-])C(C)C ZINC000929975007 649158661 /nfs/dbraw/zinc/15/86/61/649158661.db2.gz CROUKRZSLZDRPD-CQSZACIVSA-N 0 3 251.370 2.743 20 10 CFCDHN COC[C@@H](C[N@@H+](C)Cc1ccccc1[O-])C(C)C ZINC000929975007 649158662 /nfs/dbraw/zinc/15/86/62/649158662.db2.gz CROUKRZSLZDRPD-CQSZACIVSA-N 0 3 251.370 2.743 20 10 CFCDHN CC1(C)OCC[C@@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000693070695 770216624 /nfs/dbraw/zinc/21/66/24/770216624.db2.gz IIEOUQWRCVMBGG-CHWSQXEVSA-N 0 3 261.365 2.784 20 10 CFCDHN COc1ccc(N2CCCC3(CN(C)C3)C2)c(C)c1 ZINC001277018546 775351988 /nfs/dbraw/zinc/35/19/88/775351988.db2.gz MEDHXAGEIFMTIY-UHFFFAOYSA-N 0 3 260.381 2.536 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](C)O[C@H](C)C2)c(O)c1 ZINC001140851529 775562976 /nfs/dbraw/zinc/56/29/76/775562976.db2.gz KUFVUYFLZDSMJE-ZIAGYGMSSA-N 0 3 292.423 2.848 20 10 CFCDHN C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2Cl)[C@H]1CO ZINC001140921820 775651041 /nfs/dbraw/zinc/65/10/41/775651041.db2.gz RBXXWFCECJMYIF-WBMJQRKESA-N 0 3 296.842 2.999 20 10 CFCDHN C[C@@H]1CCN(Cc2ccc(N(C)C)cc2Cl)CC[C@H]1O ZINC001140921483 775651478 /nfs/dbraw/zinc/65/14/78/775651478.db2.gz FIYCRXPSCWPNJA-MLGOLLRUSA-N 0 3 296.842 2.999 20 10 CFCDHN Cc1ccc(CN(C)Cc2cnc3ccccn23)c(O)c1 ZINC001140947915 775685509 /nfs/dbraw/zinc/68/55/09/775685509.db2.gz LLUXCQQARLIJKP-UHFFFAOYSA-N 0 3 281.359 2.980 20 10 CFCDHN CCN(Cc1cccc(OC)n1)Cc1ccccc1O ZINC001137534190 775936672 /nfs/dbraw/zinc/93/66/72/775936672.db2.gz IAVAIWVTQONUBN-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN Cn1cnc2c1C[N@H+](Cc1c([O-])ccc3ccccc31)CC2 ZINC001231589438 777269854 /nfs/dbraw/zinc/26/98/54/777269854.db2.gz JFEZQXUIYFCJKS-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1cnc2c1C[N@@H+](Cc1c([O-])ccc3ccccc31)CC2 ZINC001231589438 777269858 /nfs/dbraw/zinc/26/98/58/777269858.db2.gz JFEZQXUIYFCJKS-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1cnc2c1CN(Cc1c(O)ccc3ccccc31)CC2 ZINC001231589438 777269862 /nfs/dbraw/zinc/26/98/62/777269862.db2.gz JFEZQXUIYFCJKS-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN CCN(Cc1c(O)ccc2ccccc21)C1COC1 ZINC001231590335 777271053 /nfs/dbraw/zinc/27/10/53/777271053.db2.gz URXSXIZREQAEAU-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN CC[N@H+](Cc1c([O-])ccc2ccccc21)C1COC1 ZINC001231590335 777271063 /nfs/dbraw/zinc/27/10/63/777271063.db2.gz URXSXIZREQAEAU-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN CC[N@@H+](Cc1c([O-])ccc2ccccc21)C1COC1 ZINC001231590335 777271071 /nfs/dbraw/zinc/27/10/71/777271071.db2.gz URXSXIZREQAEAU-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN Cc1cccc(CN2CC3(C2)C[C@@H](F)CS3)c1O ZINC001231593884 777273523 /nfs/dbraw/zinc/27/35/23/777273523.db2.gz NESGVVVAYQLVLT-GFCCVEGCSA-N 0 3 267.369 2.730 20 10 CFCDHN Cc1cc(C)c(CN2CCc3ccncc3C2)c(O)c1 ZINC001231846904 777349358 /nfs/dbraw/zinc/34/93/58/777349358.db2.gz SRXVBQDOJYXRTK-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@@]2(CCO2)C1 ZINC001231854712 777351541 /nfs/dbraw/zinc/35/15/41/777351541.db2.gz LFEJJTJJZLCLID-QGZVFWFLSA-N 0 3 290.407 2.516 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@@H]2C[C@@H]21 ZINC001231858340 777353539 /nfs/dbraw/zinc/35/35/39/777353539.db2.gz UJGBQCGFSXNMJA-DOMZBBRYSA-N 0 3 260.381 2.746 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@@H+](C)C[C@@H]32)cc1Cl ZINC001231871096 777360100 /nfs/dbraw/zinc/36/01/00/777360100.db2.gz XZJLPHMIEIASSC-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@H+](C)C[C@@H]32)cc1Cl ZINC001231871096 777360105 /nfs/dbraw/zinc/36/01/05/777360105.db2.gz XZJLPHMIEIASSC-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN [O-]c1c(C[N@H+]2C[C@@H](F)C[C@H](CO)C2)ccc2ccccc12 ZINC001231879620 777362369 /nfs/dbraw/zinc/36/23/69/777362369.db2.gz KWJLIOHSYHSTRS-WFASDCNBSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1c(C[N@@H+]2C[C@@H](F)C[C@H](CO)C2)ccc2ccccc12 ZINC001231879620 777362375 /nfs/dbraw/zinc/36/23/75/777362375.db2.gz KWJLIOHSYHSTRS-WFASDCNBSA-N 0 3 289.350 2.698 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CC[C@H](C)SC2)c([O-])c1 ZINC000689522293 778225455 /nfs/dbraw/zinc/22/54/55/778225455.db2.gz SEDGKCXHJVXHQR-JQWIXIFHSA-N 0 3 267.394 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[NH+]3CC=CC3)c2c1 ZINC001234518061 778242168 /nfs/dbraw/zinc/24/21/68/778242168.db2.gz BTBCVPNCIRPTDL-UHFFFAOYSA-N 0 3 255.317 2.926 20 10 CFCDHN COCC1C[NH+](Cc2c([O-])ccc3ccc(OC)cc32)C1 ZINC001234518033 778242598 /nfs/dbraw/zinc/24/25/98/778242598.db2.gz BAZBMUHCIILXEB-UHFFFAOYSA-N 0 3 287.359 2.632 20 10 CFCDHN COc1ccc2ccc(O)c(CN3CCOC4(CC4)C3)c2c1 ZINC001234570086 778255105 /nfs/dbraw/zinc/25/51/05/778255105.db2.gz XDSAXQOHLNNHNT-UHFFFAOYSA-N 0 3 299.370 2.919 20 10 CFCDHN CCN(Cc1[nH]c(C)nc1C)Cc1ccccc1O ZINC001234645891 778273976 /nfs/dbraw/zinc/27/39/76/778273976.db2.gz UTHYNYMDOMUUEX-UHFFFAOYSA-N 0 3 259.353 2.754 20 10 CFCDHN NC(=O)[C@@H]1CCC[N@@H+]1Cc1cccc(-c2ccccc2)c1[O-] ZINC001234991249 778347135 /nfs/dbraw/zinc/34/71/35/778347135.db2.gz LILSYJUGSHEOPJ-INIZCTEOSA-N 0 3 296.370 2.509 20 10 CFCDHN NC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(-c2ccccc2)c1[O-] ZINC001234991249 778347142 /nfs/dbraw/zinc/34/71/42/778347142.db2.gz LILSYJUGSHEOPJ-INIZCTEOSA-N 0 3 296.370 2.509 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCN3CC[C@@H]3C2)cccc1-c1ccccc1 ZINC001234997503 778348259 /nfs/dbraw/zinc/34/82/59/778348259.db2.gz AJJHBQVZLZILGE-QGZVFWFLSA-N 0 3 294.398 2.949 20 10 CFCDHN [O-]c1c(C[N@H+]2CCN3CC[C@@H]3C2)cccc1-c1ccccc1 ZINC001234997503 778348267 /nfs/dbraw/zinc/34/82/67/778348267.db2.gz AJJHBQVZLZILGE-QGZVFWFLSA-N 0 3 294.398 2.949 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](F)[C@H](O)C2)c([O-])c1 ZINC001235674962 778532367 /nfs/dbraw/zinc/53/23/67/778532367.db2.gz JTTJYTPPLQNCGZ-UKRRQHHQSA-N 0 3 281.371 2.594 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@H](O)C2)c([O-])c1 ZINC001235674962 778532368 /nfs/dbraw/zinc/53/23/68/778532368.db2.gz JTTJYTPPLQNCGZ-UKRRQHHQSA-N 0 3 281.371 2.594 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676011 778532615 /nfs/dbraw/zinc/53/26/15/778532615.db2.gz NPFRNOPMQWHUDT-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676011 778532617 /nfs/dbraw/zinc/53/26/17/778532617.db2.gz NPFRNOPMQWHUDT-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN CC[C@@H]1C[NH2+]CCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001235775320 778557164 /nfs/dbraw/zinc/55/71/64/778557164.db2.gz VZDUITQWPCOROV-GFCCVEGCSA-N 0 3 268.788 2.538 20 10 CFCDHN [O-]c1c(CN(C2CC2)C2C[NH2+]C2)cccc1-c1ccccc1 ZINC001236063287 778676776 /nfs/dbraw/zinc/67/67/76/778676776.db2.gz DSQBPUHJIAOHFX-UHFFFAOYSA-N 0 3 294.398 2.995 20 10 CFCDHN CCC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CC[NH2+]1 ZINC001236179205 778727525 /nfs/dbraw/zinc/72/75/25/778727525.db2.gz UMRYBSHWNIPEIU-ZDUSSCGKSA-N 0 3 282.815 2.928 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]([NH3+])[C@H]2C)cc1Cl ZINC001236417639 778811575 /nfs/dbraw/zinc/81/15/75/778811575.db2.gz CKSORMDUWCRGMZ-MFKMUULPSA-N 0 3 268.788 2.666 20 10 CFCDHN COc1cc(C[N@H+](C)C2CC2)c([O-])cc1Br ZINC001236745816 778927697 /nfs/dbraw/zinc/92/76/97/778927697.db2.gz RFVCEVLJUFUPPN-UHFFFAOYSA-N 0 3 286.169 2.758 20 10 CFCDHN COc1cc(C[N@@H+](C)C2CC2)c([O-])cc1Br ZINC001236745816 778927699 /nfs/dbraw/zinc/92/76/99/778927699.db2.gz RFVCEVLJUFUPPN-UHFFFAOYSA-N 0 3 286.169 2.758 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784019 778935134 /nfs/dbraw/zinc/93/51/34/778935134.db2.gz RDHLVZXYIPCKBT-GUYCJALGSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784019 778935137 /nfs/dbraw/zinc/93/51/37/778935137.db2.gz RDHLVZXYIPCKBT-GUYCJALGSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H](C)C[C@H](C(=O)OC)C2)c([O-])c1 ZINC001236787305 778936437 /nfs/dbraw/zinc/93/64/37/778936437.db2.gz ATLXCSFHZJPUMB-WFASDCNBSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H](C)C[C@H](C(=O)OC)C2)c([O-])c1 ZINC001236787305 778936443 /nfs/dbraw/zinc/93/64/43/778936443.db2.gz ATLXCSFHZJPUMB-WFASDCNBSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C(=O)OC)CC2)c([O-])c1 ZINC001236789557 778936648 /nfs/dbraw/zinc/93/66/48/778936648.db2.gz YBPPMMKSORSIMR-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C(=O)OC)CC2)c([O-])c1 ZINC001236789557 778936651 /nfs/dbraw/zinc/93/66/51/778936651.db2.gz YBPPMMKSORSIMR-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](CC(=O)OC)C2)c([O-])c1 ZINC001236791738 778936816 /nfs/dbraw/zinc/93/68/16/778936816.db2.gz JIKDNBDCBFIKRC-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](CC(=O)OC)C2)c([O-])c1 ZINC001236791738 778936818 /nfs/dbraw/zinc/93/68/18/778936818.db2.gz JIKDNBDCBFIKRC-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(CN2CC3(C2)C[C@@H](F)CS3)c(O)c1 ZINC001236791766 778939213 /nfs/dbraw/zinc/93/92/13/778939213.db2.gz KMDIXQNGCWZRIL-CYBMUJFWSA-N 0 3 281.396 2.984 20 10 CFCDHN CCOC(=O)[C@@H]1CCC[N@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236794644 778940754 /nfs/dbraw/zinc/94/07/54/778940754.db2.gz NIEBUDNYWDUZGH-OAHLLOKOSA-N 0 3 291.391 2.730 20 10 CFCDHN CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236794644 778940756 /nfs/dbraw/zinc/94/07/56/778940756.db2.gz NIEBUDNYWDUZGH-OAHLLOKOSA-N 0 3 291.391 2.730 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236807233 778947185 /nfs/dbraw/zinc/94/71/85/778947185.db2.gz DZLVGMFIUPLLSZ-CXAGYDPISA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236807233 778947188 /nfs/dbraw/zinc/94/71/88/778947188.db2.gz DZLVGMFIUPLLSZ-CXAGYDPISA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236808269 778948221 /nfs/dbraw/zinc/94/82/21/778948221.db2.gz OHKJNZNGVYFVSU-DYVFJYSZSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236808269 778948225 /nfs/dbraw/zinc/94/82/25/778948225.db2.gz OHKJNZNGVYFVSU-DYVFJYSZSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC001236810782 778948312 /nfs/dbraw/zinc/94/83/12/778948312.db2.gz JBDGYBIJOCNSFM-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC001236810782 778948313 /nfs/dbraw/zinc/94/83/13/778948313.db2.gz JBDGYBIJOCNSFM-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827982 778956504 /nfs/dbraw/zinc/95/65/04/778956504.db2.gz YGYMACUZSDRUJL-IAQYHMDHSA-N 0 3 257.333 2.501 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827982 778956505 /nfs/dbraw/zinc/95/65/05/778956505.db2.gz YGYMACUZSDRUJL-IAQYHMDHSA-N 0 3 257.333 2.501 20 10 CFCDHN CCOC(=O)CC[N@H+](C)Cc1cc2ccccc2cc1[O-] ZINC001236832788 778958289 /nfs/dbraw/zinc/95/82/89/778958289.db2.gz LJQJJASQCPCUFH-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CCOC(=O)CC[N@@H+](C)Cc1cc2ccccc2cc1[O-] ZINC001236832788 778958293 /nfs/dbraw/zinc/95/82/93/778958293.db2.gz LJQJJASQCPCUFH-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CN(Cc1cnn(C)c1)Cc1cc2ccccc2cc1O ZINC001236839666 778962233 /nfs/dbraw/zinc/96/22/33/778962233.db2.gz LECATMULUNUWDW-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001237047355 778999195 /nfs/dbraw/zinc/99/91/95/778999195.db2.gz LRYRITBITOCJOU-WFASDCNBSA-N 0 3 289.375 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001237047355 778999198 /nfs/dbraw/zinc/99/91/98/778999198.db2.gz LRYRITBITOCJOU-WFASDCNBSA-N 0 3 289.375 2.592 20 10 CFCDHN CC(C)c1ccc(CN2CC(N3CCCC3)C2)c(O)c1 ZINC001237050279 779000832 /nfs/dbraw/zinc/00/08/32/779000832.db2.gz AELDYJYTFTYYJO-UHFFFAOYSA-N 0 3 274.408 2.796 20 10 CFCDHN CC(C)c1ccc(CN2CCCC23COC3)c(O)c1 ZINC001237054340 779001468 /nfs/dbraw/zinc/00/14/68/779001468.db2.gz WEIYCVHVOVNDFB-UHFFFAOYSA-N 0 3 261.365 2.880 20 10 CFCDHN C[C@@H]1CN(Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122495 779020376 /nfs/dbraw/zinc/02/03/76/779020376.db2.gz VECMJKAQVZCDII-SECBINFHSA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122495 779020379 /nfs/dbraw/zinc/02/03/79/779020379.db2.gz VECMJKAQVZCDII-SECBINFHSA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2c([O-])ccc(F)c2Cl)CCCO1 ZINC001237122495 779020387 /nfs/dbraw/zinc/02/03/87/779020387.db2.gz VECMJKAQVZCDII-SECBINFHSA-N 0 3 273.735 2.796 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383091 779087927 /nfs/dbraw/zinc/08/79/27/779087927.db2.gz OCZFZUAQWWFZGR-RISCZKNCSA-N 0 3 280.799 2.620 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237404115 779097485 /nfs/dbraw/zinc/09/74/85/779097485.db2.gz NFYNCJBLHROBPT-FZMZJTMJSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001237485713 779117637 /nfs/dbraw/zinc/11/76/37/779117637.db2.gz QOEZKSZOPKUKMO-PWSUYJOCSA-N 0 3 253.292 2.788 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001237485713 779117639 /nfs/dbraw/zinc/11/76/39/779117639.db2.gz QOEZKSZOPKUKMO-PWSUYJOCSA-N 0 3 253.292 2.788 20 10 CFCDHN Cc1cccc(O)c1CN1CC[C@@](C)(F)[C@@H](F)C1 ZINC001237484294 779118352 /nfs/dbraw/zinc/11/83/52/779118352.db2.gz ASDMTCVOIRQRGG-UONOGXRCSA-N 0 3 255.308 2.973 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2ccncc2C1 ZINC001237487847 779118961 /nfs/dbraw/zinc/11/89/61/779118961.db2.gz NMVJYKFDLIRFHS-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](O)[C@H](C)C2)c1[O-] ZINC001237681006 779160101 /nfs/dbraw/zinc/16/01/01/779160101.db2.gz KBCBRZIGVUDLGJ-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](O)[C@H](C)C2)c1[O-] ZINC001237681006 779160103 /nfs/dbraw/zinc/16/01/03/779160103.db2.gz KBCBRZIGVUDLGJ-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN COC(=O)CC[N@H+](Cc1cc(Cl)cc(C)c1[O-])C1CC1 ZINC001237687484 779161299 /nfs/dbraw/zinc/16/12/99/779161299.db2.gz DLYCQMNPYSQXJU-UHFFFAOYSA-N 0 3 297.782 2.882 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])C1CC1 ZINC001237687484 779161302 /nfs/dbraw/zinc/16/13/02/779161302.db2.gz DLYCQMNPYSQXJU-UHFFFAOYSA-N 0 3 297.782 2.882 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](O)CC2)c1[O-] ZINC001237682069 779161458 /nfs/dbraw/zinc/16/14/58/779161458.db2.gz WMCDBLSIYCAKSE-QMTHXVAHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](O)CC2)c1[O-] ZINC001237682069 779161462 /nfs/dbraw/zinc/16/14/62/779161462.db2.gz WMCDBLSIYCAKSE-QMTHXVAHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CCC2OCCO2)c1[O-] ZINC001237686354 779161505 /nfs/dbraw/zinc/16/15/05/779161505.db2.gz LACILBNVEGWFER-UHFFFAOYSA-N 0 3 285.771 2.549 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CCC2OCCO2)c1[O-] ZINC001237686354 779161510 /nfs/dbraw/zinc/16/15/10/779161510.db2.gz LACILBNVEGWFER-UHFFFAOYSA-N 0 3 285.771 2.549 20 10 CFCDHN Cc1cc(F)cc(CN(CCO)Cc2ccccc2)c1O ZINC001238059050 779241376 /nfs/dbraw/zinc/24/13/76/779241376.db2.gz ZIECVSZWHVJLDA-UHFFFAOYSA-N 0 3 289.350 2.834 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](O)(CF)CC2)c1[O-] ZINC001238055756 779241588 /nfs/dbraw/zinc/24/15/88/779241588.db2.gz DEEGWYDAKGWUAX-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](O)(CF)CC2)c1[O-] ZINC001238055756 779241590 /nfs/dbraw/zinc/24/15/90/779241590.db2.gz DEEGWYDAKGWUAX-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN COCC1CC[NH+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238056398 779241701 /nfs/dbraw/zinc/24/17/01/779241701.db2.gz HZBLAKZVUBXTHU-UHFFFAOYSA-N 0 3 267.344 2.698 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCCOC(C)(C)C2)c1[O-] ZINC001238061792 779242073 /nfs/dbraw/zinc/24/20/73/779242073.db2.gz IJRDCSNYGRQGRF-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCCOC(C)(C)C2)c1[O-] ZINC001238061792 779242076 /nfs/dbraw/zinc/24/20/76/779242076.db2.gz IJRDCSNYGRQGRF-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c1[O-] ZINC001238068265 779243738 /nfs/dbraw/zinc/24/37/38/779243738.db2.gz XPSHRWVOQSISDF-SMDDNHRTSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c1[O-] ZINC001238068265 779243741 /nfs/dbraw/zinc/24/37/41/779243741.db2.gz XPSHRWVOQSISDF-SMDDNHRTSA-N 0 3 277.339 2.641 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CC[C@@H]([NH3+])C2)cc1Cl ZINC001236171780 779491911 /nfs/dbraw/zinc/49/19/11/779491911.db2.gz BNWXUGZVOWZWFW-LLVKDONJSA-N 0 3 282.815 2.876 20 10 CFCDHN O=C1CCN(Cc2ccccc2O)[C@@H]2CCCC[C@H]12 ZINC001203546882 779978128 /nfs/dbraw/zinc/97/81/28/779978128.db2.gz BMGPHNXZWRUVBY-UONOGXRCSA-N 0 3 259.349 2.726 20 10 CFCDHN Oc1ccccc1CN1CCC[C@@H]1c1cnccn1 ZINC001203556707 780036394 /nfs/dbraw/zinc/03/63/94/780036394.db2.gz WHXOIRNXODJPKH-CQSZACIVSA-N 0 3 255.321 2.519 20 10 CFCDHN CN1CCCC[C@H](C[NH2+]Cc2cccc(Cl)c2[O-])C1 ZINC000700799509 780721769 /nfs/dbraw/zinc/72/17/69/780721769.db2.gz IOUUGYKFXCFSSU-GFCCVEGCSA-N 0 3 282.815 2.867 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)cc1[O-] ZINC000700816760 780727318 /nfs/dbraw/zinc/72/73/18/780727318.db2.gz NNTSNZOCIVPHGL-OLZOCXBDSA-N 0 3 280.387 2.914 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+]Cc1c([O-])cccc1Cl ZINC000113318972 780780469 /nfs/dbraw/zinc/78/04/69/780780469.db2.gz IPOSVAAWQYOVPX-LLVKDONJSA-N 0 3 270.804 2.866 20 10 CFCDHN CC1(O)CCC([NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000703544502 781027522 /nfs/dbraw/zinc/02/75/22/781027522.db2.gz OTTKAPCKZIOFFO-UYJPIKCFSA-N 0 3 261.365 2.663 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@@H](C(C)(C)C)C2)c1 ZINC000709000573 781287201 /nfs/dbraw/zinc/28/72/01/781287201.db2.gz OQKLYXSYRGBANA-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C(C)(C)O ZINC000295106689 199347924 /nfs/dbraw/zinc/34/79/24/199347924.db2.gz WTXPCDNARQWXES-RISCZKNCSA-N 0 3 251.370 2.901 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H](CO)C(C)(C)C)c1 ZINC000093837447 347685279 /nfs/dbraw/zinc/68/52/79/347685279.db2.gz SKDBKHSCBVMFMH-OAHLLOKOSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H](CO)C(C)(C)C)c1 ZINC000093837447 347685282 /nfs/dbraw/zinc/68/52/82/347685282.db2.gz SKDBKHSCBVMFMH-OAHLLOKOSA-N 0 3 281.396 2.630 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000295191840 199397733 /nfs/dbraw/zinc/39/77/33/199397733.db2.gz IZUGYPWTOCFGOR-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000295191840 199397735 /nfs/dbraw/zinc/39/77/35/199397735.db2.gz IZUGYPWTOCFGOR-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN COC(=O)[C@@H]1CCCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000294711787 199147144 /nfs/dbraw/zinc/14/71/44/199147144.db2.gz DTUHGJAZRCHBGR-KGLIPLIRSA-N 0 3 295.354 2.743 20 10 CFCDHN CCOc1cccc(CN[C@@H](C)c2cnn(CC)c2)c1O ZINC000294776953 199177614 /nfs/dbraw/zinc/17/76/14/199177614.db2.gz GKMNTRVAUMKYAT-LBPRGKRZSA-N 0 3 289.379 2.858 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H](C)CCCO)c1[O-] ZINC000294915818 199245906 /nfs/dbraw/zinc/24/59/06/199245906.db2.gz YJHCKSLBPWCTAJ-SNVBAGLBSA-N 0 3 271.788 2.852 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(CCO)CCCC1)CC2 ZINC000297885835 200299119 /nfs/dbraw/zinc/29/91/19/200299119.db2.gz VJCKXIIVLJHNLJ-CQSZACIVSA-N 0 3 275.392 2.912 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2cccs2)c1 ZINC000020091151 372228291 /nfs/dbraw/zinc/22/82/91/372228291.db2.gz JKXCFYMINHCUFE-UHFFFAOYSA-N 0 3 263.362 2.795 20 10 CFCDHN C[C@H](NCc1ccc(N(C)C)cc1)c1ccncc1 ZINC000020120956 372235623 /nfs/dbraw/zinc/23/56/23/372235623.db2.gz OPLYUFYMENJXEQ-ZDUSSCGKSA-N 0 3 255.365 2.998 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H]2CCCCO2)c1 ZINC000042812491 372958078 /nfs/dbraw/zinc/95/80/78/372958078.db2.gz KZXZODTWLCKMKH-DGCLKSJQSA-N 0 3 265.353 2.621 20 10 CFCDHN COc1cc(C[NH2+][C@H](C)c2ccccc2[O-])ccn1 ZINC000062057895 373745442 /nfs/dbraw/zinc/74/54/42/373745442.db2.gz FMBNQCNUWNXOSV-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H](OC)C2)c([O-])c1 ZINC000091772708 375062777 /nfs/dbraw/zinc/06/27/77/375062777.db2.gz QOFQJZLTZXPMCZ-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H](OC)C2)c([O-])c1 ZINC000091772708 375062779 /nfs/dbraw/zinc/06/27/79/375062779.db2.gz QOFQJZLTZXPMCZ-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCC[N@H+](Cc1c[nH]nc1C)Cc1ccccc1[O-] ZINC000092705075 375139271 /nfs/dbraw/zinc/13/92/71/375139271.db2.gz FHVLDZHQPSFBRE-UHFFFAOYSA-N 0 3 259.353 2.836 20 10 CFCDHN CCC[N@@H+](Cc1c[nH]nc1C)Cc1ccccc1[O-] ZINC000092705075 375139278 /nfs/dbraw/zinc/13/92/78/375139278.db2.gz FHVLDZHQPSFBRE-UHFFFAOYSA-N 0 3 259.353 2.836 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC([C@H](C)O)CC2)c([O-])c1 ZINC000092970497 375172897 /nfs/dbraw/zinc/17/28/97/375172897.db2.gz UGFDCYFBNBDGHI-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C2CCN(c3ccccn3)CC2)c1 ZINC000103855245 375759614 /nfs/dbraw/zinc/75/96/14/375759614.db2.gz RLQLEDTUCUULIT-UHFFFAOYSA-N 0 3 297.402 2.854 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(N(C)C)CCCC2)c1[O-] ZINC000111254329 375836258 /nfs/dbraw/zinc/83/62/58/375836258.db2.gz ALTLZEMUWNRDGE-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCOC1CCCCC1)OCO2 ZINC000111607911 375856278 /nfs/dbraw/zinc/85/62/78/375856278.db2.gz HCQUCRCZIUCIJK-UHFFFAOYSA-N 0 3 293.363 2.560 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@](C)(O)c2ccccc2)c1 ZINC000114508237 376073112 /nfs/dbraw/zinc/07/31/12/376073112.db2.gz ZPPMMYPPEYAUKS-QGZVFWFLSA-N 0 3 271.360 2.698 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCC(=O)N2CCCCC2)c1 ZINC000123770533 376977396 /nfs/dbraw/zinc/97/73/96/376977396.db2.gz TWKIUZHCWIHMSL-AWEZNQCLSA-N 0 3 290.407 2.754 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H]2CSCCS2)c1 ZINC000125212486 377127628 /nfs/dbraw/zinc/12/76/28/377127628.db2.gz QQSWKAYWHJULTK-LBPRGKRZSA-N 0 3 269.435 2.639 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H]2CSCCS2)c1[O-] ZINC000125227016 377131864 /nfs/dbraw/zinc/13/18/64/377131864.db2.gz ZZCZWCQOVQZPSH-GFCCVEGCSA-N 0 3 299.461 2.729 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](C)SC)c1[O-] ZINC000128011093 377312664 /nfs/dbraw/zinc/31/26/64/377312664.db2.gz UZNJRKLUHUWFCJ-JTQLQIEISA-N 0 3 255.383 2.632 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H]3OCCC[C@@H]3C2)cc1F ZINC000128104967 377316525 /nfs/dbraw/zinc/31/65/25/377316525.db2.gz QSCPEVSLPSRILE-RHSMWYFYSA-N 0 3 292.398 2.893 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@H]1c1ccc[nH]1)OCO2 ZINC000127502297 377286385 /nfs/dbraw/zinc/28/63/85/377286385.db2.gz AOWYCILCQBMQIA-ZDUSSCGKSA-N 0 3 286.331 2.786 20 10 CFCDHN COCC[N@@H+](Cc1cc(OC)ccc1[O-])CC(C)C ZINC000132646941 377861328 /nfs/dbraw/zinc/86/13/28/377861328.db2.gz PPIXJEUKBADXEX-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN COCC[N@H+](Cc1cc(OC)ccc1[O-])CC(C)C ZINC000132646941 377861332 /nfs/dbraw/zinc/86/13/32/377861332.db2.gz PPIXJEUKBADXEX-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN CCOc1cccc(C[NH2+]Cc2ccccc2[O-])c1O ZINC000134235989 377995362 /nfs/dbraw/zinc/99/53/62/377995362.db2.gz WZYQVSATDSSAFT-UHFFFAOYSA-N 0 3 273.332 2.786 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C)C2CCOCC2)c1[O-] ZINC000134496148 378023393 /nfs/dbraw/zinc/02/33/93/378023393.db2.gz SWWARORXOBDMFQ-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCc2cnn(C)c2)cc1 ZINC000151147475 378300908 /nfs/dbraw/zinc/30/09/08/378300908.db2.gz KKGQDVVTUYEIJZ-ZDUSSCGKSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[C@@H]([NH2+]CCNC(=O)c1ccccc1)c1ccccc1[O-] ZINC000155399880 378626048 /nfs/dbraw/zinc/62/60/48/378626048.db2.gz HQVJEARPBNQHMX-MRXNPFEDSA-N 0 3 298.386 2.863 20 10 CFCDHN CC[N@H+](CCc1nccs1)Cc1ccccc1[O-] ZINC000179582003 380560259 /nfs/dbraw/zinc/56/02/59/380560259.db2.gz LDGPBJGYSZSGLE-UHFFFAOYSA-N 0 3 262.378 2.913 20 10 CFCDHN CC[N@@H+](CCc1nccs1)Cc1ccccc1[O-] ZINC000179582003 380560263 /nfs/dbraw/zinc/56/02/63/380560263.db2.gz LDGPBJGYSZSGLE-UHFFFAOYSA-N 0 3 262.378 2.913 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC000179780288 380580106 /nfs/dbraw/zinc/58/01/06/380580106.db2.gz DJIYJDWQXPORRT-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC000179780288 380580107 /nfs/dbraw/zinc/58/01/07/380580107.db2.gz DJIYJDWQXPORRT-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN CN(CC[C@H]1CCCC[N@@H+]1C)Cc1cc(F)ccc1[O-] ZINC000180198296 380632220 /nfs/dbraw/zinc/63/22/20/380632220.db2.gz LQFBYCBYABSGQA-OAHLLOKOSA-N 0 3 280.387 2.838 20 10 CFCDHN CN(CC[C@H]1CCCC[N@H+]1C)Cc1cc(F)ccc1[O-] ZINC000180198296 380632221 /nfs/dbraw/zinc/63/22/21/380632221.db2.gz LQFBYCBYABSGQA-OAHLLOKOSA-N 0 3 280.387 2.838 20 10 CFCDHN CC(C)[N@H+]1[C@@H]2CC[C@H]1CCN(Cc1cc(F)ccc1[O-])C2 ZINC000180194414 380632665 /nfs/dbraw/zinc/63/26/65/380632665.db2.gz MYVCVJMIJQMOAW-JKSUJKDBSA-N 0 3 292.398 2.978 20 10 CFCDHN CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(Cc1cc(F)ccc1[O-])C2 ZINC000180194414 380632670 /nfs/dbraw/zinc/63/26/70/380632670.db2.gz MYVCVJMIJQMOAW-JKSUJKDBSA-N 0 3 292.398 2.978 20 10 CFCDHN CC[NH+](CC)C[C@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180207485 380633751 /nfs/dbraw/zinc/63/37/51/380633751.db2.gz DEKRYYLUYJIUKN-CYBMUJFWSA-N 0 3 280.387 2.695 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000180206292 380634436 /nfs/dbraw/zinc/63/44/36/380634436.db2.gz SNTBMRHLPZGBMI-HNNXBMFYSA-N 0 3 288.322 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000180206292 380634447 /nfs/dbraw/zinc/63/44/47/380634447.db2.gz SNTBMRHLPZGBMI-HNNXBMFYSA-N 0 3 288.322 2.580 20 10 CFCDHN C[C@@H]([NH2+]CCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000179877700 380591479 /nfs/dbraw/zinc/59/14/79/380591479.db2.gz GPGQWLQWPHXKEN-LLVKDONJSA-N 0 3 280.368 2.568 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@@H](C)CCSC)c1 ZINC000180349901 380647746 /nfs/dbraw/zinc/64/77/46/380647746.db2.gz PRPJNYOVWKWNCH-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@@H](C)CCSC)c1 ZINC000180349901 380647747 /nfs/dbraw/zinc/64/77/47/380647747.db2.gz PRPJNYOVWKWNCH-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCc2nccs2)c1[O-] ZINC000180632365 380684295 /nfs/dbraw/zinc/68/42/95/380684295.db2.gz UTZXDYIBVLDWOG-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCc2nccs2)c1[O-] ZINC000180632365 380684298 /nfs/dbraw/zinc/68/42/98/380684298.db2.gz UTZXDYIBVLDWOG-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000295926081 381161036 /nfs/dbraw/zinc/16/10/36/381161036.db2.gz JZRHLVJJVUQPML-NVXWUHKLSA-N 0 3 299.370 2.711 20 10 CFCDHN CC[C@@H]([NH2+]CCCc1cnn(C)c1)c1ccccc1[O-] ZINC000183323330 381253981 /nfs/dbraw/zinc/25/39/81/381253981.db2.gz USNBINZUMUQRSI-OAHLLOKOSA-N 0 3 273.380 2.799 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000289926606 381221055 /nfs/dbraw/zinc/22/10/55/381221055.db2.gz XSIRWFYHVBBRJF-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000289926606 381221060 /nfs/dbraw/zinc/22/10/60/381221060.db2.gz XSIRWFYHVBBRJF-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN C[C@H]([NH2+]CCN1CCCC[C@@H]1C)c1ccccc1[O-] ZINC000183420086 381269324 /nfs/dbraw/zinc/26/93/24/381269324.db2.gz OKHCRAGYOGDDMN-KBPBESRZSA-N 0 3 262.397 2.917 20 10 CFCDHN CSC1(C[NH2+][C@@H](C)c2ccccc2[O-])CCOCC1 ZINC000183612784 381293245 /nfs/dbraw/zinc/29/32/45/381293245.db2.gz WLXWCODOWDCCPJ-LBPRGKRZSA-N 0 3 281.421 2.955 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)c1ccccc1[O-] ZINC000183549088 381286244 /nfs/dbraw/zinc/28/62/44/381286244.db2.gz NMIGXHKNLQPSPP-AGIUHOORSA-N 0 3 260.381 2.668 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC[C@@H](CO)C1)c1ccc(C)cc1[O-] ZINC000296315034 381344336 /nfs/dbraw/zinc/34/43/36/381344336.db2.gz GONFFEPDELJSGC-IPYPFGDCSA-N 0 3 263.381 2.902 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000296465635 381408470 /nfs/dbraw/zinc/40/84/70/381408470.db2.gz OBHKJDJVIOWDAR-CQSZACIVSA-N 0 3 297.358 2.523 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCC(C)(C)CO)c1 ZINC000296440587 381398065 /nfs/dbraw/zinc/39/80/65/381398065.db2.gz MGKPKJJGHYBBTG-LBPRGKRZSA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@H](CCCCO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000296637968 381484122 /nfs/dbraw/zinc/48/41/22/381484122.db2.gz XXDCBGODYNVJQJ-MNOVXSKESA-N 0 3 255.333 2.733 20 10 CFCDHN CCOc1ccc(O)c(CN2CC(C)(CCOC)C2)c1 ZINC000297382636 381560757 /nfs/dbraw/zinc/56/07/57/381560757.db2.gz JPQXEYIGVRCMQR-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](C)c2cn(C)nc2C)c1 ZINC000185349569 381607734 /nfs/dbraw/zinc/60/77/34/381607734.db2.gz SQURAQQAFLNQLX-QWRGUYRKSA-N 0 3 289.379 2.855 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1cc(C)ccc1[O-])C1CC1 ZINC000185307877 381593353 /nfs/dbraw/zinc/59/33/53/381593353.db2.gz WRFSYFDKNDZEOK-ZDUSSCGKSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000185370521 381615445 /nfs/dbraw/zinc/61/54/45/381615445.db2.gz XPGYNTNBHNHVDZ-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(F)ccc1[O-] ZINC000185460518 381637806 /nfs/dbraw/zinc/63/78/06/381637806.db2.gz ZIKSJXAFJNMVGD-PFEFGLNJSA-N 0 3 251.301 2.502 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC23CCC(CO)CC3)c1 ZINC000371477542 381638686 /nfs/dbraw/zinc/63/86/86/381638686.db2.gz MXFRGQILYNHSFA-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC23CCC(CO)CC3)c1 ZINC000371477542 381638694 /nfs/dbraw/zinc/63/86/94/381638694.db2.gz MXFRGQILYNHSFA-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)CC(C)(C)C)c1 ZINC000185482064 381645984 /nfs/dbraw/zinc/64/59/84/381645984.db2.gz XRTRTSLBXBZTOT-NEPJUHHUSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@@H]([NH2+]CCCC(C)(C)CO)c1cc(F)ccc1[O-] ZINC000185537846 381659979 /nfs/dbraw/zinc/65/99/79/381659979.db2.gz BAIYPEJCSLLCCZ-LLVKDONJSA-N 0 3 269.360 2.981 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2CN(C)Cc3ccccc32)c1 ZINC000359894943 381662897 /nfs/dbraw/zinc/66/28/97/381662897.db2.gz FYKVGHJYEFTYKQ-QGZVFWFLSA-N 0 3 298.386 2.677 20 10 CFCDHN CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)[C@@H]1SC ZINC000298538351 381666347 /nfs/dbraw/zinc/66/63/47/381666347.db2.gz SUKDUZPRZMJDLG-OAGGEKHMSA-N 0 3 294.464 2.751 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000185672705 381699982 /nfs/dbraw/zinc/69/99/82/381699982.db2.gz SZWNYUYLTWINGZ-MDZLAQPJSA-N 0 3 278.371 2.807 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c([O-])c1 ZINC000186115479 381826544 /nfs/dbraw/zinc/82/65/44/381826544.db2.gz VMTVZZIRJSAWII-WCQYABFASA-N 0 3 271.364 2.632 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000186143948 381834245 /nfs/dbraw/zinc/83/42/45/381834245.db2.gz JCKUZXRROMQVJR-PWSUYJOCSA-N 0 3 269.360 2.979 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000186170465 381841660 /nfs/dbraw/zinc/84/16/60/381841660.db2.gz FAKQNYJPRVWTOV-LBPRGKRZSA-N 0 3 281.396 2.850 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCOCC1)c1cc(F)ccc1[O-] ZINC000186235026 381859662 /nfs/dbraw/zinc/85/96/62/381859662.db2.gz KWQZZLRLEASNJA-PWSUYJOCSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1cc(CN2CCCO[C@H](C)C2)ccc1N(C)C ZINC000292962392 381924728 /nfs/dbraw/zinc/92/47/28/381924728.db2.gz CVPLZGLHJFVPPQ-CQSZACIVSA-N 0 3 262.397 2.672 20 10 CFCDHN Cc1ncc2c(n1)CC[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C2 ZINC000374713858 382052928 /nfs/dbraw/zinc/05/29/28/382052928.db2.gz WYSVRYAQTKFEIY-BXUZGUMPSA-N 0 3 283.375 2.699 20 10 CFCDHN Cc1noc(C2(C)CC[NH+](Cc3ccccc3[O-])CC2)n1 ZINC000374725776 382054771 /nfs/dbraw/zinc/05/47/71/382054771.db2.gz JTNPDPFXTFLJPX-UHFFFAOYSA-N 0 3 287.363 2.637 20 10 CFCDHN CN1CCc2cc(CNCc3cnn(C(C)(C)C)c3)ccc21 ZINC000375321637 382078348 /nfs/dbraw/zinc/07/83/48/382078348.db2.gz WAAUTCSVNFAAKQ-UHFFFAOYSA-N 0 3 298.434 2.920 20 10 CFCDHN Cc1cc(CN2CC[C@H](n3cccn3)C2)ccc1N(C)C ZINC000293564578 382177573 /nfs/dbraw/zinc/17/75/73/382177573.db2.gz MMESPFQVSCVXOX-INIZCTEOSA-N 0 3 284.407 2.705 20 10 CFCDHN COc1cccc(CN[C@H]2C[C@H](CO)c3ccccc32)c1O ZINC000376958358 382197723 /nfs/dbraw/zinc/19/77/23/382197723.db2.gz PKIYFTVEPNGFAN-CJNGLKHVSA-N 0 3 299.370 2.711 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293814894 382290121 /nfs/dbraw/zinc/29/01/21/382290121.db2.gz RTRMJEKSGARAJZ-ZIAGYGMSSA-N 0 3 292.423 2.964 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2ccccc2[O-])CCO[C@H]1C1CC1 ZINC000364070132 382257979 /nfs/dbraw/zinc/25/79/79/382257979.db2.gz BGJORNHCPDBMCQ-HOTGVXAUSA-N 0 3 261.365 2.687 20 10 CFCDHN CC[C@H](O)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000293759976 382268226 /nfs/dbraw/zinc/26/82/26/382268226.db2.gz RZVJXOWAVCBYMY-RISCZKNCSA-N 0 3 263.381 2.693 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000293767989 382271284 /nfs/dbraw/zinc/27/12/84/382271284.db2.gz RVRAUQLEBMEVBV-KBPBESRZSA-N 0 3 292.423 2.904 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)C(F)(F)F)c([O-])c1 ZINC000293771061 382272633 /nfs/dbraw/zinc/27/26/33/382272633.db2.gz PPGMNZILGAOVOJ-ONGXEEELSA-N 0 3 277.286 2.583 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293773909 382273892 /nfs/dbraw/zinc/27/38/92/382273892.db2.gz YUKSUVJTRYFOHD-INIZCTEOSA-N 0 3 273.376 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293773909 382273898 /nfs/dbraw/zinc/27/38/98/382273898.db2.gz YUKSUVJTRYFOHD-INIZCTEOSA-N 0 3 273.376 2.783 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C[C@H]1C ZINC000188106613 382345211 /nfs/dbraw/zinc/34/52/11/382345211.db2.gz SGBFYBMRGIWSQD-UKRRQHHQSA-N 0 3 291.391 2.640 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C[C@H]1C ZINC000188106613 382345215 /nfs/dbraw/zinc/34/52/15/382345215.db2.gz SGBFYBMRGIWSQD-UKRRQHHQSA-N 0 3 291.391 2.640 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364540415 382325005 /nfs/dbraw/zinc/32/50/05/382325005.db2.gz CVMBGASOLCTHSD-DYVFJYSZSA-N 0 3 299.370 2.711 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364540415 382325010 /nfs/dbraw/zinc/32/50/10/382325010.db2.gz CVMBGASOLCTHSD-DYVFJYSZSA-N 0 3 299.370 2.711 20 10 CFCDHN CO[C@H](C)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000188121146 382349361 /nfs/dbraw/zinc/34/93/61/382349361.db2.gz YDTSTUYRRTUXEM-VXGBXAGGSA-N 0 3 263.381 2.957 20 10 CFCDHN CO[C@H](C)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000188121099 382349765 /nfs/dbraw/zinc/34/97/65/382349765.db2.gz YDTSTUYRRTUXEM-NEPJUHHUSA-N 0 3 263.381 2.957 20 10 CFCDHN COc1ccncc1CN[C@H](C)c1ccc(C)cc1O ZINC000293967795 382359327 /nfs/dbraw/zinc/35/93/27/382359327.db2.gz AOBJGAHNFONPOG-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000294025063 382383817 /nfs/dbraw/zinc/38/38/17/382383817.db2.gz NTOLHDPCINFDTM-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000294025063 382383822 /nfs/dbraw/zinc/38/38/22/382383822.db2.gz NTOLHDPCINFDTM-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN Cc1nc([C@H]2CCC[N@H+](Cc3cc(C)ccc3[O-])C2)no1 ZINC000378351310 382446717 /nfs/dbraw/zinc/44/67/17/382446717.db2.gz STNHWVGYBPVKCO-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nc([C@H]2CCC[N@@H+](Cc3cc(C)ccc3[O-])C2)no1 ZINC000378351310 382446722 /nfs/dbraw/zinc/44/67/22/382446722.db2.gz STNHWVGYBPVKCO-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN [O-]c1c(F)cccc1CN1CCC[C@@H]1C[NH+]1CCCC1 ZINC000378501859 382475048 /nfs/dbraw/zinc/47/50/48/382475048.db2.gz ZRJGWRHFOPFHGY-CQSZACIVSA-N 0 3 278.371 2.592 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1cc(C)c(C)cc1[O-])OC ZINC000294690524 382525547 /nfs/dbraw/zinc/52/55/47/382525547.db2.gz BSOZOXFUEJFRGD-CQSZACIVSA-N 0 3 251.370 2.914 20 10 CFCDHN CN(Cc1ccc(N2CCCCC2)cc1)CC1(CO)CC1 ZINC000188959472 382512363 /nfs/dbraw/zinc/51/23/63/382512363.db2.gz AXWPVTLSSCZAER-UHFFFAOYSA-N 0 3 288.435 2.881 20 10 CFCDHN CS[C@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000294920773 382543228 /nfs/dbraw/zinc/54/32/28/382543228.db2.gz AVGQPNJIZUDLCW-ZDUSSCGKSA-N 0 3 251.395 2.946 20 10 CFCDHN CS[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000294920773 382543232 /nfs/dbraw/zinc/54/32/32/382543232.db2.gz AVGQPNJIZUDLCW-ZDUSSCGKSA-N 0 3 251.395 2.946 20 10 CFCDHN CC[C@@H](COCC(F)(F)F)[NH2+]Cc1ccccc1[O-] ZINC000295124001 382577069 /nfs/dbraw/zinc/57/70/69/382577069.db2.gz NRXNQXADWMGRQA-NSHDSACASA-N 0 3 277.286 2.839 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cc(OC)c(OC)cc1[O-])OC ZINC000294818285 382531594 /nfs/dbraw/zinc/53/15/94/382531594.db2.gz OPYIFWHFJMWJSU-BZNIZROVSA-N 0 3 297.395 2.560 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC(C)(C)c2ccccn2)c1 ZINC000294828294 382532500 /nfs/dbraw/zinc/53/25/00/382532500.db2.gz PROLTPJUOREPPA-UHFFFAOYSA-N 0 3 286.375 2.863 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H](OC)[C@@H](C)CC)c1 ZINC000294840499 382534412 /nfs/dbraw/zinc/53/44/12/382534412.db2.gz RCOVYPWEOUTTBD-BLLLJJGKSA-N 0 3 281.396 2.942 20 10 CFCDHN CS[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000295129568 382578089 /nfs/dbraw/zinc/57/80/89/382578089.db2.gz XTLGEJIOXXJZPN-LBPRGKRZSA-N 0 3 268.401 2.829 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCC[C@@H]2CCO)cc1C ZINC000189971861 382647603 /nfs/dbraw/zinc/64/76/03/382647603.db2.gz SGVYZBTUPAOIPP-UKRRQHHQSA-N 0 3 263.381 2.650 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])CC1CCC2(CC1)OCCO2 ZINC000190295054 382660932 /nfs/dbraw/zinc/66/09/32/382660932.db2.gz USTWHELOJQVZMQ-UHFFFAOYSA-N 0 3 291.391 2.757 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])CC1CCC2(CC1)OCCO2 ZINC000190295054 382660934 /nfs/dbraw/zinc/66/09/34/382660934.db2.gz USTWHELOJQVZMQ-UHFFFAOYSA-N 0 3 291.391 2.757 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCSC[C@H](C)C2)c1 ZINC000190850298 382682749 /nfs/dbraw/zinc/68/27/49/382682749.db2.gz WKAYNDXOAAWTMK-GFCCVEGCSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCSC[C@H](C)C2)c1 ZINC000190850298 382682751 /nfs/dbraw/zinc/68/27/51/382682751.db2.gz WKAYNDXOAAWTMK-GFCCVEGCSA-N 0 3 251.395 2.886 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCOCC(F)F)c([O-])c1 ZINC000190900498 382684407 /nfs/dbraw/zinc/68/44/07/382684407.db2.gz QNABHVSWWXETSY-UHFFFAOYSA-N 0 3 289.322 2.552 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c1 ZINC000251695538 383393879 /nfs/dbraw/zinc/39/38/79/383393879.db2.gz JQKKOGWHQXCEDW-CAVOSLQRSA-N 0 3 261.365 2.919 20 10 CFCDHN Cc1cc(O)c(CN[C@@H](CO)c2ccc(F)cc2)cc1C ZINC000266124434 384085489 /nfs/dbraw/zinc/08/54/89/384085489.db2.gz BEWHHDKDPHIIAH-INIZCTEOSA-N 0 3 289.350 2.971 20 10 CFCDHN COC[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000266961812 384269649 /nfs/dbraw/zinc/26/96/49/384269649.db2.gz KICUDNYTMDESGF-INIZCTEOSA-N 0 3 271.360 2.740 20 10 CFCDHN C[C@H](C(=O)N(C)Cc1ccccc1O)N1CCCCCC1 ZINC000118775273 412994272 /nfs/dbraw/zinc/99/42/72/412994272.db2.gz WUXXXLRRCFQYGG-CQSZACIVSA-N 0 3 290.407 2.615 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2([S@@](C)=O)CC2)c([O-])c1C ZINC000282241827 385257433 /nfs/dbraw/zinc/25/74/33/385257433.db2.gz JBLBFCLSWIYBPS-CWTRNNRKSA-N 0 3 281.421 2.571 20 10 CFCDHN CCCC[N@H+](CCC(=O)N(C)CC)Cc1ccccc1[O-] ZINC000282358926 385292863 /nfs/dbraw/zinc/29/28/63/385292863.db2.gz DBDPXKHRSWODND-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN CCCC[N@@H+](CCC(=O)N(C)CC)Cc1ccccc1[O-] ZINC000282358926 385292867 /nfs/dbraw/zinc/29/28/67/385292867.db2.gz DBDPXKHRSWODND-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN CCC[N@H+](Cc1cc(C)c(C)cc1[O-])CC(C)(C)O ZINC000271178130 385363949 /nfs/dbraw/zinc/36/39/49/385363949.db2.gz VKQWZGIYHXWOON-UHFFFAOYSA-N 0 3 265.397 2.992 20 10 CFCDHN CCC[N@@H+](Cc1cc(C)c(C)cc1[O-])CC(C)(C)O ZINC000271178130 385363953 /nfs/dbraw/zinc/36/39/53/385363953.db2.gz VKQWZGIYHXWOON-UHFFFAOYSA-N 0 3 265.397 2.992 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2([C@H](C)CCO)CCC2)c1 ZINC000271791418 385392268 /nfs/dbraw/zinc/39/22/68/385392268.db2.gz GVXJZNKFPULOIJ-CYBMUJFWSA-N 0 3 293.407 2.679 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@](C)(O)c2cccs2)c1[O-] ZINC000271819152 385394171 /nfs/dbraw/zinc/39/41/71/385394171.db2.gz MLSZQURGOYCSDE-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CSC2(C)C)cc1C ZINC000282911810 385409357 /nfs/dbraw/zinc/40/93/57/385409357.db2.gz VDFUMVNRRCBPLW-CYBMUJFWSA-N 0 3 251.395 2.993 20 10 CFCDHN O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1cc(F)ccc1[O-] ZINC000272409208 385530369 /nfs/dbraw/zinc/53/03/69/385530369.db2.gz KONZTTHPUWIIHM-ZDUSSCGKSA-N 0 3 288.322 2.799 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284086019 385533541 /nfs/dbraw/zinc/53/35/41/385533541.db2.gz MAJLTDZFMOPLGA-ZDUSSCGKSA-N 0 3 273.380 2.865 20 10 CFCDHN CN(C)c1ccc(CN(C)Cc2c[nH]c3nccnc23)cc1 ZINC000284312788 385547564 /nfs/dbraw/zinc/54/75/64/385547564.db2.gz VULXMCIMAFGSHA-UHFFFAOYSA-N 0 3 295.390 2.656 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)CN2CCCC2=O)c([O-])c1 ZINC000284275188 385547681 /nfs/dbraw/zinc/54/76/81/385547681.db2.gz XBSNJHLSJZNNCW-UONOGXRCSA-N 0 3 290.407 2.671 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000284996163 385551578 /nfs/dbraw/zinc/55/15/78/385551578.db2.gz JELYYTZCNZKJNT-UONOGXRCSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000284996163 385551581 /nfs/dbraw/zinc/55/15/81/385551581.db2.gz JELYYTZCNZKJNT-UONOGXRCSA-N 0 3 277.364 2.544 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c([O-])c1 ZINC000285219855 385552679 /nfs/dbraw/zinc/55/26/79/385552679.db2.gz OVWHRSJBGGGFKT-ZUOKHONESA-N 0 3 295.448 2.961 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@@H](O)C2(C)C)c([O-])c1 ZINC000285402640 385555585 /nfs/dbraw/zinc/55/55/85/385555585.db2.gz XGPREKOBOOURGM-IACUBPJLSA-N 0 3 263.381 2.819 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@H]2CCCC[C@H]2O)c1[O-] ZINC000272653191 385582921 /nfs/dbraw/zinc/58/29/21/385582921.db2.gz QEVPLZKOJLQLGR-UKRRQHHQSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c1[O-] ZINC000272653191 385582925 /nfs/dbraw/zinc/58/29/25/385582925.db2.gz QEVPLZKOJLQLGR-UKRRQHHQSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCC[C@H](C(=O)N(C)C)C1)c1ccccc1[O-] ZINC000272843565 385631473 /nfs/dbraw/zinc/63/14/73/385631473.db2.gz JWHBCDWVSRHFOK-IHRRRGAJSA-N 0 3 290.407 2.690 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C2CCN(C)CC2)c([O-])c1C ZINC000273297589 385675698 /nfs/dbraw/zinc/67/56/98/385675698.db2.gz AMZOGWBLGLEWGP-ZDUSSCGKSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cn2ccnc2)c([O-])c1C ZINC000273375770 385678261 /nfs/dbraw/zinc/67/82/61/385678261.db2.gz HCNUGUDFFZPZDP-OCCSQVGLSA-N 0 3 273.380 2.945 20 10 CFCDHN CCn1cc(CN[C@H](C)c2cc(C)ccc2O)cn1 ZINC000273354504 385678349 /nfs/dbraw/zinc/67/83/49/385678349.db2.gz CJPRWQKUCFAKJQ-GFCCVEGCSA-N 0 3 259.353 2.768 20 10 CFCDHN C[C@H]([NH2+]CCNc1ccccn1)c1cc(F)ccc1[O-] ZINC000273368881 385678611 /nfs/dbraw/zinc/67/86/11/385678611.db2.gz BZETUNOFKMGNCL-NSHDSACASA-N 0 3 275.327 2.689 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@]1(C)[NH2+]Cc1ccccc1[O-] ZINC000273374790 385679441 /nfs/dbraw/zinc/67/94/41/385679441.db2.gz BHXASYUGJDSJGU-BBRMVZONSA-N 0 3 277.364 2.604 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000273442742 385683074 /nfs/dbraw/zinc/68/30/74/385683074.db2.gz WSIHPRARTVVGJH-KGLIPLIRSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000273442742 385683079 /nfs/dbraw/zinc/68/30/79/385683079.db2.gz WSIHPRARTVVGJH-KGLIPLIRSA-N 0 3 293.407 2.630 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cn2cccn2)c([O-])c1C ZINC000273503745 385685599 /nfs/dbraw/zinc/68/55/99/385685599.db2.gz QPACLWZRCXLQPT-GXTWGEPZSA-N 0 3 273.380 2.945 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CC(=O)N(C(C)C)C2)c([O-])c1C ZINC000273497409 385686483 /nfs/dbraw/zinc/68/64/83/385686483.db2.gz PMAHDTMTKLJNDA-KGLIPLIRSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1 ZINC000273502195 385686620 /nfs/dbraw/zinc/68/66/20/385686620.db2.gz QLBCYBHEQGTNRY-SKDRFNHKSA-N 0 3 277.286 2.665 20 10 CFCDHN C[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1cc(F)ccc1[O-] ZINC000273558529 385688186 /nfs/dbraw/zinc/68/81/86/385688186.db2.gz HMBCIFROTWRTDY-SECBINFHSA-N 0 3 294.292 2.676 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H](C)c1cc(Cl)ccc1[O-] ZINC000273582441 385689211 /nfs/dbraw/zinc/68/92/11/385689211.db2.gz MYTHOAWLCQBHBE-JTQLQIEISA-N 0 3 279.771 2.901 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(C(N)=O)CCCC2)c([O-])c1C ZINC000273610821 385691620 /nfs/dbraw/zinc/69/16/20/385691620.db2.gz VTFXCSUEGKAVJJ-CYBMUJFWSA-N 0 3 290.407 2.705 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](CCO)C2CCCC2)c1[O-] ZINC000273774578 385694454 /nfs/dbraw/zinc/69/44/54/385694454.db2.gz RKSCFGFKLIHCDC-UHFFFAOYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](CCO)C2CCCC2)c1[O-] ZINC000273774578 385694459 /nfs/dbraw/zinc/69/44/59/385694459.db2.gz RKSCFGFKLIHCDC-UHFFFAOYSA-N 0 3 299.798 2.791 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]3CCC[C@H]31)OCO2 ZINC000228173113 285382022 /nfs/dbraw/zinc/38/20/22/285382022.db2.gz SZXMVIJEOGZEPP-DGCLKSJQSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]3CCC[C@H]31)OCO2 ZINC000228173113 285382024 /nfs/dbraw/zinc/38/20/24/285382024.db2.gz SZXMVIJEOGZEPP-DGCLKSJQSA-N 0 3 275.348 2.885 20 10 CFCDHN Oc1cccc2c1[C@H](N[C@@H]1CCCc3c[nH]nc31)CC2 ZINC000296660790 285397650 /nfs/dbraw/zinc/39/76/50/285397650.db2.gz FEQNYVMBAGEHFP-CHWSQXEVSA-N 0 3 269.348 2.770 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CN1C1CC1 ZINC000297826145 393448066 /nfs/dbraw/zinc/44/80/66/393448066.db2.gz ROQAPXJAFCRGPB-OSAQELSMSA-N 0 3 272.392 2.594 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCO[C@@H]2C2CC2)cc1C ZINC000372864404 393458346 /nfs/dbraw/zinc/45/83/46/393458346.db2.gz VVZGYHAQWSJTBU-GDBMZVCRSA-N 0 3 261.365 2.666 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccccc2[O-])C[C@]2(CCO[C@H](C)C2)O1 ZINC000373978970 393477393 /nfs/dbraw/zinc/47/73/93/393477393.db2.gz UMMWPFKDDZHSIW-CKEIUWERSA-N 0 3 291.391 2.551 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccccc2[O-])C[C@]2(CCO[C@H](C)C2)O1 ZINC000373978970 393477396 /nfs/dbraw/zinc/47/73/96/393477396.db2.gz UMMWPFKDDZHSIW-CKEIUWERSA-N 0 3 291.391 2.551 20 10 CFCDHN CCC[N@H+](CCn1cccn1)Cc1ccccc1[O-] ZINC000068973537 393635839 /nfs/dbraw/zinc/63/58/39/393635839.db2.gz VTVZQSGLBQBIOP-UHFFFAOYSA-N 0 3 259.353 2.501 20 10 CFCDHN CCC[N@@H+](CCn1cccn1)Cc1ccccc1[O-] ZINC000068973537 393635842 /nfs/dbraw/zinc/63/58/42/393635842.db2.gz VTVZQSGLBQBIOP-UHFFFAOYSA-N 0 3 259.353 2.501 20 10 CFCDHN COc1ccc(N2CCN(CCCSC)CC2)cc1F ZINC000121995771 393963166 /nfs/dbraw/zinc/96/31/66/393963166.db2.gz ITUDWXXQGBZJFS-UHFFFAOYSA-N 0 3 298.427 2.709 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(O)CCc3ccccc32)c1[O-] ZINC000271786701 394023517 /nfs/dbraw/zinc/02/35/17/394023517.db2.gz FQXZHRDJGCUDTA-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN CO[C@H](C)CNCc1ccc(N(C)C)cc1C(F)(F)F ZINC000280468649 394072276 /nfs/dbraw/zinc/07/22/76/394072276.db2.gz CJXAZEVSASEBJH-SNVBAGLBSA-N 0 3 290.329 2.896 20 10 CFCDHN OC[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000364435029 394212247 /nfs/dbraw/zinc/21/22/47/394212247.db2.gz JPRJNOHSGZMPSY-YJBOKZPZSA-N 0 3 295.382 2.932 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2C[C@]2(C)OC(C)C)c1[O-] ZINC000527801264 394408427 /nfs/dbraw/zinc/40/84/27/394408427.db2.gz SWOJXKUGAOQPDH-ZBFHGGJFSA-N 0 3 279.380 2.837 20 10 CFCDHN CCOc1cccc(CN[C@@H]2C[C@]2(C)OC(C)C)c1O ZINC000527801264 394408429 /nfs/dbraw/zinc/40/84/29/394408429.db2.gz SWOJXKUGAOQPDH-ZBFHGGJFSA-N 0 3 279.380 2.837 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C(=O)N(C)CC)c1ccc(C)cc1[O-] ZINC000280014679 286918265 /nfs/dbraw/zinc/91/82/65/286918265.db2.gz GXBDPXCNPAWZHV-GXTWGEPZSA-N 0 3 278.396 2.608 20 10 CFCDHN C[N@H+](Cc1ccc2c(c1)OCCO2)Cc1ccccc1[O-] ZINC000006625431 170219793 /nfs/dbraw/zinc/21/97/93/170219793.db2.gz HMSHOBCMBFGNPM-UHFFFAOYSA-N 0 3 285.343 2.795 20 10 CFCDHN C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1ccccc1[O-] ZINC000006625431 170219794 /nfs/dbraw/zinc/21/97/94/170219794.db2.gz HMSHOBCMBFGNPM-UHFFFAOYSA-N 0 3 285.343 2.795 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1 ZINC000020125998 171009951 /nfs/dbraw/zinc/00/99/51/171009951.db2.gz XBRDHQNTZJZZOD-LBPRGKRZSA-N 0 3 250.386 2.691 20 10 CFCDHN C[C@@H](NCc1ccc(N(C)C)cc1)c1cccnc1 ZINC000020127435 171013228 /nfs/dbraw/zinc/01/32/28/171013228.db2.gz STCOYLMETHBERL-CYBMUJFWSA-N 0 3 255.365 2.998 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[C@@H]2CCCO2)c1 ZINC000038095580 174109767 /nfs/dbraw/zinc/10/97/67/174109767.db2.gz JZOHKJGXGZVWBP-RYUDHWBXSA-N 0 3 265.353 2.621 20 10 CFCDHN CCN1CCC([NH2+][C@@H](C)c2cc(C)ccc2[O-])CC1 ZINC000038098074 174111870 /nfs/dbraw/zinc/11/18/70/174111870.db2.gz SMABLVJDEKKOBI-ZDUSSCGKSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCOCCC(C)C)c1 ZINC000071408741 176156828 /nfs/dbraw/zinc/15/68/28/176156828.db2.gz IVUBOAQZWSQHOF-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])cnn1C ZINC000037167843 260072773 /nfs/dbraw/zinc/07/27/73/260072773.db2.gz QACMEJCNNVVLTJ-GHMZBOCLSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c1 ZINC000367472735 267092266 /nfs/dbraw/zinc/09/22/66/267092266.db2.gz UPDRZZUQAQFUGV-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)c1 ZINC000367472735 267092272 /nfs/dbraw/zinc/09/22/72/267092272.db2.gz UPDRZZUQAQFUGV-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2[C@H]3COC[C@H]32)c([O-])c1C ZINC000367696117 267109856 /nfs/dbraw/zinc/10/98/56/267109856.db2.gz DXDSLBDTYTYCOH-CYUUQNCZSA-N 0 3 261.365 2.552 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@](O)(C2CC2)C1 ZINC000368035887 267139459 /nfs/dbraw/zinc/13/94/59/267139459.db2.gz HEOGJLIIEAJLIT-HOCLYGCPSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@](O)(C2CC2)C1 ZINC000368035887 267139460 /nfs/dbraw/zinc/13/94/60/267139460.db2.gz HEOGJLIIEAJLIT-HOCLYGCPSA-N 0 3 261.365 2.690 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCC3(CCC3)CC1)OCO2 ZINC000368511661 267178259 /nfs/dbraw/zinc/17/82/59/267178259.db2.gz LSAJJISYMWADDG-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCOCC[C@@H]2C)c([O-])c1 ZINC000368595073 267189967 /nfs/dbraw/zinc/18/99/67/267189967.db2.gz VWUZKTTVJNWATJ-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCOCC[C@@H]2C)c([O-])c1 ZINC000368595073 267189970 /nfs/dbraw/zinc/18/99/70/267189970.db2.gz VWUZKTTVJNWATJ-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCO[C@@]2(CCOC2)C1)c1cc(F)ccc1[O-] ZINC000369902180 267275289 /nfs/dbraw/zinc/27/52/89/267275289.db2.gz KXURYFUSLXLOOE-RBOXIYTFSA-N 0 3 295.354 2.520 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000369930661 267276937 /nfs/dbraw/zinc/27/69/37/267276937.db2.gz NUXZRSTVBBGRQI-GOEBONIOSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000369930661 267276938 /nfs/dbraw/zinc/27/69/38/267276938.db2.gz NUXZRSTVBBGRQI-GOEBONIOSA-N 0 3 261.365 2.954 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c1[O-] ZINC000378333370 274145579 /nfs/dbraw/zinc/14/55/79/274145579.db2.gz LEUWEWOFCJRTLD-ZDUSSCGKSA-N 0 3 299.374 2.570 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1[O-] ZINC000378333370 274145581 /nfs/dbraw/zinc/14/55/81/274145581.db2.gz LEUWEWOFCJRTLD-ZDUSSCGKSA-N 0 3 299.374 2.570 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c([O-])c1 ZINC000275703353 276019709 /nfs/dbraw/zinc/01/97/09/276019709.db2.gz BVRKSETUNDSWAH-MRXNPFEDSA-N 0 3 293.407 2.774 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c([O-])c1 ZINC000275703353 276019710 /nfs/dbraw/zinc/01/97/10/276019710.db2.gz BVRKSETUNDSWAH-MRXNPFEDSA-N 0 3 293.407 2.774 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@@H](O)C(F)F ZINC000296329414 276591705 /nfs/dbraw/zinc/59/17/05/276591705.db2.gz HEXYBGPQQKPGLR-INNHCVQGSA-N 0 3 277.286 2.587 20 10 CFCDHN C[C@@H](COCC(F)(F)F)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297710075 278291397 /nfs/dbraw/zinc/29/13/97/278291397.db2.gz MRWHBDKGNWFPRM-GXSJLCMTSA-N 0 3 289.297 2.937 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@@H](O)C(F)F ZINC000296654784 288081264 /nfs/dbraw/zinc/08/12/64/288081264.db2.gz ZFPNUXJSJFYLRU-SUZMYJTESA-N 0 3 273.323 2.756 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297498037 279215225 /nfs/dbraw/zinc/21/52/25/279215225.db2.gz BUEMRYRIVRXXSL-HZMBPMFUSA-N 0 3 271.364 2.772 20 10 CFCDHN CC(C)[N@H+](C)CCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442977 279354681 /nfs/dbraw/zinc/35/46/81/279354681.db2.gz ZEKCQHMSPFEQOA-LBPRGKRZSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)[N@@H+](C)CCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442977 279354684 /nfs/dbraw/zinc/35/46/84/279354684.db2.gz ZEKCQHMSPFEQOA-LBPRGKRZSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)N(C)CCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442977 279354685 /nfs/dbraw/zinc/35/46/85/279354685.db2.gz ZEKCQHMSPFEQOA-LBPRGKRZSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)N(C)CCC[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000230658161 279354950 /nfs/dbraw/zinc/35/49/50/279354950.db2.gz VQAMWYDGUMOSBK-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CC(C)[N@H+](C)CCCN[C@H](C)c1ccc(F)cc1[O-] ZINC000230658161 279354954 /nfs/dbraw/zinc/35/49/54/279354954.db2.gz VQAMWYDGUMOSBK-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CC(C)[N@@H+](C)CCCN[C@H](C)c1ccc(F)cc1[O-] ZINC000230658161 279354955 /nfs/dbraw/zinc/35/49/55/279354955.db2.gz VQAMWYDGUMOSBK-GFCCVEGCSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOC[C@H]1C1CC1 ZINC000377619034 288167357 /nfs/dbraw/zinc/16/73/57/288167357.db2.gz DFASUKQXYLZQSE-CABCVRRESA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOC[C@H]1C1CC1 ZINC000377619034 288167365 /nfs/dbraw/zinc/16/73/65/288167365.db2.gz DFASUKQXYLZQSE-CABCVRRESA-N 0 3 261.365 2.954 20 10 CFCDHN Cc1cccc(CN2CCC[C@H]2[C@@H](O)C(F)(F)F)c1O ZINC000271751031 281216149 /nfs/dbraw/zinc/21/61/49/281216149.db2.gz VIGGXKVFJCYMGW-WCQYABFASA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)c1[O-] ZINC000271751031 281216150 /nfs/dbraw/zinc/21/61/50/281216150.db2.gz VIGGXKVFJCYMGW-WCQYABFASA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)c1[O-] ZINC000271751031 281216151 /nfs/dbraw/zinc/21/61/51/281216151.db2.gz VIGGXKVFJCYMGW-WCQYABFASA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCSC3(CCOCC3)C2)c1[O-] ZINC000186503594 281217219 /nfs/dbraw/zinc/21/72/19/281217219.db2.gz VIAVXSQVYWWKFX-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN Cc1cccc(C[N@H+]2CCSC3(CCOCC3)C2)c1[O-] ZINC000186503594 281217222 /nfs/dbraw/zinc/21/72/22/281217222.db2.gz VIAVXSQVYWWKFX-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)C2CCCC2)c1 ZINC000290215956 295168466 /nfs/dbraw/zinc/16/84/66/295168466.db2.gz QKESNVDWRNAIAN-XHDPSFHLSA-N 0 3 279.380 2.603 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCC(C3CC3)CC1)OCO2 ZINC000368169331 328936617 /nfs/dbraw/zinc/93/66/17/328936617.db2.gz XRQBWMNDDRDBRF-UHFFFAOYSA-N 0 3 275.348 2.743 20 10 CFCDHN COc1ccc(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])cn1 ZINC000527990307 330299110 /nfs/dbraw/zinc/29/91/10/330299110.db2.gz MIOMSYQTYWTFOR-LLVKDONJSA-N 0 3 290.338 2.828 20 10 CFCDHN CC(=O)NC1CCC([NH2+]Cc2cc(C)c(C)cc2[O-])CC1 ZINC000266234548 519645355 /nfs/dbraw/zinc/64/53/55/519645355.db2.gz VFEONIIUVZHOFA-UHFFFAOYSA-N 0 3 290.407 2.546 20 10 CFCDHN CC(C)OCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000070976431 519765394 /nfs/dbraw/zinc/76/53/94/519765394.db2.gz XEQFNEKFLQODEF-INIZCTEOSA-N 0 3 293.407 2.798 20 10 CFCDHN CC(C)OCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000070976431 519765396 /nfs/dbraw/zinc/76/53/96/519765396.db2.gz XEQFNEKFLQODEF-INIZCTEOSA-N 0 3 293.407 2.798 20 10 CFCDHN CC(C)OCCN[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000181256401 519768317 /nfs/dbraw/zinc/76/83/17/519768317.db2.gz PDRJXJZPCYTYIV-OAHLLOKOSA-N 0 3 292.423 2.599 20 10 CFCDHN CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)N1CCCCC1 ZINC000062461307 519789498 /nfs/dbraw/zinc/78/94/98/519789498.db2.gz DWGXCLCREBSEHT-HNNXBMFYSA-N 0 3 275.396 2.718 20 10 CFCDHN CCOCCNCc1ccc(N(C)C)cc1C(F)(F)F ZINC000280381282 519966305 /nfs/dbraw/zinc/96/63/05/519966305.db2.gz UHQAYPQGWUNDKB-UHFFFAOYSA-N 0 3 290.329 2.898 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCC2([S@@](C)=O)CC2)cc1 ZINC000282277246 520287922 /nfs/dbraw/zinc/28/79/22/520287922.db2.gz KVZPXQAWRRRCGK-RNODOKPDSA-N 0 3 294.464 2.704 20 10 CFCDHN CCC[C@@H](C)C(=O)NCCNCc1ccc(OC)c(C)c1 ZINC000292830996 520607734 /nfs/dbraw/zinc/60/77/34/520607734.db2.gz XSTPBFJAZKFEIS-CYBMUJFWSA-N 0 3 292.423 2.646 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)Cn2cccn2)cc1 ZINC000035259084 520909897 /nfs/dbraw/zinc/90/98/97/520909897.db2.gz LLZJCBXPHCZVBZ-OAHLLOKOSA-N 0 3 286.423 2.908 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(C)(OC)CC2)c1 ZINC000272384674 521142654 /nfs/dbraw/zinc/14/26/54/521142654.db2.gz SLZMPHGFKOMOCE-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(O)(CC)CC2)c1 ZINC000271208933 521142893 /nfs/dbraw/zinc/14/28/93/521142893.db2.gz TUTULQODMMLZNM-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2CCOC(C)(C)C2)c1 ZINC000160515679 521155597 /nfs/dbraw/zinc/15/55/97/521155597.db2.gz HQJQRMNCORHHPN-ZDUSSCGKSA-N 0 3 279.380 2.838 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000280565633 521338694 /nfs/dbraw/zinc/33/86/94/521338694.db2.gz VHUYUEGTOIHTKW-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000280565633 521338702 /nfs/dbraw/zinc/33/87/02/521338702.db2.gz VHUYUEGTOIHTKW-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000285358950 521340730 /nfs/dbraw/zinc/34/07/30/521340730.db2.gz YWCUFEMGKWTBMQ-LSDHHAIUSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000285358950 521340736 /nfs/dbraw/zinc/34/07/36/521340736.db2.gz YWCUFEMGKWTBMQ-LSDHHAIUSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(O)CCCCCC2)c1[O-] ZINC000079619409 521362950 /nfs/dbraw/zinc/36/29/50/521362950.db2.gz QGOKLSMIIRGFRK-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2nccs2)c1[O-] ZINC000060942190 521363922 /nfs/dbraw/zinc/36/39/22/521363922.db2.gz SJSUHCWEGSDERF-UHFFFAOYSA-N 0 3 278.377 2.580 20 10 CFCDHN CCOc1cccc(CNCc2ccc(C)nc2)c1O ZINC000060942087 521369415 /nfs/dbraw/zinc/36/94/15/521369415.db2.gz FEKJOWTZOXJAIQ-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H]2CCOC(C)(C)C2)c1[O-] ZINC000160466739 521376820 /nfs/dbraw/zinc/37/68/20/521376820.db2.gz TYGMVNDOCDEYJO-ZDUSSCGKSA-N 0 3 279.380 2.838 20 10 CFCDHN CCCN(CCC)c1ccc(CN[C@@H](C)C(=O)NC)cc1 ZINC000291674938 521650608 /nfs/dbraw/zinc/65/06/08/521650608.db2.gz HADZQQQHVCZVRD-AWEZNQCLSA-N 0 3 291.439 2.537 20 10 CFCDHN CCOCC(C)(C)[NH2+]Cc1cccc(OCC)c1[O-] ZINC000292877545 521670910 /nfs/dbraw/zinc/67/09/10/521670910.db2.gz DTHOQJMNVAHRAX-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN COC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCCO1 ZINC000279339361 522361511 /nfs/dbraw/zinc/36/15/11/522361511.db2.gz DXHWQJDSZARCQM-KGLIPLIRSA-N 0 3 299.798 2.638 20 10 CFCDHN COc1cc(CN[C@H](C)c2cc(C)ccc2O)ccn1 ZINC000062058000 522485435 /nfs/dbraw/zinc/48/54/35/522485435.db2.gz UQGQIDWTWJMLDL-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(C[NH2+][C@H](C)c2cc(C)ccc2[O-])ccn1 ZINC000062058000 522485444 /nfs/dbraw/zinc/48/54/44/522485444.db2.gz UQGQIDWTWJMLDL-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2nccs2)c1[O-] ZINC000228672824 522539929 /nfs/dbraw/zinc/53/99/29/522539929.db2.gz WXMQXHFUCSKHBE-UHFFFAOYSA-N 0 3 298.795 2.843 20 10 CFCDHN CC[C@H]([NH2+]CCS(=O)(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000290264494 522597499 /nfs/dbraw/zinc/59/74/99/522597499.db2.gz KZCDGHUKJAAFJD-AWEZNQCLSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)c1ccccc1[O-] ZINC000085976807 522617158 /nfs/dbraw/zinc/61/71/58/522617158.db2.gz DSVIBOAPIOQPGF-QEJZJMRPSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@H](CO)SC)c1ccc(C)cc1[O-] ZINC000280205995 522695652 /nfs/dbraw/zinc/69/56/52/522695652.db2.gz TVYNXYUDDBYSMP-WHOFXGATSA-N 0 3 283.437 2.854 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CC[S@](C)=O)c1ccc(C)cc1[O-] ZINC000280134085 522732987 /nfs/dbraw/zinc/73/29/87/522732987.db2.gz PDGLRMXBUBLSEQ-UHYGZKCKSA-N 0 3 283.437 2.898 20 10 CFCDHN COC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCCO1 ZINC000279339359 522747883 /nfs/dbraw/zinc/74/78/83/522747883.db2.gz DXHWQJDSZARCQM-KBPBESRZSA-N 0 3 299.798 2.638 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1[O-])[C@H]1CCCO1 ZINC000278832461 522765685 /nfs/dbraw/zinc/76/56/85/522765685.db2.gz OZYRPUQIZVHFAB-VNQPRFMTSA-N 0 3 293.407 2.854 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCC(C)(C)C2)cc1OC ZINC000160313879 522773933 /nfs/dbraw/zinc/77/39/33/522773933.db2.gz TVRLLJWWEISXGD-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCC(C)(C)C2)cc1OC ZINC000160313879 522773940 /nfs/dbraw/zinc/77/39/40/522773940.db2.gz TVRLLJWWEISXGD-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1cc(O)c(CN2CCSC(C)(C)C2)cc1OC ZINC000160375944 522778690 /nfs/dbraw/zinc/77/86/90/522778690.db2.gz BOTBOZWLPBMCEQ-UHFFFAOYSA-N 0 3 297.420 2.737 20 10 CFCDHN COCC(C)(C)CCC[NH2+]Cc1ccccc1[O-] ZINC000290130193 522806647 /nfs/dbraw/zinc/80/66/47/522806647.db2.gz MTOYRCQHOMMBEK-UHFFFAOYSA-N 0 3 251.370 2.935 20 10 CFCDHN COCC(C)(C)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000291745104 522810101 /nfs/dbraw/zinc/81/01/01/522810101.db2.gz PJZMNJXWRQVQBA-UHFFFAOYSA-N 0 3 251.370 2.771 20 10 CFCDHN CC[C@@H]([NH2+]CCS(=O)(=O)C(C)(C)C)c1ccccc1[O-] ZINC000156558189 522839247 /nfs/dbraw/zinc/83/92/47/522839247.db2.gz VCLMWYBBMKLTLL-CYBMUJFWSA-N 0 3 299.436 2.646 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)N(C)C)c1ccc(C)cc1[O-] ZINC000280282293 522847982 /nfs/dbraw/zinc/84/79/82/522847982.db2.gz YQDGHXXAJZLJMS-TZMCWYRMSA-N 0 3 250.386 2.691 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)c(C)cc1[O-])[C@@H](O)C(F)F ZINC000295050099 522870455 /nfs/dbraw/zinc/87/04/55/522870455.db2.gz NKUVONNCBWHYSS-DGCLKSJQSA-N 0 3 273.323 2.503 20 10 CFCDHN COCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2[O-])CCC1 ZINC000282665098 522903841 /nfs/dbraw/zinc/90/38/41/522903841.db2.gz IUVCVSQMPWICIE-LBPRGKRZSA-N 0 3 279.380 2.868 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1cccc(C)c1[O-] ZINC000230943355 522984673 /nfs/dbraw/zinc/98/46/73/522984673.db2.gz ONUHIAWTOMIEEH-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN COCc1ccccc1CNCc1cccc(OC)c1O ZINC000037762664 523103716 /nfs/dbraw/zinc/10/37/16/523103716.db2.gz YIUAFLVEBVPQIM-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COCc1ccccc1C[NH2+]Cc1cccc(OC)c1[O-] ZINC000037762664 523103728 /nfs/dbraw/zinc/10/37/28/523103728.db2.gz YIUAFLVEBVPQIM-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN CO[C@H](C)[C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000290932122 523889855 /nfs/dbraw/zinc/88/98/55/523889855.db2.gz PBUHAFCGSMMTEM-NXEZZACHSA-N 0 3 257.761 2.867 20 10 CFCDHN COc1ccc(CNCc2ccc(NC(C)=O)nc2)cc1C ZINC000278752686 524072957 /nfs/dbraw/zinc/07/29/57/524072957.db2.gz WLOVYXTWCBSMLM-UHFFFAOYSA-N 0 3 299.374 2.647 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)CCCO)c([O-])c1 ZINC000284311440 524331630 /nfs/dbraw/zinc/33/16/30/524331630.db2.gz ZHKFDOLPAFKQKE-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cccc(CCC[NH2+]Cc2cc(F)ccc2[O-])n1 ZINC000289564060 524353383 /nfs/dbraw/zinc/35/33/83/524353383.db2.gz SAQQSYGTTKBHDX-UHFFFAOYSA-N 0 3 274.339 2.957 20 10 CFCDHN Cc1cccc(CN2CC[C@H](n3cc(Cl)cn3)C2)c1O ZINC000290974061 524406875 /nfs/dbraw/zinc/40/68/75/524406875.db2.gz SRSJGOHTLCCRID-AWEZNQCLSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@@H](O)c2ccccc2)c1[O-] ZINC000289439138 524434011 /nfs/dbraw/zinc/43/40/11/524434011.db2.gz LRRPTGSLUWGIKN-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN C[C@@H](CNC(=O)OC(C)(C)C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000235156469 524694145 /nfs/dbraw/zinc/69/41/45/524694145.db2.gz CZRNQCIRIVMUNE-JTQLQIEISA-N 0 3 298.358 2.534 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@](C)(O)C2CCCCC2)c1 ZINC000191654032 524752486 /nfs/dbraw/zinc/75/24/86/524752486.db2.gz ZRMNDHXTBPBJNR-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2cccc(O)c2)c1 ZINC000037150617 524755136 /nfs/dbraw/zinc/75/51/36/524755136.db2.gz YAEZIIRRUNYRAL-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(N(C)C)CCC2)c1 ZINC000097927843 524759388 /nfs/dbraw/zinc/75/93/88/524759388.db2.gz OCXHIXFCTLYRFC-GFCCVEGCSA-N 0 3 278.396 2.536 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)CCCO)c1 ZINC000230666398 524760537 /nfs/dbraw/zinc/76/05/37/524760537.db2.gz PQOAIIGGWOJRNY-GFCCVEGCSA-N 0 3 281.396 2.850 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@@H](OC)CC2)c1 ZINC000364986505 524761124 /nfs/dbraw/zinc/76/11/24/524761124.db2.gz SVZVQMSLIXEZLI-CHWSQXEVSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@@H](OC)CC2)c1 ZINC000364986505 524761133 /nfs/dbraw/zinc/76/11/33/524761133.db2.gz SVZVQMSLIXEZLI-CHWSQXEVSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)C2CCCC2)c1 ZINC000290215952 524765948 /nfs/dbraw/zinc/76/59/48/524765948.db2.gz QKESNVDWRNAIAN-ABAIWWIYSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@H](OC)CC2)c1 ZINC000364986511 524768291 /nfs/dbraw/zinc/76/82/91/524768291.db2.gz SVZVQMSLIXEZLI-STQMWFEESA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@H](OC)CC2)c1 ZINC000364986511 524768300 /nfs/dbraw/zinc/76/83/00/524768300.db2.gz SVZVQMSLIXEZLI-STQMWFEESA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC(C)CC2)c1 ZINC000040771296 524769062 /nfs/dbraw/zinc/76/90/62/524769062.db2.gz AKDYNMOJFXMLSK-AWEZNQCLSA-N 0 3 292.423 2.783 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@H]3OCC[C@H]3C2)c1 ZINC000368034199 524770273 /nfs/dbraw/zinc/77/02/73/524770273.db2.gz AEURRZQBKNAAMC-MQIPJXDCSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@H]3OCC[C@H]3C2)c1 ZINC000368034199 524770283 /nfs/dbraw/zinc/77/02/83/524770283.db2.gz AEURRZQBKNAAMC-MQIPJXDCSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)C2CCCC2)c1 ZINC000290215955 524773788 /nfs/dbraw/zinc/77/37/88/524773788.db2.gz QKESNVDWRNAIAN-NHYWBVRUSA-N 0 3 279.380 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCOCC[C@H]2C)c1[O-] ZINC000367706614 524865136 /nfs/dbraw/zinc/86/51/36/524865136.db2.gz NVRGGUDFGDFWQJ-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCOCC[C@H]2C)c1[O-] ZINC000367706614 524865150 /nfs/dbraw/zinc/86/51/50/524865150.db2.gz NVRGGUDFGDFWQJ-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H]2CO)c1[O-] ZINC000191175156 524867299 /nfs/dbraw/zinc/86/72/99/524867299.db2.gz KFNSJBMWEVFUHO-ZANVPECISA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H]2CO)c1[O-] ZINC000191175156 524867305 /nfs/dbraw/zinc/86/73/05/524867305.db2.gz KFNSJBMWEVFUHO-ZANVPECISA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@@H]3CCC[C@H]32)cc1C ZINC000299133653 525318263 /nfs/dbraw/zinc/31/82/63/525318263.db2.gz FMXOGUNQSOYNAC-GDBMZVCRSA-N 0 3 261.365 2.762 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCS[C@H](C)C2)cc1C ZINC000171606496 525320291 /nfs/dbraw/zinc/32/02/91/525320291.db2.gz LKDNNQKJUCZLKS-GFCCVEGCSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCS[C@H](C)C2)cc1C ZINC000171606496 525320283 /nfs/dbraw/zinc/32/02/83/525320283.db2.gz LKDNNQKJUCZLKS-GFCCVEGCSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@](C)(O)c2ccco2)cc1C ZINC000266179604 525323806 /nfs/dbraw/zinc/32/38/06/525323806.db2.gz UYPUWQFOQCYGSA-MRXNPFEDSA-N 0 3 275.348 2.599 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094616945 525342790 /nfs/dbraw/zinc/34/27/90/525342790.db2.gz LBNZOBSQWWKTBX-JSGCOSHPSA-N 0 3 297.370 2.768 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]Cc2ccnc(N3CCCC3)c2)c1 ZINC000264936401 525353317 /nfs/dbraw/zinc/35/33/17/525353317.db2.gz DCHHGOKIKSVNCY-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnc(N3CCCC3)c2)c1 ZINC000264936401 525353328 /nfs/dbraw/zinc/35/33/28/525353328.db2.gz DCHHGOKIKSVNCY-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)Cc2ccccc2)c1 ZINC000185370095 525362048 /nfs/dbraw/zinc/36/20/48/525362048.db2.gz RBRMZEQMOGPYJU-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)Cc2ccccc2)c1 ZINC000063218540 525365085 /nfs/dbraw/zinc/36/50/85/525365085.db2.gz PMVGSAKCFOAVMA-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(O)c([C@H](C)N[C@H](C)c2cnn(C)c2)c1 ZINC000273554470 525365190 /nfs/dbraw/zinc/36/51/90/525365190.db2.gz GOPLWFDJIBJUIP-NEPJUHHUSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)c2cnn(C)c2)c1 ZINC000273554470 525365201 /nfs/dbraw/zinc/36/52/01/525365201.db2.gz GOPLWFDJIBJUIP-NEPJUHHUSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CCN(C)C)c1 ZINC000049553877 525365408 /nfs/dbraw/zinc/36/54/08/525365408.db2.gz GKQBPAZUCDEVNY-OLZOCXBDSA-N 0 3 250.386 2.691 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)Cn2cccn2)c1 ZINC000037155948 525365503 /nfs/dbraw/zinc/36/55/03/525365503.db2.gz LKRNKIGNYOBQKM-STQMWFEESA-N 0 3 259.353 2.636 20 10 CFCDHN C[S@@](=O)C[C@@H](NCc1ccccc1O)c1ccccc1 ZINC000154687051 525366982 /nfs/dbraw/zinc/36/69/82/525366982.db2.gz IUEKJIBRRFXKOZ-QRWLVFNGSA-N 0 3 289.400 2.602 20 10 CFCDHN C[C@H]([NH2+]CCc1ccccn1)c1cc(F)ccc1[O-] ZINC000094616673 525368328 /nfs/dbraw/zinc/36/83/28/525368328.db2.gz NYRNWXGFNLOCHY-NSHDSACASA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(c2cccnn2)CC1)c1ccccc1[O-] ZINC000277163013 525403949 /nfs/dbraw/zinc/40/39/49/525403949.db2.gz RHBINYOWAOKMCF-CYBMUJFWSA-N 0 3 298.390 2.502 20 10 CFCDHN C[C@@H]([NH2+]CC1(CCO)CCCC1)c1ccccc1[O-] ZINC000272869904 525422775 /nfs/dbraw/zinc/42/27/75/525422775.db2.gz OLEMZSYWKMZFIV-CYBMUJFWSA-N 0 3 263.381 2.986 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCSC1)c1cc(F)ccc1[O-] ZINC000228558997 525504295 /nfs/dbraw/zinc/50/42/95/525504295.db2.gz JWGFHJQAEMKWFG-NXEZZACHSA-N 0 3 255.358 2.935 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CSCCS1)c1ccccc1[O-] ZINC000167457709 525505598 /nfs/dbraw/zinc/50/55/98/525505598.db2.gz PUFRWWPVOCNFKL-MNOVXSKESA-N 0 3 269.435 2.891 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000094618181 525541327 /nfs/dbraw/zinc/54/13/27/525541327.db2.gz DFEPYPNVFOZGIB-SWLSCSKDSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)CC1CCC1)c1cc(F)ccc1[O-] ZINC000279894013 525595636 /nfs/dbraw/zinc/59/56/36/525595636.db2.gz ADNHEENOQVJGCU-GWCFXTLKSA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cc(F)ccc1[O-] ZINC000094617423 525611856 /nfs/dbraw/zinc/61/18/56/525611856.db2.gz QGRPQTYOCRZIAZ-HZMBPMFUSA-N 0 3 289.354 2.993 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)Cc2ccccc2)c([O-])c1 ZINC000063218407 525749579 /nfs/dbraw/zinc/74/95/79/525749579.db2.gz VUQWOCGAGKVCKK-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1c([C@H](C)NCc2cc(C)ccc2O)cnn1C ZINC000071407978 525919655 /nfs/dbraw/zinc/91/96/55/525919655.db2.gz RBAQJFCWPKEPHO-NSHDSACASA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC[C@H]2CCCO2)c([O-])c1 ZINC000020146917 525920083 /nfs/dbraw/zinc/92/00/83/525920083.db2.gz SGXHEXYEMCGHHS-LSDHHAIUSA-N 0 3 293.407 2.937 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H](C)c2nccs2)c1[O-] ZINC000230694787 526020893 /nfs/dbraw/zinc/02/08/93/526020893.db2.gz UQZAGQIPIAWJIU-SNVBAGLBSA-N 0 3 278.377 2.751 20 10 CFCDHN COc1cccc(CNCc2cnn(CC(C)C)c2)c1O ZINC000289521552 526025930 /nfs/dbraw/zinc/02/59/30/526025930.db2.gz VJALCRKGUIXKJC-UHFFFAOYSA-N 0 3 289.379 2.543 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@@H]1CCCCO1 ZINC000227522017 526348092 /nfs/dbraw/zinc/34/80/92/526348092.db2.gz RLKCPSUIXDJECO-ZDUSSCGKSA-N 0 3 253.317 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000292881603 526348526 /nfs/dbraw/zinc/34/85/26/526348526.db2.gz XSMBXLCHWZYWEF-CQSZACIVSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000292881603 526348530 /nfs/dbraw/zinc/34/85/30/526348530.db2.gz XSMBXLCHWZYWEF-CQSZACIVSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC1CCSCC1 ZINC000226608139 526350090 /nfs/dbraw/zinc/35/00/90/526350090.db2.gz FKMSOSIKGHFLID-UHFFFAOYSA-N 0 3 255.358 2.764 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@H](C(F)(F)F)C1 ZINC000287768525 526373513 /nfs/dbraw/zinc/37/35/13/526373513.db2.gz RJOGJBBMGPWDAF-PWSUYJOCSA-N 0 3 275.270 2.592 20 10 CFCDHN Oc1ccccc1CNCc1ccc2c(n1)CCCC2 ZINC000277711158 526374263 /nfs/dbraw/zinc/37/42/63/526374263.db2.gz MOIYCDNCFVZFLN-UHFFFAOYSA-N 0 3 268.360 2.956 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000293019285 527579263 /nfs/dbraw/zinc/57/92/63/527579263.db2.gz OQZWVIIOPURZHQ-OAHLLOKOSA-N 0 3 263.381 2.671 20 10 CFCDHN Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000361928960 527700817 /nfs/dbraw/zinc/70/08/17/527700817.db2.gz YLCKWHXWVLMRFH-OAHLLOKOSA-N 0 3 289.354 2.910 20 10 CFCDHN Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000361928960 527700818 /nfs/dbraw/zinc/70/08/18/527700818.db2.gz YLCKWHXWVLMRFH-OAHLLOKOSA-N 0 3 289.354 2.910 20 10 CFCDHN CCOc1ccc(C[NH2+]CCCc2nccs2)c([O-])c1 ZINC000736641961 574063738 /nfs/dbraw/zinc/06/37/38/574063738.db2.gz PDJDMMINQIRUAG-UHFFFAOYSA-N 0 3 292.404 2.970 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1C[C@](C)(OC)C1(C)C ZINC000744448322 574075162 /nfs/dbraw/zinc/07/51/62/574075162.db2.gz IDTHPPKXQSJPBO-ZBFHGGJFSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1C[C@@](C)(OC)C1(C)C ZINC000744448319 574075258 /nfs/dbraw/zinc/07/52/58/574075258.db2.gz IDTHPPKXQSJPBO-GDBMZVCRSA-N 0 3 279.380 2.694 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000756356077 574097203 /nfs/dbraw/zinc/09/72/03/574097203.db2.gz ZZODYIJGOLAOBZ-SCVCMEIPSA-N 0 3 265.328 2.848 20 10 CFCDHN CN(C)C(=O)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731846142 574130166 /nfs/dbraw/zinc/13/01/66/574130166.db2.gz UTLOKUKFUMTRMQ-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN CN(C)C(=O)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731846142 574130169 /nfs/dbraw/zinc/13/01/69/574130169.db2.gz UTLOKUKFUMTRMQ-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN CC[N@@H+](Cc1cc(C)c(C)cc1[O-])C[C@H]1CCOC1 ZINC000738076744 574157380 /nfs/dbraw/zinc/15/73/80/574157380.db2.gz OKDQURMWHCMNJT-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN CC[N@H+](Cc1cc(C)c(C)cc1[O-])C[C@H]1CCOC1 ZINC000738076744 574157384 /nfs/dbraw/zinc/15/73/84/574157384.db2.gz OKDQURMWHCMNJT-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN CC[C@@H](C)CN1CCN(c2ccc(OC)cc2)CC1 ZINC000755881241 574193879 /nfs/dbraw/zinc/19/38/79/574193879.db2.gz SLNSHDPIKVZRDB-CQSZACIVSA-N 0 3 262.397 2.863 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCS[C@@H](C)CC1 ZINC000756147237 574214053 /nfs/dbraw/zinc/21/40/53/574214053.db2.gz PEPDXSUNZLSZBF-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCS[C@@H](C)CC1 ZINC000756147237 574214056 /nfs/dbraw/zinc/21/40/56/574214056.db2.gz PEPDXSUNZLSZBF-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756397259 574233560 /nfs/dbraw/zinc/23/35/60/574233560.db2.gz QDTNULQWLVAZMV-AAEUAGOBSA-N 0 3 289.354 2.956 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417171 574235624 /nfs/dbraw/zinc/23/56/24/574235624.db2.gz KLKYBXRXXFHMAY-DRZSPHRISA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417171 574235625 /nfs/dbraw/zinc/23/56/25/574235625.db2.gz KLKYBXRXXFHMAY-DRZSPHRISA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCC[C@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417171 574235626 /nfs/dbraw/zinc/23/56/26/574235626.db2.gz KLKYBXRXXFHMAY-DRZSPHRISA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c([O-])c1C ZINC000756433010 574236636 /nfs/dbraw/zinc/23/66/36/574236636.db2.gz MGDMNHPEGZSISU-CZUORRHYSA-N 0 3 276.424 3.000 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000756449968 574237953 /nfs/dbraw/zinc/23/79/53/574237953.db2.gz PTFPWSDRPATPER-YNEQXMIYSA-N 0 3 293.260 2.592 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756449795 574237970 /nfs/dbraw/zinc/23/79/70/574237970.db2.gz NSZCFAJKZJRUJU-SKDRFNHKSA-N 0 3 275.327 2.603 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccccc2CO)c1 ZINC000756459588 574238696 /nfs/dbraw/zinc/23/86/96/574238696.db2.gz PQSJSQMKIZXECB-LBPRGKRZSA-N 0 3 287.359 2.744 20 10 CFCDHN C[C@H](Cc1cnccn1)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756493492 574241024 /nfs/dbraw/zinc/24/10/24/574241024.db2.gz GCTSSUVQRASSMQ-GHMZBOCLSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)Cc1cnccn1)c1cc(F)ccc1[O-] ZINC000756493495 574241333 /nfs/dbraw/zinc/24/13/33/574241333.db2.gz GCTSSUVQRASSMQ-WDEREUQCSA-N 0 3 275.327 2.603 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756508304 574242516 /nfs/dbraw/zinc/24/25/16/574242516.db2.gz HNJJJAVSPHUYAU-ZWNOBZJWSA-N 0 3 289.354 2.874 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1cc(OC)ccc1[O-])C(C)C ZINC000756525524 574243721 /nfs/dbraw/zinc/24/37/21/574243721.db2.gz PTWREZHORUEXDD-CYBMUJFWSA-N 0 3 280.412 2.782 20 10 CFCDHN C[C@@H](C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)N(C)C ZINC000756537016 574244357 /nfs/dbraw/zinc/24/43/57/574244357.db2.gz YVJBJGMCSSAHIN-SCVCMEIPSA-N 0 3 266.360 2.619 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1cc(F)ccc1[O-] ZINC000756550455 574246525 /nfs/dbraw/zinc/24/65/25/574246525.db2.gz HTBDQFBKVUJAKA-RISCZKNCSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cc(F)ccc1[O-] ZINC000756550457 574246628 /nfs/dbraw/zinc/24/66/28/574246628.db2.gz HTBDQFBKVUJAKA-SMDDNHRTSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000756565193 574248030 /nfs/dbraw/zinc/24/80/30/574248030.db2.gz WJXWMSZMJWMWSJ-ONGXEEELSA-N 0 3 265.328 2.584 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000756565190 574248169 /nfs/dbraw/zinc/24/81/69/574248169.db2.gz WJXWMSZMJWMWSJ-GXSJLCMTSA-N 0 3 265.328 2.584 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@H]2CCOC2)c([O-])c1C ZINC000756564173 574248285 /nfs/dbraw/zinc/24/82/85/574248285.db2.gz QYDFKDCCGCRDGI-CABCVRRESA-N 0 3 293.407 2.713 20 10 CFCDHN COC(=O)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733614146 574249829 /nfs/dbraw/zinc/24/98/29/574249829.db2.gz ZRTJDWNFDCCMLL-UHFFFAOYSA-N 0 3 277.364 2.700 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733614146 574249831 /nfs/dbraw/zinc/24/98/31/574249831.db2.gz ZRTJDWNFDCCMLL-UHFFFAOYSA-N 0 3 277.364 2.700 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCOC[C@H]2CCCO2)c1 ZINC000756583894 574250695 /nfs/dbraw/zinc/25/06/95/574250695.db2.gz RKRZBFYQRKGNPE-ZIAGYGMSSA-N 0 3 279.380 2.547 20 10 CFCDHN C[C@H](CCO)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756620633 574252822 /nfs/dbraw/zinc/25/28/22/574252822.db2.gz LLFVXSCATWVASQ-CHWSQXEVSA-N 0 3 277.408 2.940 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)[S@@](C)=O)c([O-])c1C ZINC000756762119 574260599 /nfs/dbraw/zinc/26/05/99/574260599.db2.gz OPTSNDDABHUVAV-RGIROJJOSA-N 0 3 283.437 2.817 20 10 CFCDHN COC[C@@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756778828 574262434 /nfs/dbraw/zinc/26/24/34/574262434.db2.gz FYMPKTKJFPFAGR-IQJOONFLSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@@H]([NH2+]CC1=CCN(C)CC1)c1cc(F)cc(F)c1[O-] ZINC000756790753 574263615 /nfs/dbraw/zinc/26/36/15/574263615.db2.gz OZFQBSHOHYBIKO-SNVBAGLBSA-N 0 3 282.334 2.583 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(CCO)CCCCC2)c([O-])c1 ZINC000751152708 574370098 /nfs/dbraw/zinc/37/00/98/574370098.db2.gz NGBOEBZGRZGJKA-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@H](OC)C3)c2c1 ZINC000751945824 574385503 /nfs/dbraw/zinc/38/55/03/574385503.db2.gz PNBUWLUGHXYZEO-AWEZNQCLSA-N 0 3 287.359 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@H](OC)C3)c2c1 ZINC000751945824 574385504 /nfs/dbraw/zinc/38/55/04/574385504.db2.gz PNBUWLUGHXYZEO-AWEZNQCLSA-N 0 3 287.359 2.775 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H](O)CCc1ccccc1 ZINC000753594416 574405705 /nfs/dbraw/zinc/40/57/05/574405705.db2.gz LXWQWMUEAIZLRF-INIZCTEOSA-N 0 3 289.350 2.615 20 10 CFCDHN CC[C@H](C)C[N@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891693626 617714591 /nfs/dbraw/zinc/71/45/91/617714591.db2.gz GNEINCMGZDTWDV-NSHDSACASA-N 0 3 267.369 2.887 20 10 CFCDHN CC[C@H](C)C[N@@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891693626 617714594 /nfs/dbraw/zinc/71/45/94/617714594.db2.gz GNEINCMGZDTWDV-NSHDSACASA-N 0 3 267.369 2.887 20 10 CFCDHN CCCC[C@](C)(CO)[NH2+]Cc1cc(F)ccc1[O-] ZINC000843425696 617880675 /nfs/dbraw/zinc/88/06/75/617880675.db2.gz FHNZUIWEPDWPKO-CQSZACIVSA-N 0 3 255.333 2.562 20 10 CFCDHN Oc1ccccc1CN1CCc2nc[nH]c2C12CCC2 ZINC000895068050 618254168 /nfs/dbraw/zinc/25/41/68/618254168.db2.gz GQWKGUVCZDMPMV-UHFFFAOYSA-N 0 3 269.348 2.553 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2CO)c1[O-] ZINC000895151182 618395688 /nfs/dbraw/zinc/39/56/88/618395688.db2.gz QRYCWOPDHTWBDE-ZDUSSCGKSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCCC[C@H]2CO)c1[O-] ZINC000895151182 618395692 /nfs/dbraw/zinc/39/56/92/618395692.db2.gz QRYCWOPDHTWBDE-ZDUSSCGKSA-N 0 3 299.798 2.791 20 10 CFCDHN Cc1noc2ncc(CNCc3ccc(N(C)C)cc3)cc12 ZINC000894159970 618405403 /nfs/dbraw/zinc/40/54/03/618405403.db2.gz IWLCRIVCJZJYBX-UHFFFAOYSA-N 0 3 296.374 2.887 20 10 CFCDHN C[C@@H]1CCSCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000191809866 618415695 /nfs/dbraw/zinc/41/56/95/618415695.db2.gz GFBGJOXKKJVZKT-SNVBAGLBSA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@@H]1CCSCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000191809866 618415700 /nfs/dbraw/zinc/41/57/00/618415700.db2.gz GFBGJOXKKJVZKT-SNVBAGLBSA-N 0 3 255.358 2.859 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(C(C)(C)O)CC1 ZINC000877752218 618461390 /nfs/dbraw/zinc/46/13/90/618461390.db2.gz QBGOEEOXHLMFPI-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN CCn1cc(CNCc2ccc3c(c2)CCCN3C)c(C)n1 ZINC000892733153 618734746 /nfs/dbraw/zinc/73/47/46/618734746.db2.gz OHVNBXKKGUVEJN-UHFFFAOYSA-N 0 3 298.434 2.884 20 10 CFCDHN C[C@]1(Br)C[C@H]1C[NH2+]Cc1ccccc1[O-] ZINC000892790585 618746527 /nfs/dbraw/zinc/74/65/27/618746527.db2.gz GAJYIAMXAXJLHZ-JQWIXIFHSA-N 0 3 270.170 2.655 20 10 CFCDHN C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+]Cc1ccccc1[O-] ZINC000309915873 618890544 /nfs/dbraw/zinc/89/05/44/618890544.db2.gz UHWLVPCUPLNVLB-NWDGAFQWSA-N 0 3 294.395 2.784 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2c(C)noc2C)c1 ZINC000092326778 618916162 /nfs/dbraw/zinc/91/61/62/618916162.db2.gz HZWRLYAROBURKM-VIFPVBQESA-N 0 3 276.336 2.856 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1Cc3ccccc3O1)CC2 ZINC000314577979 619085210 /nfs/dbraw/zinc/08/52/10/619085210.db2.gz RIHHFIIQKGHENG-HUUCEWRRSA-N 0 3 281.355 2.973 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000840958563 619149849 /nfs/dbraw/zinc/14/98/49/619149849.db2.gz QMUIQPOILWRDMA-CVEARBPZSA-N 0 3 287.334 2.839 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000840958563 619149850 /nfs/dbraw/zinc/14/98/50/619149850.db2.gz QMUIQPOILWRDMA-CVEARBPZSA-N 0 3 287.334 2.839 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc2c(cc1[O-])OCO2)C(C)(C)C ZINC000096610273 619183058 /nfs/dbraw/zinc/18/30/58/619183058.db2.gz MVZTVJOJJMOGJC-JTQLQIEISA-N 0 3 265.353 2.893 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)[C@@H]2C)c1[O-] ZINC000840976496 619204610 /nfs/dbraw/zinc/20/46/10/619204610.db2.gz CKMXLKHFBGKBIJ-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c1[O-] ZINC000840976496 619204613 /nfs/dbraw/zinc/20/46/13/619204613.db2.gz CKMXLKHFBGKBIJ-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)[C@H]2C)c1[O-] ZINC000840976494 619204821 /nfs/dbraw/zinc/20/48/21/619204821.db2.gz CKMXLKHFBGKBIJ-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c1[O-] ZINC000840976494 619204823 /nfs/dbraw/zinc/20/48/23/619204823.db2.gz CKMXLKHFBGKBIJ-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cccc(CNCc2cnc(F)c(C)c2)c1O ZINC000894458081 619390152 /nfs/dbraw/zinc/39/01/52/619390152.db2.gz MSWOQZYKDZYPED-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN COCCOc1ccc(CNCc2cc(C)ccc2O)o1 ZINC000895581740 619563043 /nfs/dbraw/zinc/56/30/43/619563043.db2.gz RXCMQCSRYSPTEO-UHFFFAOYSA-N 0 3 291.347 2.609 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000895791735 619608021 /nfs/dbraw/zinc/60/80/21/619608021.db2.gz UXVXBKIJBGWLOE-CYBMUJFWSA-N 0 3 265.328 2.580 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H]1CC(C)(C)CO1 ZINC000895802800 619611592 /nfs/dbraw/zinc/61/15/92/619611592.db2.gz PZVMFNVRFYACTI-ZDUSSCGKSA-N 0 3 263.381 2.995 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895847805 619621945 /nfs/dbraw/zinc/62/19/45/619621945.db2.gz VUBPYPNSZPTXRS-YOEHRIQHSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895847805 619621947 /nfs/dbraw/zinc/62/19/47/619621947.db2.gz VUBPYPNSZPTXRS-YOEHRIQHSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1nccc(CN[C@@H](C)c2ccccc2O)c1F ZINC000895850558 619622759 /nfs/dbraw/zinc/62/27/59/619622759.db2.gz AKXWKUDTOFRGQU-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN Cn1ccc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000896493289 619748022 /nfs/dbraw/zinc/74/80/22/619748022.db2.gz NOWSPXXAQIICLH-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1ccc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000896493289 619748027 /nfs/dbraw/zinc/74/80/27/619748027.db2.gz NOWSPXXAQIICLH-GFCCVEGCSA-N 0 3 289.354 2.644 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)c1cccc(F)c1 ZINC000896565173 619763634 /nfs/dbraw/zinc/76/36/34/619763634.db2.gz TYXYSDPCVSYCBS-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN CC[N@H+](CCC(N)=O)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000896714835 619796888 /nfs/dbraw/zinc/79/68/88/619796888.db2.gz IRJRHKGDIGFKLF-UHFFFAOYSA-N 0 3 298.386 2.757 20 10 CFCDHN CC[N@@H+](CCC(N)=O)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000896714835 619796889 /nfs/dbraw/zinc/79/68/89/619796889.db2.gz IRJRHKGDIGFKLF-UHFFFAOYSA-N 0 3 298.386 2.757 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H](N(C)C)C(F)(F)F ZINC000896879580 619855540 /nfs/dbraw/zinc/85/55/40/619855540.db2.gz WTSJHXNJZDSWIX-ZDUSSCGKSA-N 0 3 290.329 2.673 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CSC[C@H]2C)c([O-])c1 ZINC000796485758 619888592 /nfs/dbraw/zinc/88/85/92/619888592.db2.gz ZKRPHSLLDQXBER-ZWNOBZJWSA-N 0 3 267.394 2.632 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CC2)[C@@H]2CCCOC2)c([O-])c1 ZINC000897082585 619926517 /nfs/dbraw/zinc/92/65/17/619926517.db2.gz VJEILFZSDZMNNZ-NVXWUHKLSA-N 0 3 275.392 2.995 20 10 CFCDHN COC[C@H](C[NH2+]Cc1ccc(C)cc1[O-])C(C)C ZINC000897220993 619952881 /nfs/dbraw/zinc/95/28/81/619952881.db2.gz FSJLITIFRSIXRR-AWEZNQCLSA-N 0 3 251.370 2.709 20 10 CFCDHN CC1(C[NH2+]Cc2ccccc2[O-])CCC2(CC1)OCCO2 ZINC000897720701 620274946 /nfs/dbraw/zinc/27/49/46/620274946.db2.gz ZQCNHNWSJIODNU-UHFFFAOYSA-N 0 3 291.391 2.805 20 10 CFCDHN CC1(C)CCC[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000898048083 620321111 /nfs/dbraw/zinc/32/11/11/620321111.db2.gz FGRYPEZYTVCNEN-ZDUSSCGKSA-N 0 3 267.344 2.969 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000898050334 620321719 /nfs/dbraw/zinc/32/17/19/620321719.db2.gz SDGNUFLYXQHJLU-GFCCVEGCSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1nc2ccccn2c1CNCc1ccc2c(c1)CCO2 ZINC000898276552 620363400 /nfs/dbraw/zinc/36/34/00/620363400.db2.gz PXXAJDMTPOOSMZ-UHFFFAOYSA-N 0 3 293.370 2.867 20 10 CFCDHN COC(=O)[C@H](C[NH2+]Cc1ccccc1[O-])CC1CCCC1 ZINC000898342728 620373558 /nfs/dbraw/zinc/37/35/58/620373558.db2.gz MVEJIHHXJHVSNC-HNNXBMFYSA-N 0 3 291.391 2.851 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2COC[C@@H]2C2CC2)c1[O-] ZINC000898381288 620379130 /nfs/dbraw/zinc/37/91/30/620379130.db2.gz CSILFMPDKMURLJ-CHWSQXEVSA-N 0 3 297.782 2.569 20 10 CFCDHN CC[C@@](C)(C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000322752786 620390600 /nfs/dbraw/zinc/39/06/00/620390600.db2.gz CLHIXLSVXHARRS-AWEZNQCLSA-N 0 3 287.787 2.959 20 10 CFCDHN CC[C@](C)(C[NH2+][C@H](C)c1cc(F)ccc1[O-])OC ZINC000322839718 620392484 /nfs/dbraw/zinc/39/24/84/620392484.db2.gz FJSMNRIESZWDLX-QMTHXVAHSA-N 0 3 255.333 2.997 20 10 CFCDHN CC[C@@](C)(C[NH2+][C@@H](C)c1cc(F)ccc1[O-])OC ZINC000322839716 620392618 /nfs/dbraw/zinc/39/26/18/620392618.db2.gz FJSMNRIESZWDLX-HZMBPMFUSA-N 0 3 255.333 2.997 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CCN1 ZINC000841062278 620424749 /nfs/dbraw/zinc/42/47/49/620424749.db2.gz VJJYREBVHWKIAG-GZMMTYOYSA-N 0 3 289.206 2.929 20 10 CFCDHN C[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[O-])CC[NH2+]1 ZINC000841062278 620424752 /nfs/dbraw/zinc/42/47/52/620424752.db2.gz VJJYREBVHWKIAG-GZMMTYOYSA-N 0 3 289.206 2.929 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000898422611 620462634 /nfs/dbraw/zinc/46/26/34/620462634.db2.gz KWYGXBSKUJCHNX-ABAIWWIYSA-N 0 3 279.405 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000898422611 620462636 /nfs/dbraw/zinc/46/26/36/620462636.db2.gz KWYGXBSKUJCHNX-ABAIWWIYSA-N 0 3 279.405 2.586 20 10 CFCDHN Cc1ccc(C[NH2+]CCOC2CCSCC2)c([O-])c1 ZINC000898435469 620464300 /nfs/dbraw/zinc/46/43/00/620464300.db2.gz ZOAUDGWCIGDISG-UHFFFAOYSA-N 0 3 281.421 2.702 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000898478256 620469191 /nfs/dbraw/zinc/46/91/91/620469191.db2.gz GGKFLJKXRHSJDX-OCCSQVGLSA-N 0 3 277.364 2.522 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1N)c1cc(F)ccc1[O-] ZINC000902440513 621080537 /nfs/dbraw/zinc/08/05/37/621080537.db2.gz YWHIEJHDCVLDMK-IGGJQXEISA-N 0 3 286.350 2.807 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CC(=O)N(C)C2)c([O-])c1 ZINC000903213676 621289945 /nfs/dbraw/zinc/28/99/45/621289945.db2.gz PJGGEWMPPSMXOE-KBPBESRZSA-N 0 3 290.407 2.528 20 10 CFCDHN C[C@@H]([NH2+]CC1(C2(O)CCC2)CC1)c1cc(F)ccc1[O-] ZINC000903258610 621301854 /nfs/dbraw/zinc/30/18/54/621301854.db2.gz YMVOAEOSUMUBOY-LLVKDONJSA-N 0 3 279.355 2.877 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@H]1CCCC[C@H]1O)CC2 ZINC000903263121 621303929 /nfs/dbraw/zinc/30/39/29/621303929.db2.gz JJBHKGRGZMPQTF-BPLDGKMQSA-N 0 3 275.392 2.910 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnn(CCF)c1)c1cc(F)ccc1[O-] ZINC000903273731 621309368 /nfs/dbraw/zinc/30/93/68/621309368.db2.gz CPSHTWYSFFGIEW-SNVBAGLBSA-N 0 3 281.306 2.548 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c2c1c(F)ccc2[O-] ZINC000903286227 621317995 /nfs/dbraw/zinc/31/79/95/621317995.db2.gz DUQDQFKLMHLKTC-NQKGJSAZSA-N 0 3 289.350 2.845 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCN2C)c1[O-] ZINC000903318626 621332020 /nfs/dbraw/zinc/33/20/20/621332020.db2.gz ROIOHKQOOGTAGG-JQWIXIFHSA-N 0 3 268.788 2.709 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(CCO)cc1)c1cc(F)ccc1[O-] ZINC000903402258 621369024 /nfs/dbraw/zinc/36/90/24/621369024.db2.gz AJCDSAZLAFCZHV-LBPRGKRZSA-N 0 3 289.350 2.917 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000903451689 621386680 /nfs/dbraw/zinc/38/66/80/621386680.db2.gz WPFOCYFXIFYXBU-XBFCOCLRSA-N 0 3 289.375 2.701 20 10 CFCDHN CC[C@](O)(CNCc1ccc(N(C)C)cc1)C(F)(F)F ZINC000905028983 621689004 /nfs/dbraw/zinc/68/90/04/621689004.db2.gz VNKVBKSZRNIYHN-ZDUSSCGKSA-N 0 3 290.329 2.546 20 10 CFCDHN COc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000183605770 625521153 /nfs/dbraw/zinc/52/11/53/625521153.db2.gz SVGCMZKIUKBALP-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCC[C@H](O)C1)c1ccccc1[O-] ZINC000155999202 622614929 /nfs/dbraw/zinc/61/49/29/622614929.db2.gz BEOXBAKEHHIWOL-YDHLFZDLSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000044685417 622940347 /nfs/dbraw/zinc/94/03/47/622940347.db2.gz RPKRBMKUHODIJN-OLZOCXBDSA-N 0 3 260.381 2.588 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(CCO)CCC1)CC2 ZINC000834685453 625782832 /nfs/dbraw/zinc/78/28/32/625782832.db2.gz VNTSYCQIEKKSNG-CYBMUJFWSA-N 0 3 261.365 2.522 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1CCOC1 ZINC000822525791 623120690 /nfs/dbraw/zinc/12/06/90/623120690.db2.gz MMTRNCBHTHBKML-MRXNPFEDSA-N 0 3 299.370 2.850 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@H]2CCCO2)c1[O-] ZINC000228670816 623155928 /nfs/dbraw/zinc/15/59/28/623155928.db2.gz CKFUWLHZJRPVRU-GFCCVEGCSA-N 0 3 285.771 2.713 20 10 CFCDHN CC(C)CNC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000228970016 623171871 /nfs/dbraw/zinc/17/18/71/623171871.db2.gz JFHLVDPOUUKUAY-KGLIPLIRSA-N 0 3 291.439 2.564 20 10 CFCDHN C[C@H]([NH2+]CC[C@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000230672569 623290719 /nfs/dbraw/zinc/29/07/19/623290719.db2.gz CCJXEFSPNBDFJL-QWRGUYRKSA-N 0 3 253.317 2.609 20 10 CFCDHN Fc1cc(CN2CC[C@@H]2C2CC2)ccc1N1CCOCC1 ZINC000824651035 623540155 /nfs/dbraw/zinc/54/01/55/623540155.db2.gz STRCWDHUGWIIIB-MRXNPFEDSA-N 0 3 290.382 2.647 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824714662 623549870 /nfs/dbraw/zinc/54/98/70/623549870.db2.gz DUNMJVKXWUJNKG-SQWLQELKSA-N 0 3 261.365 2.518 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000824714662 623549876 /nfs/dbraw/zinc/54/98/76/623549876.db2.gz DUNMJVKXWUJNKG-SQWLQELKSA-N 0 3 261.365 2.518 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824714418 623550129 /nfs/dbraw/zinc/55/01/29/623550129.db2.gz DUNMJVKXWUJNKG-FMKPAKJESA-N 0 3 261.365 2.518 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824714418 623550133 /nfs/dbraw/zinc/55/01/33/623550133.db2.gz DUNMJVKXWUJNKG-FMKPAKJESA-N 0 3 261.365 2.518 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ncccc2C)c([O-])c1 ZINC000824794277 623566224 /nfs/dbraw/zinc/56/62/24/623566224.db2.gz COVQWVOSVHDGIJ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN C[C@H](NC(=O)C(C)(C)N1CCCCC1)c1ccccc1O ZINC000913763871 623581001 /nfs/dbraw/zinc/58/10/01/623581001.db2.gz UFLUULZVEUVYEP-ZDUSSCGKSA-N 0 3 290.407 2.834 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C13CCC(CC1)CC3)OCO2 ZINC000824935202 623591580 /nfs/dbraw/zinc/59/15/80/623591580.db2.gz CYNPXDNMCKXKAK-UHFFFAOYSA-N 0 3 275.348 2.933 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000184940825 625663680 /nfs/dbraw/zinc/66/36/80/625663680.db2.gz VYTDCRSHJRRNCH-GFCCVEGCSA-N 0 3 287.407 2.944 20 10 CFCDHN CO[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104066 623630924 /nfs/dbraw/zinc/63/09/24/623630924.db2.gz LYXMHSSYMXRVOF-CABCVRRESA-N 0 3 261.365 2.782 20 10 CFCDHN CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104066 623630931 /nfs/dbraw/zinc/63/09/31/623630931.db2.gz LYXMHSSYMXRVOF-CABCVRRESA-N 0 3 261.365 2.782 20 10 CFCDHN CCO[C@@H]1CCC[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000825284022 623663206 /nfs/dbraw/zinc/66/32/06/623663206.db2.gz DCRQBXPOUYUVOJ-TZMCWYRMSA-N 0 3 253.317 2.579 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c([O-])c1 ZINC000825331302 623674041 /nfs/dbraw/zinc/67/40/41/623674041.db2.gz COXGVFILGHJKEH-CABCVRRESA-N 0 3 291.391 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c([O-])c1 ZINC000825331302 623674044 /nfs/dbraw/zinc/67/40/44/623674044.db2.gz COXGVFILGHJKEH-CABCVRRESA-N 0 3 291.391 2.648 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H](C)C[S@@](C)=O)cc1Cl ZINC000825505365 623703820 /nfs/dbraw/zinc/70/38/20/623703820.db2.gz XDTNPOCEKSDXFC-MLCYQJTMSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H](C)C[S@@](C)=O)cc1Cl ZINC000825505365 623703827 /nfs/dbraw/zinc/70/38/27/623703827.db2.gz XDTNPOCEKSDXFC-MLCYQJTMSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH+]3CCC2CC3)cc1Cl ZINC000825915912 623768715 /nfs/dbraw/zinc/76/87/15/623768715.db2.gz DONNNERQIWUXBZ-UHFFFAOYSA-N 0 3 280.799 2.634 20 10 CFCDHN CC[C@H](COCC1CC1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000826866421 623899097 /nfs/dbraw/zinc/89/90/97/623899097.db2.gz AJZHYGOYBYGMEA-CQSZACIVSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1ccncc1CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000826926833 623910563 /nfs/dbraw/zinc/91/05/63/623910563.db2.gz OHOFSCFMEKRGDS-UHFFFAOYSA-N 0 3 260.312 2.567 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000827179301 623960316 /nfs/dbraw/zinc/96/03/16/623960316.db2.gz UMQBZBGXPSGGLL-GOEBONIOSA-N 0 3 273.307 2.799 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2C[C@@H](O)c3ccccc32)c1 ZINC000827179361 623960499 /nfs/dbraw/zinc/96/04/99/623960499.db2.gz VUZLVUKDEYNCNV-DOTOQJQBSA-N 0 3 285.343 2.669 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2C[C@@H](O)C23CCC3)c1[O-] ZINC000827365064 623993996 /nfs/dbraw/zinc/99/39/96/623993996.db2.gz JIZMUEJABXHQEF-QWHCGFSZSA-N 0 3 281.783 2.747 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccc3c(c1)OCO3)CC2 ZINC000834497231 625695099 /nfs/dbraw/zinc/69/50/99/625695099.db2.gz ZWAQAIBKLFZNDM-AWEZNQCLSA-N 0 3 297.354 2.941 20 10 CFCDHN COc1cccc(O)c1CN[C@H](c1ccccc1)[C@H](C)O ZINC000827855427 624111836 /nfs/dbraw/zinc/11/18/36/624111836.db2.gz CUFUYBXEWBZQQT-SJCJKPOMSA-N 0 3 287.359 2.613 20 10 CFCDHN COc1cccc(O)c1CN[C@H](c1ccccc1)[C@@H](C)O ZINC000827855426 624111982 /nfs/dbraw/zinc/11/19/82/624111982.db2.gz CUFUYBXEWBZQQT-PXAZEXFGSA-N 0 3 287.359 2.613 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H](C1CC1)C1CCC1)OCO2 ZINC000324663725 624230068 /nfs/dbraw/zinc/23/00/68/624230068.db2.gz IXRZVEBUEVIOBU-MRXNPFEDSA-N 0 3 275.348 2.789 20 10 CFCDHN Cc1ccc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000834578275 625723598 /nfs/dbraw/zinc/72/35/98/625723598.db2.gz JMNAFWAGJOJXJT-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834581853 625724562 /nfs/dbraw/zinc/72/45/62/625724562.db2.gz NXCSOXBKJONUIR-DETPVDSQSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC[C@H]2CCOC2)c([O-])c1 ZINC000185523865 625735727 /nfs/dbraw/zinc/73/57/27/625735727.db2.gz CLQZDRKNSNQFJC-LSDHHAIUSA-N 0 3 293.407 2.794 20 10 CFCDHN C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834624327 625740789 /nfs/dbraw/zinc/74/07/89/625740789.db2.gz JMNOSUUFOCXRPE-MBNYWOFBSA-N 0 3 261.365 2.784 20 10 CFCDHN CCCN(CC)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185632067 625752296 /nfs/dbraw/zinc/75/22/96/625752296.db2.gz RXKADGJFDIAZFP-GFCCVEGCSA-N 0 3 268.376 2.914 20 10 CFCDHN OC[C@H](N[C@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000834770860 625847731 /nfs/dbraw/zinc/84/77/31/625847731.db2.gz ZLBREGJTJFUMQF-STQMWFEESA-N 0 3 275.373 2.764 20 10 CFCDHN OC[C@H](N[C@@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000834770856 625848220 /nfs/dbraw/zinc/84/82/20/625848220.db2.gz ZLBREGJTJFUMQF-OLZOCXBDSA-N 0 3 275.373 2.764 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834778811 625851900 /nfs/dbraw/zinc/85/19/00/625851900.db2.gz GLDOHGWVSIEKRN-IRXDYDNUSA-N 0 3 297.398 2.881 20 10 CFCDHN CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834793933 625864137 /nfs/dbraw/zinc/86/41/37/625864137.db2.gz KBEHGIWUDKXZTF-YDHLFZDLSA-N 0 3 261.365 2.927 20 10 CFCDHN CCN1C[C@H]([NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])CC1=O ZINC000834888828 625910483 /nfs/dbraw/zinc/91/04/83/625910483.db2.gz QHOZOOYIJGLPJI-ZYHUDNBSSA-N 0 3 296.798 2.625 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CC)[C@@H](C)O)c1ccc(C)cc1[O-] ZINC000834888479 625910777 /nfs/dbraw/zinc/91/07/77/625910777.db2.gz PPJLUSIWYWZFDN-XBFCOCLRSA-N 0 3 251.370 2.901 20 10 CFCDHN C[C@H](Cc1cnn(C)c1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000834896689 625913381 /nfs/dbraw/zinc/91/33/81/625913381.db2.gz MPZYZLATRZKLSL-MNOVXSKESA-N 0 3 277.343 2.547 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+]Cc1c([O-])cccc1Cl ZINC000083552428 625977471 /nfs/dbraw/zinc/97/74/71/625977471.db2.gz UMJLQNHVXQVFLX-NSHDSACASA-N 0 3 270.804 2.866 20 10 CFCDHN FCC1(NCc2ccc3c(c2)CCCO3)CCOCC1 ZINC000922159463 626220764 /nfs/dbraw/zinc/22/07/64/626220764.db2.gz GGYCBUISKRETNR-UHFFFAOYSA-N 0 3 279.355 2.620 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)c1ccccc1[O-] ZINC000922329216 626271469 /nfs/dbraw/zinc/27/14/69/626271469.db2.gz LVRABURMECSPIT-GKKOWQTJSA-N 0 3 273.376 2.856 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCS[C@H](C)C1 ZINC000922840841 626377707 /nfs/dbraw/zinc/37/77/07/626377707.db2.gz BNGRVIIJAXXFDU-MNOVXSKESA-N 0 3 267.394 2.775 20 10 CFCDHN CCCN(Cc1cnccn1)Cc1ccccc1O ZINC000838808629 626507225 /nfs/dbraw/zinc/50/72/25/626507225.db2.gz HYSDIVWFYPAPPA-UHFFFAOYSA-N 0 3 257.337 2.594 20 10 CFCDHN CCOC[C@@H]1CCCC[N@@H+]1Cc1c([O-])cccc1OC ZINC000839169711 626529435 /nfs/dbraw/zinc/52/94/35/626529435.db2.gz HYRLWCFFZXSMPL-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOC[C@@H]1CCCC[N@H+]1Cc1c([O-])cccc1OC ZINC000839169711 626529436 /nfs/dbraw/zinc/52/94/36/626529436.db2.gz HYRLWCFFZXSMPL-ZDUSSCGKSA-N 0 3 279.380 2.792 20 10 CFCDHN C[NH2+][C@@H]1CCCN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000843048492 626546828 /nfs/dbraw/zinc/54/68/28/626546828.db2.gz BZSFOZKUTVJOBV-LLVKDONJSA-N 0 3 268.788 2.538 20 10 CFCDHN C[C@H]([NH3+])[C@@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000843052416 626548905 /nfs/dbraw/zinc/54/89/05/626548905.db2.gz SUQLSTIOUSSZCN-VHSXEESVSA-N 0 3 286.778 2.744 20 10 CFCDHN COc1ccc(CNCc2ccc(OC)cc2F)c(O)c1 ZINC000758488894 626595839 /nfs/dbraw/zinc/59/58/39/626595839.db2.gz VUPPUKAAIWEJIC-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1(C)C ZINC000758998491 626622886 /nfs/dbraw/zinc/62/28/86/626622886.db2.gz CKNRTZUMLAMLBJ-XHDPSFHLSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1(C)C ZINC000758998491 626622891 /nfs/dbraw/zinc/62/28/91/626622891.db2.gz CKNRTZUMLAMLBJ-XHDPSFHLSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@H]1N(Cc2cc3c(cc2O)CCC3)CCOC1(C)C ZINC000763214469 626970888 /nfs/dbraw/zinc/97/08/88/626970888.db2.gz YNMBUFNVRVGDQF-GFCCVEGCSA-N 0 3 275.392 2.880 20 10 CFCDHN C[C@@H](O)CC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000767925849 627295483 /nfs/dbraw/zinc/29/54/83/627295483.db2.gz GCQCPMLJHZBRRT-CYBMUJFWSA-N 0 3 271.360 2.920 20 10 CFCDHN Cc1ccc(C[N@@H+](C)Cc2cc3c(cc2[O-])OC[C@@H]3O)cc1 ZINC000768438211 627343041 /nfs/dbraw/zinc/34/30/41/627343041.db2.gz PSPXHEZPMHBBEQ-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1ccc(C[N@H+](C)Cc2cc3c(cc2[O-])OC[C@@H]3O)cc1 ZINC000768438211 627343045 /nfs/dbraw/zinc/34/30/45/627343045.db2.gz PSPXHEZPMHBBEQ-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN CC[C@@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464801 627345072 /nfs/dbraw/zinc/34/50/72/627345072.db2.gz AOJPHEBIHBUFCU-RDJZCZTQSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464801 627345075 /nfs/dbraw/zinc/34/50/75/627345075.db2.gz AOJPHEBIHBUFCU-RDJZCZTQSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cccc(O)c1CN(C)CCOC(C)(C)C ZINC000769514471 627449861 /nfs/dbraw/zinc/44/98/61/627449861.db2.gz HPCFVLRPHHKYDB-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCc2nccs2)c([O-])c1 ZINC000769541633 627454688 /nfs/dbraw/zinc/45/46/88/627454688.db2.gz DVBXNURFTIMXAU-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCc2nccs2)c([O-])c1 ZINC000769541633 627454691 /nfs/dbraw/zinc/45/46/91/627454691.db2.gz DVBXNURFTIMXAU-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCS[C@@H](C(C)C)C1 ZINC000769547200 627454725 /nfs/dbraw/zinc/45/47/25/627454725.db2.gz BHGHAMYITRTUDO-OAHLLOKOSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCS[C@@H](C(C)C)C1 ZINC000769547200 627454729 /nfs/dbraw/zinc/45/47/29/627454729.db2.gz BHGHAMYITRTUDO-OAHLLOKOSA-N 0 3 281.421 2.974 20 10 CFCDHN C[C@@H](N[C@@H](CO)c1ccsc1)c1ccccc1O ZINC000769987944 627494510 /nfs/dbraw/zinc/49/45/10/627494510.db2.gz WKFOJYIKXPKUQH-MFKMUULPSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1ccsc1)c1ccccc1[O-] ZINC000769987944 627494513 /nfs/dbraw/zinc/49/45/13/627494513.db2.gz WKFOJYIKXPKUQH-MFKMUULPSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1ccsc1)c1cc(F)ccc1[O-] ZINC000769990583 627494678 /nfs/dbraw/zinc/49/46/78/627494678.db2.gz UVXCBACOIREFKL-RNCFNFMXSA-N 0 3 281.352 2.977 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000770374984 627516497 /nfs/dbraw/zinc/51/64/97/627516497.db2.gz PMKLUSVJWIWBBR-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000770374984 627516498 /nfs/dbraw/zinc/51/64/98/627516498.db2.gz PMKLUSVJWIWBBR-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC000771894339 627644605 /nfs/dbraw/zinc/64/46/05/627644605.db2.gz WJTQGQYRIPNJFC-MLGOLLRUSA-N 0 3 279.380 2.694 20 10 CFCDHN CC(C)N(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000774480705 627931551 /nfs/dbraw/zinc/93/15/51/627931551.db2.gz CGFLOJJMYYCERE-KBPBESRZSA-N 0 3 291.439 2.659 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC[C@@H]2OC)c([O-])c1 ZINC000774834045 627968969 /nfs/dbraw/zinc/96/89/69/627968969.db2.gz XUSAQKFUSMLGSP-CJNGLKHVSA-N 0 3 279.380 2.696 20 10 CFCDHN CCn1nccc1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775365123 628015746 /nfs/dbraw/zinc/01/57/46/628015746.db2.gz UHIBKHLJIWTAAN-ZDUSSCGKSA-N 0 3 272.396 2.820 20 10 CFCDHN CC[C@H]([NH2+]CCC(=O)Nc1ccccn1)c1ccccc1[O-] ZINC000775496322 628031313 /nfs/dbraw/zinc/03/13/13/628031313.db2.gz GKFCQEVKAGHYNZ-AWEZNQCLSA-N 0 3 299.374 2.857 20 10 CFCDHN CC[C@H]([NH2+]C1CCC(C(=O)NC)CC1)c1ccccc1[O-] ZINC000775495824 628031560 /nfs/dbraw/zinc/03/15/60/628031560.db2.gz CNKIWWXIATVEPM-PIMMBPRGSA-N 0 3 290.407 2.738 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)O)c2c1c(F)ccc2[O-] ZINC000775585538 628043331 /nfs/dbraw/zinc/04/33/31/628043331.db2.gz GVIXTHXXKOWNFP-MWLCHTKSSA-N 0 3 267.344 2.830 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)OCC2(C)C)c1 ZINC000775703736 628056728 /nfs/dbraw/zinc/05/67/28/628056728.db2.gz WHTGNFOEWROTMF-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCC(=O)O1 ZINC000852017879 634628023 /nfs/dbraw/zinc/62/80/23/634628023.db2.gz HWPPLEKRHVGVHD-CQSZACIVSA-N 0 3 277.364 2.700 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCC(=O)O1 ZINC000852017879 634628027 /nfs/dbraw/zinc/62/80/27/634628027.db2.gz HWPPLEKRHVGVHD-CQSZACIVSA-N 0 3 277.364 2.700 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC=C(COC)CC2)c([O-])c1 ZINC000775994804 628092404 /nfs/dbraw/zinc/09/24/04/628092404.db2.gz LMYITFQRVSQQFU-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC=C(COC)CC2)c([O-])c1 ZINC000775994804 628092408 /nfs/dbraw/zinc/09/24/08/628092408.db2.gz LMYITFQRVSQQFU-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2cc(OC)ccc2O)nc1 ZINC000776008552 628093990 /nfs/dbraw/zinc/09/39/90/628093990.db2.gz RPJNIESFKBWWSW-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN COc1ccc(CN[C@H](C)c2cc(OC)ccc2O)nc1 ZINC000776008549 628094213 /nfs/dbraw/zinc/09/42/13/628094213.db2.gz RPJNIESFKBWWSW-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC(C)(C)O2)c([O-])c1 ZINC000778207917 628286987 /nfs/dbraw/zinc/28/69/87/628286987.db2.gz AOBBNBGBMMAXCH-AWEZNQCLSA-N 0 3 279.380 2.838 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000779003157 628344649 /nfs/dbraw/zinc/34/46/49/628344649.db2.gz KSCIDFPTCHNEJK-UHFFFAOYSA-N 0 3 269.344 2.699 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000779003157 628344653 /nfs/dbraw/zinc/34/46/53/628344653.db2.gz KSCIDFPTCHNEJK-UHFFFAOYSA-N 0 3 269.344 2.699 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](CCO)CCc1ccccc1 ZINC000779021413 628345718 /nfs/dbraw/zinc/34/57/18/628345718.db2.gz WWJJGFQJHUUBFJ-UHFFFAOYSA-N 0 3 289.350 2.568 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](CCO)CCc1ccccc1 ZINC000779021413 628345720 /nfs/dbraw/zinc/34/57/20/628345720.db2.gz WWJJGFQJHUUBFJ-UHFFFAOYSA-N 0 3 289.350 2.568 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000779028432 628347192 /nfs/dbraw/zinc/34/71/92/628347192.db2.gz WTLVINZHESGIFY-INIZCTEOSA-N 0 3 261.365 2.785 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000779028432 628347195 /nfs/dbraw/zinc/34/71/95/628347195.db2.gz WTLVINZHESGIFY-INIZCTEOSA-N 0 3 261.365 2.785 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000779062162 628349182 /nfs/dbraw/zinc/34/91/82/628349182.db2.gz PXHBPXJKLSGIEZ-OCCSQVGLSA-N 0 3 271.364 2.644 20 10 CFCDHN COC(=O)c1ccc2c(c1)CN(Cc1ccccc1O)CC2 ZINC000779597764 628389519 /nfs/dbraw/zinc/38/95/19/628389519.db2.gz DYZFUGLPVPDLFY-UHFFFAOYSA-N 0 3 297.354 2.737 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)[C@@H]2CCCOC2)c([O-])c1 ZINC000779987841 628425148 /nfs/dbraw/zinc/42/51/48/628425148.db2.gz HFMHFJCITCAORY-TZMCWYRMSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cccc(C[NH2+]C(C)(C)C2CCOCC2)c1[O-] ZINC000787332400 629007308 /nfs/dbraw/zinc/00/73/08/629007308.db2.gz JXOSPDPHHLSONW-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCOCC(F)F)c2c1c(F)ccc2[O-] ZINC000788259204 629053062 /nfs/dbraw/zinc/05/30/62/629053062.db2.gz LNTHBFQBKMERQG-SCZZXKLOSA-N 0 3 289.297 2.951 20 10 CFCDHN C[C@@H](C[N@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000788492255 629074422 /nfs/dbraw/zinc/07/44/22/629074422.db2.gz BYZNLDDWIDOTKN-LBPRGKRZSA-N 0 3 279.380 2.802 20 10 CFCDHN C[C@@H](C[N@@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000788492255 629074429 /nfs/dbraw/zinc/07/44/29/629074429.db2.gz BYZNLDDWIDOTKN-LBPRGKRZSA-N 0 3 279.380 2.802 20 10 CFCDHN C[C@@H](CC[NH+](C)C)NCc1c([O-])ccc(Cl)c1F ZINC000790962157 629275105 /nfs/dbraw/zinc/27/51/05/629275105.db2.gz GPTLUPNNJLXVHR-VIFPVBQESA-N 0 3 274.767 2.615 20 10 CFCDHN C[C@@H](CCN(C)C)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790962157 629275107 /nfs/dbraw/zinc/27/51/07/629275107.db2.gz GPTLUPNNJLXVHR-VIFPVBQESA-N 0 3 274.767 2.615 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+]Cc2ccccc2[O-])cc1C ZINC000835073495 629372179 /nfs/dbraw/zinc/37/21/79/629372179.db2.gz MXUQBHMTZLVNRL-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN C[C@@H]1C[C@@H](C)N1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000793219678 629507628 /nfs/dbraw/zinc/50/76/28/629507628.db2.gz DDSALTOLDCZWME-CHWSQXEVSA-N 0 3 278.371 2.645 20 10 CFCDHN CN(C)c1ccc(CN2CCC(F)(F)CC2)cc1 ZINC000793351876 629529734 /nfs/dbraw/zinc/52/97/34/629529734.db2.gz IECKPKZSDNPCAL-UHFFFAOYSA-N 0 3 254.324 2.984 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC2(CCOCC2)CC1 ZINC000793623476 629580838 /nfs/dbraw/zinc/58/08/38/629580838.db2.gz GQGBEQAPXFQYDB-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)COCC(C)C)c1ccc(C)cc1[O-] ZINC000794801914 629687627 /nfs/dbraw/zinc/68/76/27/629687627.db2.gz LIKUFNDSBOYSIF-GDBMZVCRSA-N 0 3 295.423 2.775 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)COCCOC)c1ccc(C)cc1[O-] ZINC000794818688 629690162 /nfs/dbraw/zinc/69/01/62/629690162.db2.gz UWANZCXRFUMQJY-HIFRSBDPSA-N 0 3 281.396 2.793 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000794816106 629690378 /nfs/dbraw/zinc/69/03/78/629690378.db2.gz KJXOJLCRACLFGG-CVEARBPZSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)COCCOC)c1ccc(C)cc1[O-] ZINC000794818695 629690385 /nfs/dbraw/zinc/69/03/85/629690385.db2.gz UWANZCXRFUMQJY-ZFWWWQNUSA-N 0 3 281.396 2.793 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000796497684 629927057 /nfs/dbraw/zinc/92/70/57/629927057.db2.gz NXAFGZWEJFMRTJ-STQMWFEESA-N 0 3 279.380 2.553 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCO[C@H](CC)C2)c([O-])c1 ZINC000798964139 630265495 /nfs/dbraw/zinc/26/54/95/630265495.db2.gz IURODNVWSHMBPD-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCO[C@H](CC)C2)c([O-])c1 ZINC000798964139 630265497 /nfs/dbraw/zinc/26/54/97/630265497.db2.gz IURODNVWSHMBPD-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[NH2+]CCCOC(F)F)c([O-])c1 ZINC000800896013 630415195 /nfs/dbraw/zinc/41/51/95/630415195.db2.gz TTZPLHPTYMQUPR-UHFFFAOYSA-N 0 3 275.295 2.510 20 10 CFCDHN CCCC[N@H+](CCC(=O)OCC)Cc1ccccc1[O-] ZINC000801596504 630461114 /nfs/dbraw/zinc/46/11/14/630461114.db2.gz BZLHKVUZJFIEHT-UHFFFAOYSA-N 0 3 279.380 2.948 20 10 CFCDHN CCCC[N@@H+](CCC(=O)OCC)Cc1ccccc1[O-] ZINC000801596504 630461116 /nfs/dbraw/zinc/46/11/16/630461116.db2.gz BZLHKVUZJFIEHT-UHFFFAOYSA-N 0 3 279.380 2.948 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NCCC ZINC000801596875 630461174 /nfs/dbraw/zinc/46/11/74/630461174.db2.gz RVVPBMODTVXUEF-AWEZNQCLSA-N 0 3 292.423 2.909 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NCCC ZINC000801596875 630461175 /nfs/dbraw/zinc/46/11/75/630461175.db2.gz RVVPBMODTVXUEF-AWEZNQCLSA-N 0 3 292.423 2.909 20 10 CFCDHN CCCCN(CC(=O)N[C@H](C)CC)Cc1ccccc1O ZINC000801599689 630462157 /nfs/dbraw/zinc/46/21/57/630462157.db2.gz ZFPVTRRGKBGOLL-CQSZACIVSA-N 0 3 292.423 2.909 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCN(C)C2=O)c1[O-] ZINC000808699955 631030668 /nfs/dbraw/zinc/03/06/68/631030668.db2.gz FZOYWOLMHRMADC-GWCFXTLKSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCn2cccn2)c1[O-] ZINC000808704420 631031124 /nfs/dbraw/zinc/03/11/24/631031124.db2.gz QGMFLZVHCFIBTH-LLVKDONJSA-N 0 3 279.771 2.901 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCC(=O)N(C)C2)c1[O-] ZINC000808697284 631031171 /nfs/dbraw/zinc/03/11/71/631031171.db2.gz BGADVGVXHDRZSH-ZYHUDNBSSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCOC2)c1[O-] ZINC000808708848 631032134 /nfs/dbraw/zinc/03/21/34/631032134.db2.gz RAQOYVDUGLWKQL-GXSJLCMTSA-N 0 3 255.745 2.794 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)C[S@@](C)=O)c1[O-] ZINC000808714348 631032884 /nfs/dbraw/zinc/03/28/84/631032884.db2.gz VLDSRTKCRJIHDD-LXIMFEHMSA-N 0 3 289.828 2.772 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2ccn(C)n2)c1[O-] ZINC000808714604 631033461 /nfs/dbraw/zinc/03/34/61/631033461.db2.gz NNDQJWQXBRZFLG-NSHDSACASA-N 0 3 293.798 2.981 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000808720528 631035742 /nfs/dbraw/zinc/03/57/42/631035742.db2.gz ALLIJQBASXQTAI-HOSYDEDBSA-N 0 3 265.328 2.848 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@H](O)C(C)C ZINC000840881260 631250214 /nfs/dbraw/zinc/25/02/14/631250214.db2.gz HCUHQRMWTDGEQH-HEHGZKQESA-N 0 3 263.381 2.765 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCOC[C@@H]1C1CC1 ZINC000840916967 631264278 /nfs/dbraw/zinc/26/42/78/631264278.db2.gz MGXOSJKTEAXOGW-QGZVFWFLSA-N 0 3 274.408 2.672 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNC(C)(C)c1cnn(C)c1 ZINC000840934876 631268005 /nfs/dbraw/zinc/26/80/05/631268005.db2.gz YZTVCJGBSTVQPK-UHFFFAOYSA-N 0 3 286.423 2.819 20 10 CFCDHN COc1cccc(CNCc2cccc(OC)c2F)c1O ZINC000809740372 631275396 /nfs/dbraw/zinc/27/53/96/631275396.db2.gz WUQAQEMHTRHWNG-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CS[C@@H](C)C2)c([O-])c1 ZINC000840957469 631284973 /nfs/dbraw/zinc/28/49/73/631284973.db2.gz BURGQQBPKKSLOQ-CMPLNLGQSA-N 0 3 267.394 2.775 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)[C@H]2CC2(F)F)c([O-])c1 ZINC000840968091 631288957 /nfs/dbraw/zinc/28/89/57/631288957.db2.gz NMOWRKRUPNHOTG-GZMMTYOYSA-N 0 3 257.280 2.534 20 10 CFCDHN Cn1c(Cl)nc(Cl)c1CNCCc1ccc(N)cc1 ZINC000841035812 631314495 /nfs/dbraw/zinc/31/44/95/631314495.db2.gz OQCQLWLXAODMBN-UHFFFAOYSA-N 0 3 299.205 2.641 20 10 CFCDHN C[C@H](NCc1c([O-])ccc(Cl)c1F)[C@@H]1CCC[NH2+]C1 ZINC000841034131 631315066 /nfs/dbraw/zinc/31/50/66/631315066.db2.gz WDPSPQCKAOFWHN-VHSXEESVSA-N 0 3 286.778 2.662 20 10 CFCDHN [O-]c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CCCCNC1 ZINC000841091518 631338747 /nfs/dbraw/zinc/33/87/47/631338747.db2.gz ZQEXTWFGFCLSPY-NSHDSACASA-N 0 3 289.206 2.931 20 10 CFCDHN COCC[C@H](COC)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000810257751 631351000 /nfs/dbraw/zinc/35/10/00/631351000.db2.gz VLBQLPYTXBPJIZ-WZRBSPASSA-N 0 3 297.370 2.721 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@@](C)(O)C2)c1[O-] ZINC000841760464 631467999 /nfs/dbraw/zinc/46/79/99/631467999.db2.gz WCSRVVHDMRCKNF-NURSFMCSSA-N 0 3 269.772 2.918 20 10 CFCDHN Cc1cc([O-])c(CN(C)CC(C)(C)C[NH3+])c(Cl)c1 ZINC000843056282 631820342 /nfs/dbraw/zinc/82/03/42/631820342.db2.gz HFFLMNGFLCBGIS-UHFFFAOYSA-N 0 3 270.804 2.771 20 10 CFCDHN CCCn1cc(CN[C@H](C)c2cc(OC)ccc2O)cn1 ZINC000813331722 631903892 /nfs/dbraw/zinc/90/38/92/631903892.db2.gz SJJHDGIWCQVMPJ-GFCCVEGCSA-N 0 3 289.379 2.858 20 10 CFCDHN CCOc1ccc(CN2C[C@H](C)OC3(CCC3)C2)c(O)c1 ZINC000843435147 631959348 /nfs/dbraw/zinc/95/93/48/631959348.db2.gz JATQYIOKQPAYSK-ZDUSSCGKSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)Cc2ccc(O)cc2)c([O-])c1 ZINC000105446982 632134442 /nfs/dbraw/zinc/13/44/42/632134442.db2.gz YGOMELYPZHLITG-LBPRGKRZSA-N 0 3 287.359 2.827 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000044684724 650052957 /nfs/dbraw/zinc/05/29/57/650052957.db2.gz CSZVWBRBOSTHSN-WFASDCNBSA-N 0 3 260.381 2.670 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])c1cc[nH]c(=O)c1 ZINC000815642520 632303737 /nfs/dbraw/zinc/30/37/37/632303737.db2.gz FBZJNNDMAXRGPZ-QWRGUYRKSA-N 0 3 258.321 2.905 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CNc3ccccc3C2)c([O-])c1 ZINC000844904832 632331847 /nfs/dbraw/zinc/33/18/47/632331847.db2.gz CTASQMXLBPFJHB-OAHLLOKOSA-N 0 3 298.386 2.917 20 10 CFCDHN CN(CCC[NH+](C)C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816610771 632494235 /nfs/dbraw/zinc/49/42/35/632494235.db2.gz XVMSDPOFTOGDMA-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CN(C)CCC[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816610771 632494243 /nfs/dbraw/zinc/49/42/43/632494243.db2.gz XVMSDPOFTOGDMA-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CN(C)CCC[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816610771 632494251 /nfs/dbraw/zinc/49/42/51/632494251.db2.gz XVMSDPOFTOGDMA-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](O)C23CCCC3)c([O-])c1 ZINC000816630601 632497107 /nfs/dbraw/zinc/49/71/07/632497107.db2.gz KMWCFFSNUUNMQN-MRXNPFEDSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c([O-])c1 ZINC000816630601 632497110 /nfs/dbraw/zinc/49/71/10/632497110.db2.gz KMWCFFSNUUNMQN-MRXNPFEDSA-N 0 3 291.391 2.670 20 10 CFCDHN CCc1ncc(CN[C@H](C)c2cc(OC)ccc2O)cn1 ZINC000845970630 632607313 /nfs/dbraw/zinc/60/73/13/632607313.db2.gz AUPMHAPTNGAEJA-LLVKDONJSA-N 0 3 287.363 2.604 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@@](C)(O)c1ccccc1 ZINC000846038973 632620653 /nfs/dbraw/zinc/62/06/53/632620653.db2.gz OREDUGGEKRKPFT-SUMWQHHRSA-N 0 3 271.360 2.778 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC000846043001 632622735 /nfs/dbraw/zinc/62/27/35/632622735.db2.gz RBYROQISYVZXMZ-INIZCTEOSA-N 0 3 261.365 2.687 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412508 632624652 /nfs/dbraw/zinc/62/46/52/632624652.db2.gz MBRUNHOJWHOWJW-MNOVXSKESA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412508 632624657 /nfs/dbraw/zinc/62/46/57/632624657.db2.gz MBRUNHOJWHOWJW-MNOVXSKESA-N 0 3 299.798 2.505 20 10 CFCDHN C[C@H](CO)C1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000846057713 632626257 /nfs/dbraw/zinc/62/62/57/632626257.db2.gz HUZCQLIVTOVOLC-CYBMUJFWSA-N 0 3 294.414 2.732 20 10 CFCDHN CN1CCC[C@@H]1C[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000817417127 632627389 /nfs/dbraw/zinc/62/73/89/632627389.db2.gz DQTVFPJPCILFIK-LLVKDONJSA-N 0 3 286.778 2.711 20 10 CFCDHN CN1CCC[C@@H]1C[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000817417127 632627393 /nfs/dbraw/zinc/62/73/93/632627393.db2.gz DQTVFPJPCILFIK-LLVKDONJSA-N 0 3 286.778 2.711 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@H](C)CCO)c1[O-] ZINC000846111563 632634810 /nfs/dbraw/zinc/63/48/10/632634810.db2.gz QNCHOSRWYZJKQL-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@H](C)CCO)c1[O-] ZINC000846111563 632634815 /nfs/dbraw/zinc/63/48/15/632634815.db2.gz QNCHOSRWYZJKQL-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1C[C@H]2[C@@H](C1)C2(F)F ZINC000846113232 632636103 /nfs/dbraw/zinc/63/61/03/632636103.db2.gz IUOUOCBKIKZFAX-OKILXGFUSA-N 0 3 266.335 2.758 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@H](C(N)=O)CC2)c([O-])c1 ZINC000817585699 632671400 /nfs/dbraw/zinc/67/14/00/632671400.db2.gz GZCMSSGITAEWPN-IHRRRGAJSA-N 0 3 290.407 2.643 20 10 CFCDHN CON1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)CC1 ZINC000817589595 632673191 /nfs/dbraw/zinc/67/31/91/632673191.db2.gz ZDEOTAZPCNXZTB-ZWNOBZJWSA-N 0 3 294.370 2.695 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cnccc1N ZINC000817900326 632724164 /nfs/dbraw/zinc/72/41/64/632724164.db2.gz MHUZKPSGOQLPOT-CYBMUJFWSA-N 0 3 296.418 2.727 20 10 CFCDHN CC[C@@H]([NH2+]C1CCNCC1)c1cccc(Cl)c1[O-] ZINC000817936029 632741968 /nfs/dbraw/zinc/74/19/68/632741968.db2.gz MCZXRDZUMIUNIV-CYBMUJFWSA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@H](NC[C@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1[O-] ZINC000817953012 632752686 /nfs/dbraw/zinc/75/26/86/632752686.db2.gz KFYAJJHRULYJFM-VHSXEESVSA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000817971687 632770891 /nfs/dbraw/zinc/77/08/91/632770891.db2.gz PATJQNBUIPAHGR-OSMZGAPFSA-N 0 3 266.360 2.713 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1ccc(F)cc1[O-] ZINC000817984889 632781325 /nfs/dbraw/zinc/78/13/25/632781325.db2.gz BNRCHWWYXCUVGT-WCQYABFASA-N 0 3 278.371 2.857 20 10 CFCDHN COc1cc(Br)cc([C@@H](C)[NH2+]C2CC2)c1[O-] ZINC000848514390 633269696 /nfs/dbraw/zinc/26/96/96/633269696.db2.gz NIAFFMXBKNFBJH-SSDOTTSWSA-N 0 3 286.169 2.976 20 10 CFCDHN CCc1cccc(CN[C@H](CO)c2ccc(F)cc2)c1O ZINC000848896745 633381199 /nfs/dbraw/zinc/38/11/99/633381199.db2.gz IIVWLIAQHWKEIJ-MRXNPFEDSA-N 0 3 289.350 2.917 20 10 CFCDHN CCc1cccc(CNCc2n[nH]c(C(C)(C)C)n2)c1O ZINC000848917400 633401020 /nfs/dbraw/zinc/40/10/20/633401020.db2.gz SLRRLXAJPILEPA-UHFFFAOYSA-N 0 3 288.395 2.660 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000848928136 633410713 /nfs/dbraw/zinc/41/07/13/633410713.db2.gz WPZSLTVKYAOGCA-CABCVRRESA-N 0 3 278.371 2.638 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1 ZINC000850113300 633845589 /nfs/dbraw/zinc/84/55/89/633845589.db2.gz BIGKBJIRQZGUBI-QGZVFWFLSA-N 0 3 299.370 2.850 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCN2C(C)(C)C)c([O-])c1 ZINC000850344251 633947529 /nfs/dbraw/zinc/94/75/29/633947529.db2.gz ZCOJHEZZKFHCMO-CQSZACIVSA-N 0 3 292.423 2.753 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC000850377740 633965819 /nfs/dbraw/zinc/96/58/19/633965819.db2.gz KPUXOIHKKDBFHU-RWMBFGLXSA-N 0 3 261.365 2.927 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C)O2)c([O-])c1 ZINC000850379246 633966370 /nfs/dbraw/zinc/96/63/70/633966370.db2.gz IUUNPSBOHYCBGG-DOMZBBRYSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)CN1CCC(C)CC1 ZINC000850387730 633971265 /nfs/dbraw/zinc/97/12/65/633971265.db2.gz YLPGFSXTMWGFBX-CQSZACIVSA-N 0 3 292.423 2.611 20 10 CFCDHN COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C1CCOCC1 ZINC000850494468 634017924 /nfs/dbraw/zinc/01/79/24/634017924.db2.gz RXTYCPQIYKCITR-IAQYHMDHSA-N 0 3 297.370 2.624 20 10 CFCDHN COc1ccccc1OCC[N@H+](C)Cc1ccccc1[O-] ZINC000109769740 634233691 /nfs/dbraw/zinc/23/36/91/634233691.db2.gz KLSBSTKYIITAMT-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1ccccc1OCC[N@@H+](C)Cc1ccccc1[O-] ZINC000109769740 634233694 /nfs/dbraw/zinc/23/36/94/634233694.db2.gz KLSBSTKYIITAMT-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN Cn1c2cccc(F)c2nc1CC[NH2+]Cc1ccccc1[O-] ZINC000113359049 635556843 /nfs/dbraw/zinc/55/68/43/635556843.db2.gz LPNVTRRLPHTZGQ-UHFFFAOYSA-N 0 3 299.349 2.750 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2ccccn2)cc1F ZINC000858087038 636121587 /nfs/dbraw/zinc/12/15/87/636121587.db2.gz RQFKCNUIVCJJGC-UHFFFAOYSA-N 0 3 291.345 2.758 20 10 CFCDHN CC(C)C[C@@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858116936 636131736 /nfs/dbraw/zinc/13/17/36/636131736.db2.gz UBHJSWDJNHYPRY-GFCCVEGCSA-N 0 3 286.366 2.527 20 10 CFCDHN CSC[C@@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000858141287 636138142 /nfs/dbraw/zinc/13/81/42/636138142.db2.gz NJRHSAFTOOBXFA-SECBINFHSA-N 0 3 274.380 2.872 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2CCSC2)cc1F ZINC000858147036 636138915 /nfs/dbraw/zinc/13/89/15/636138915.db2.gz GCKFAPUNTASAHF-JTQLQIEISA-N 0 3 272.364 2.626 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000858486568 636268938 /nfs/dbraw/zinc/26/89/38/636268938.db2.gz VSBGWEAZERTNJE-UONOGXRCSA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@H](Nc1ccnc(CO)c1)c1ccc(N(C)C)cc1 ZINC000858488153 636270441 /nfs/dbraw/zinc/27/04/41/636270441.db2.gz ONAFAHWEQYAISW-GFCCVEGCSA-N 0 3 271.364 2.813 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000858508379 636277650 /nfs/dbraw/zinc/27/76/50/636277650.db2.gz NIQSKSYJVWQNOK-KBPBESRZSA-N 0 3 287.359 2.621 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H](CO)C(C)(C)C)cc1F ZINC000862324729 637321547 /nfs/dbraw/zinc/32/15/47/637321547.db2.gz UBZXCFZORVMLKH-CQSZACIVSA-N 0 3 286.366 2.527 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCN2C)c1[O-] ZINC000862536102 637412113 /nfs/dbraw/zinc/41/21/13/637412113.db2.gz GEXAVIZJZHOBCK-ZDUSSCGKSA-N 0 3 268.788 2.538 20 10 CFCDHN COc1cc(O)c(CN[C@H](C)c2ccns2)cc1OC ZINC000862540026 637413381 /nfs/dbraw/zinc/41/33/81/637413381.db2.gz XHXJWMPUIUEMNL-SECBINFHSA-N 0 3 294.376 2.717 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCCC3(CC3)CC1)[C@@H](O)CO2 ZINC000863331698 637628893 /nfs/dbraw/zinc/62/88/93/637628893.db2.gz RZLNPWLGCDRMBT-HNNXBMFYSA-N 0 3 289.375 2.584 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCCC3(CC3)CC1)[C@@H](O)CO2 ZINC000863331698 637628895 /nfs/dbraw/zinc/62/88/95/637628895.db2.gz RZLNPWLGCDRMBT-HNNXBMFYSA-N 0 3 289.375 2.584 20 10 CFCDHN COc1cccc(CN[C@H](C)c2ccncc2OC)c1O ZINC000189556770 650389055 /nfs/dbraw/zinc/38/90/55/650389055.db2.gz MTMABVBQNVEALJ-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2ccncc2OC)c1O ZINC000189556746 650389200 /nfs/dbraw/zinc/38/92/00/650389200.db2.gz MTMABVBQNVEALJ-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cncc(CNCc2ccc(N(C)C)cc2)c1C ZINC000865404076 638313091 /nfs/dbraw/zinc/31/30/91/638313091.db2.gz BMYRGSKKTKRNTQ-UHFFFAOYSA-N 0 3 285.391 2.754 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000865784125 638571628 /nfs/dbraw/zinc/57/16/28/638571628.db2.gz ABCNELDNFBDGIG-KBPBESRZSA-N 0 3 291.391 2.553 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CC(C)(C)CC[C@H]1O)c1ccccc1[O-] ZINC000866452611 638824920 /nfs/dbraw/zinc/82/49/20/638824920.db2.gz KRCUMMBUBMDLQE-NJZAAPMLSA-N 0 3 263.381 2.982 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CCCn3nccc31)CC2 ZINC000866632948 638858034 /nfs/dbraw/zinc/85/80/34/638858034.db2.gz DKERXHDIXWNBNN-STQMWFEESA-N 0 3 269.348 2.701 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000191570062 650511399 /nfs/dbraw/zinc/51/13/99/650511399.db2.gz PHQQELTWXYLPED-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000191590510 650512020 /nfs/dbraw/zinc/51/20/20/650512020.db2.gz LEUMUNIPEADMBV-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1nccnc1[C@@H](C)N[C@@H]1CCc2cccc(O)c21 ZINC000872132852 641660291 /nfs/dbraw/zinc/66/02/91/641660291.db2.gz IBFFCTFLCQTUPW-DGCLKSJQSA-N 0 3 269.348 2.829 20 10 CFCDHN Cc1nccnc1[C@H](C)N[C@H](C)c1ccccc1O ZINC000872134686 641662337 /nfs/dbraw/zinc/66/23/37/641662337.db2.gz UGJAVMXVJSEKFK-PWSUYJOCSA-N 0 3 257.337 2.902 20 10 CFCDHN Cc1nn(C)cc1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000125527685 642665193 /nfs/dbraw/zinc/66/51/93/642665193.db2.gz QBFGPPZWSIZBRQ-GFCCVEGCSA-N 0 3 272.396 2.645 20 10 CFCDHN COCCCOC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000876756420 642996673 /nfs/dbraw/zinc/99/66/73/642996673.db2.gz UBPSEUZNHPMVHM-UHFFFAOYSA-N 0 3 293.407 2.718 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC2(C1)CCOCC2 ZINC000876794011 643012092 /nfs/dbraw/zinc/01/20/92/643012092.db2.gz KLAVENJBMKMMMI-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC2(C1)CCOCC2 ZINC000876794011 643012096 /nfs/dbraw/zinc/01/20/96/643012096.db2.gz KLAVENJBMKMMMI-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN COc1ccc(OCC[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876902432 643058111 /nfs/dbraw/zinc/05/81/11/643058111.db2.gz OUPHTMFTOYQEPB-UHFFFAOYSA-N 0 3 287.359 2.878 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1COc2ccccc2O1 ZINC000876907867 643060080 /nfs/dbraw/zinc/06/00/80/643060080.db2.gz IHFIWHBPDNLGGB-ZDUSSCGKSA-N 0 3 285.343 2.630 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876916546 643063951 /nfs/dbraw/zinc/06/39/51/643063951.db2.gz CVZJWZRQRLVBER-QGZVFWFLSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]CCCOCC(F)(F)F)c([O-])c1 ZINC000876926816 643067127 /nfs/dbraw/zinc/06/71/27/643067127.db2.gz HCQCSTPFGCSUFA-UHFFFAOYSA-N 0 3 277.286 2.759 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876959091 643081400 /nfs/dbraw/zinc/08/14/00/643081400.db2.gz GIBGYSQAFXQVLL-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)COCC(F)(F)F)c([O-])c1 ZINC000876974553 643089437 /nfs/dbraw/zinc/08/94/37/643089437.db2.gz KVZVECPKKVQJHH-SNVBAGLBSA-N 0 3 277.286 2.758 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)c1cccc(F)c1 ZINC000876988991 643095686 /nfs/dbraw/zinc/09/56/86/643095686.db2.gz NWNIPDPODWMMRH-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2ccccc2C)c([O-])c1 ZINC000877026941 643109367 /nfs/dbraw/zinc/10/93/67/643109367.db2.gz JCVLXARSVFYFCJ-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877035375 643113909 /nfs/dbraw/zinc/11/39/09/643113909.db2.gz GMVCKODQOWUAOE-QGZVFWFLSA-N 0 3 287.359 2.532 20 10 CFCDHN CCN1CCCC[C@@H]1C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877036805 643114491 /nfs/dbraw/zinc/11/44/91/643114491.db2.gz IYRPIUSKIIFCHU-OAHLLOKOSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)c2ccccc2)c([O-])c1 ZINC000877041277 643116740 /nfs/dbraw/zinc/11/67/40/643116740.db2.gz WEZNMOFPPLKDNV-KRWDZBQOSA-N 0 3 271.360 2.698 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)c2ccsc2)c([O-])c1 ZINC000877052667 643122629 /nfs/dbraw/zinc/12/26/29/643122629.db2.gz ZXOKGHKCXJSEPG-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877065243 643130501 /nfs/dbraw/zinc/13/05/01/643130501.db2.gz KEBIQOJPYBCZLE-ZDUSSCGKSA-N 0 3 251.370 2.589 20 10 CFCDHN CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877065812 643131433 /nfs/dbraw/zinc/13/14/33/643131433.db2.gz WQKBTHCOBZWTAG-OCCSQVGLSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](CCO)CC(C)C)c([O-])c1 ZINC000877068093 643132147 /nfs/dbraw/zinc/13/21/47/643132147.db2.gz QPLQYOVMMGGBNJ-AWEZNQCLSA-N 0 3 265.397 2.835 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCC(=O)OC(C)(C)C ZINC000877069045 643133212 /nfs/dbraw/zinc/13/32/12/643133212.db2.gz WJNPEODSZBRNOD-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]CCNc2ccccc2)c([O-])c1 ZINC000877075618 643137304 /nfs/dbraw/zinc/13/73/04/643137304.db2.gz PAEPMWOPTSBFNL-UHFFFAOYSA-N 0 3 256.349 2.902 20 10 CFCDHN CN(C(=O)[C@@H](N)CC1CCCCC1)c1ccc(N)cc1 ZINC000877075980 643138661 /nfs/dbraw/zinc/13/86/61/643138661.db2.gz KRWDLVLHIGLHCF-HNNXBMFYSA-N 0 3 275.396 2.529 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000877090156 643146989 /nfs/dbraw/zinc/14/69/89/643146989.db2.gz SDZWKBKZXWXQFA-AWEZNQCLSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1cccc([C@H](O)C[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877091806 643148617 /nfs/dbraw/zinc/14/86/17/643148617.db2.gz QNHRYYZCHDGKKZ-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)c([O-])c1 ZINC000877123909 643162589 /nfs/dbraw/zinc/16/25/89/643162589.db2.gz DWMNOQLSMGSFGS-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1ccc(C[NH2+]CCC(=O)N2CCCCCC2)c([O-])c1 ZINC000877147029 643177178 /nfs/dbraw/zinc/17/71/78/643177178.db2.gz MYQAQMKBOYPVMZ-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@H]2CCCC[C@H]2O)c([O-])c1 ZINC000877167209 643184950 /nfs/dbraw/zinc/18/49/50/643184950.db2.gz QFBVKEYGJGUPCC-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c([O-])c1 ZINC000877167209 643184954 /nfs/dbraw/zinc/18/49/54/643184954.db2.gz QFBVKEYGJGUPCC-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@H]1CCO[C@H](C)C1 ZINC000877310035 643231805 /nfs/dbraw/zinc/23/18/05/643231805.db2.gz YAXOZKAJFPDSDX-KGLIPLIRSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000877316701 643233857 /nfs/dbraw/zinc/23/38/57/643233857.db2.gz LFHPFWIJSMPMQJ-HZPDHXFCSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](C2(C)OCCO2)C1 ZINC000877315691 643234186 /nfs/dbraw/zinc/23/41/86/643234186.db2.gz PWKAJEFHYWAQAB-CQSZACIVSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](C2(C)OCCO2)C1 ZINC000877315691 643234191 /nfs/dbraw/zinc/23/41/91/643234191.db2.gz PWKAJEFHYWAQAB-CQSZACIVSA-N 0 3 291.391 2.676 20 10 CFCDHN CN1CCC2(CCC[N@@H+]2Cc2ccc(F)c(F)c2[O-])CC1 ZINC000877458362 643280672 /nfs/dbraw/zinc/28/06/72/643280672.db2.gz QMHKMYFTPMAJHY-UHFFFAOYSA-N 0 3 296.361 2.731 20 10 CFCDHN CN1CCC2(CCC[N@H+]2Cc2ccc(F)c(F)c2[O-])CC1 ZINC000877458362 643280674 /nfs/dbraw/zinc/28/06/74/643280674.db2.gz QMHKMYFTPMAJHY-UHFFFAOYSA-N 0 3 296.361 2.731 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000877464213 643284733 /nfs/dbraw/zinc/28/47/33/643284733.db2.gz IBLMISPVBUMWJU-MRXNPFEDSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000877486608 643302082 /nfs/dbraw/zinc/30/20/82/643302082.db2.gz OLCBYYJJADTKNA-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000877486608 643302085 /nfs/dbraw/zinc/30/20/85/643302085.db2.gz OLCBYYJJADTKNA-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCc3cccnc3CC2)c([O-])c1 ZINC000877494119 643307404 /nfs/dbraw/zinc/30/74/04/643307404.db2.gz SWULUUVZXAQBGC-HNNXBMFYSA-N 0 3 298.386 2.833 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000877539964 643342492 /nfs/dbraw/zinc/34/24/92/643342492.db2.gz REEYZPANRXQHEF-MJGOQNOKSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000877550259 643350822 /nfs/dbraw/zinc/35/08/22/643350822.db2.gz VRXQKZNYDWBVJS-INIZCTEOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000877550259 643350828 /nfs/dbraw/zinc/35/08/28/643350828.db2.gz VRXQKZNYDWBVJS-INIZCTEOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(O)CCCC2(C)C)c([O-])c1 ZINC000877551527 643352123 /nfs/dbraw/zinc/35/21/23/643352123.db2.gz DNOAOIPSDBAYBX-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(O)CCCC1(C)C ZINC000877551600 643353057 /nfs/dbraw/zinc/35/30/57/643353057.db2.gz HHBCJRLWUMMAAJ-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000877554724 643355801 /nfs/dbraw/zinc/35/58/01/643355801.db2.gz NSFLAEIEJLWVFY-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000877554724 643355809 /nfs/dbraw/zinc/35/58/09/643355809.db2.gz NSFLAEIEJLWVFY-MRXNPFEDSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(CN2C[C@]3(CCCO3)[C@@H]2C2CC2)c(O)c1 ZINC000877555632 643357117 /nfs/dbraw/zinc/35/71/17/643357117.db2.gz YCEPVKOYRNVYCZ-DLBZAZTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ccc(C[NH2+]C2(C(=O)N(C)C)CCCCC2)c([O-])c1 ZINC000877564194 643364449 /nfs/dbraw/zinc/36/44/49/643364449.db2.gz VBAZLKFLHHHWPK-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(CF)CCOCC2)c([O-])c1 ZINC000877566019 643365397 /nfs/dbraw/zinc/36/53/97/643365397.db2.gz UPLVSLGMXNFFRV-UHFFFAOYSA-N 0 3 267.344 2.557 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC000877572423 643371509 /nfs/dbraw/zinc/37/15/09/643371509.db2.gz FDUDQZJEDJVBBX-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC000877572423 643371520 /nfs/dbraw/zinc/37/15/20/643371520.db2.gz FDUDQZJEDJVBBX-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2c(C)cccc2[O-])CC1 ZINC000877575921 643374631 /nfs/dbraw/zinc/37/46/31/643374631.db2.gz FSXAGDKDCZDADP-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])CC1 ZINC000877575921 643374632 /nfs/dbraw/zinc/37/46/32/643374632.db2.gz FSXAGDKDCZDADP-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CCC(C)(C)OCC[NH2+]Cc1c(C)cccc1[O-] ZINC000877578884 643375461 /nfs/dbraw/zinc/37/54/61/643375461.db2.gz PJHFCWOCYYGDHD-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN CO[C@@H]1C[C@@H]([NH2+]Cc2c(C)cccc2[O-])C12CCC2 ZINC000877585120 643380318 /nfs/dbraw/zinc/38/03/18/643380318.db2.gz PYLCNQHGJHWDAE-HUUCEWRRSA-N 0 3 261.365 2.748 20 10 CFCDHN CO[C@](C)([C@@H](C)[NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877587940 643382521 /nfs/dbraw/zinc/38/25/21/643382521.db2.gz JWKOGZBTVXMSTH-MLGOLLRUSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](CO)c2ccc(F)cc2)c([O-])c1 ZINC000877591223 643384953 /nfs/dbraw/zinc/38/49/53/643384953.db2.gz PFEDUAAJVVWRLK-OAHLLOKOSA-N 0 3 289.350 2.705 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877605860 643393471 /nfs/dbraw/zinc/39/34/71/643393471.db2.gz KLPVHYILDKYWNS-AAEUAGOBSA-N 0 3 251.370 2.587 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1ccc(C)cc1[O-])OCC ZINC000877648212 643430128 /nfs/dbraw/zinc/43/01/28/643430128.db2.gz LUGLGZSLANNFDJ-CQSZACIVSA-N 0 3 251.370 2.995 20 10 CFCDHN CN(Cc1cc(Cl)c(F)cc1[O-])[C@@H]1C[NH+]2CCC1CC2 ZINC000877706247 643473861 /nfs/dbraw/zinc/47/38/61/643473861.db2.gz ITWHECXCHBJVBN-CQSZACIVSA-N 0 3 298.789 2.711 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877736849 643496707 /nfs/dbraw/zinc/49/67/07/643496707.db2.gz DNNUHKNCTLADAH-CMPLNLGQSA-N 0 3 267.369 2.716 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877736849 643496712 /nfs/dbraw/zinc/49/67/12/643496712.db2.gz DNNUHKNCTLADAH-CMPLNLGQSA-N 0 3 267.369 2.716 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877741717 643512220 /nfs/dbraw/zinc/51/22/20/643512220.db2.gz ZFFXHABTLCDXDZ-OLZOCXBDSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877741717 643512229 /nfs/dbraw/zinc/51/22/29/643512229.db2.gz ZFFXHABTLCDXDZ-OLZOCXBDSA-N 0 3 263.406 2.886 20 10 CFCDHN COC(=O)c1cc(C[NH2+][C@@H](C)c2ccccc2[O-])[nH]c1C ZINC000877758197 643538596 /nfs/dbraw/zinc/53/85/96/643538596.db2.gz MJBFLLMMKWHZKQ-JTQLQIEISA-N 0 3 288.347 2.666 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877818873 643584285 /nfs/dbraw/zinc/58/42/85/643584285.db2.gz RFDAIQPKRVMLCT-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877818873 643584289 /nfs/dbraw/zinc/58/42/89/643584289.db2.gz RFDAIQPKRVMLCT-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1ccc(CN2CCO[C@H](C(F)(F)F)CC2)c(O)c1 ZINC000877823415 643590207 /nfs/dbraw/zinc/59/02/07/643590207.db2.gz YYAQJIKDPLNPKB-ZDUSSCGKSA-N 0 3 289.297 2.854 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)N1CCCCCC1 ZINC000879650061 644362807 /nfs/dbraw/zinc/36/28/07/644362807.db2.gz ZIOKVKHBMRJOAS-ZIAGYGMSSA-N 0 3 290.407 2.834 20 10 CFCDHN CCC[C@H](C)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649043 644363371 /nfs/dbraw/zinc/36/33/71/644363371.db2.gz JZDBDEVEEJZEAP-YNEHKIRRSA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1ccc(CNC(=O)C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000879649054 644363458 /nfs/dbraw/zinc/36/34/58/644363458.db2.gz KOAGLVVGPANNAO-CQSZACIVSA-N 0 3 298.386 2.668 20 10 CFCDHN CCCCCNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651617 644364764 /nfs/dbraw/zinc/36/47/64/644364764.db2.gz DLKYIKMFTKKQAA-QWHCGFSZSA-N 0 3 278.396 2.738 20 10 CFCDHN C[C@H]([NH2+]CC(=O)NCC1CCCCC1)c1ccccc1[O-] ZINC000879653700 644366018 /nfs/dbraw/zinc/36/60/18/644366018.db2.gz TVVXRJIGFQMLCF-ZDUSSCGKSA-N 0 3 290.407 2.739 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1cc(F)ccc1[O-] ZINC000883275915 645717148 /nfs/dbraw/zinc/71/71/48/645717148.db2.gz CLFXJJPEMYTMOD-YPMHNXCESA-N 0 3 293.338 2.626 20 10 CFCDHN C[C@H]([NH2+]CC1(N(C)C)CCCC1)c1ccccc1[O-] ZINC000132040216 645865750 /nfs/dbraw/zinc/86/57/50/645865750.db2.gz ZFFNSNBOIIDQOJ-ZDUSSCGKSA-N 0 3 262.397 2.917 20 10 CFCDHN C[NH+](C)C1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000132207724 645893208 /nfs/dbraw/zinc/89/32/08/645893208.db2.gz KOCAQBJTBGBIGX-UHFFFAOYSA-N 0 3 268.788 2.572 20 10 CFCDHN CCc1ccc(CNCc2cc(OC)ccc2O)o1 ZINC000133993232 646262858 /nfs/dbraw/zinc/26/28/58/646262858.db2.gz GMJSFTLYYGYACH-UHFFFAOYSA-N 0 3 261.321 2.846 20 10 CFCDHN Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2[O-])o1 ZINC000134236444 646309876 /nfs/dbraw/zinc/30/98/76/646309876.db2.gz YSBSBWBWUQCXCM-UHFFFAOYSA-N 0 3 283.331 2.974 20 10 CFCDHN CCN(CC)c1ccc(CN[C@]23C[C@H]2COC3)cc1F ZINC000886200523 646917379 /nfs/dbraw/zinc/91/73/79/646917379.db2.gz PHJCSIQWUQHHOY-BBRMVZONSA-N 0 3 278.371 2.550 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CC(C)(C)CO1 ZINC000886306985 646961670 /nfs/dbraw/zinc/96/16/70/646961670.db2.gz HABKNKFCXACMLB-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886517559 647026150 /nfs/dbraw/zinc/02/61/50/647026150.db2.gz IJHOBYLNZAUADH-MNOVXSKESA-N 0 3 254.349 2.522 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@@H]1CCCOC1)c1ccccc1[O-] ZINC000886788358 647136898 /nfs/dbraw/zinc/13/68/98/647136898.db2.gz ASCGNIQUKVRRTA-KBMXLJTQSA-N 0 3 293.407 2.875 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@H]1CCCOC1 ZINC000886789661 647137501 /nfs/dbraw/zinc/13/75/01/647137501.db2.gz ZFPFTIDFRGMXDG-YCPHGPKFSA-N 0 3 293.407 2.793 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@H]1CCCOC1 ZINC000886789507 647137747 /nfs/dbraw/zinc/13/77/47/647137747.db2.gz WJVNDMDMBTYNMI-HUBLWGQQSA-N 0 3 297.370 2.624 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCc2cc(N)ccn2)cc1 ZINC000925772567 648316011 /nfs/dbraw/zinc/31/60/11/648316011.db2.gz UFECLLUJSWQRIK-CYBMUJFWSA-N 0 3 284.407 2.971 20 10 CFCDHN [O-]c1ccccc1[C@H](CCc1ccccc1)[NH2+][C@@H]1CNOC1 ZINC000925862344 648347886 /nfs/dbraw/zinc/34/78/86/648347886.db2.gz OUXMQYBPSJFZDV-WBVHZDCISA-N 0 3 298.386 2.559 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCOC1CC1)C[C@@H]1CCCO1 ZINC000929971168 649158138 /nfs/dbraw/zinc/15/81/38/649158138.db2.gz MSDQMKVPWMXPDI-INIZCTEOSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCOC1CC1)C[C@@H]1CCCO1 ZINC000929971168 649158141 /nfs/dbraw/zinc/15/81/41/649158141.db2.gz MSDQMKVPWMXPDI-INIZCTEOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCCC[N@H+](CCO[C@H]1CCOC1)Cc1ccccc1[O-] ZINC000930350418 649235929 /nfs/dbraw/zinc/23/59/29/649235929.db2.gz HNUXETVOSWXFMM-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN CCCC[N@@H+](CCO[C@H]1CCOC1)Cc1ccccc1[O-] ZINC000930350418 649235933 /nfs/dbraw/zinc/23/59/33/649235933.db2.gz HNUXETVOSWXFMM-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN COc1ccc(N2CCN([C@@H](C)C3CC3)CC2)c(OC)c1 ZINC000931531490 649448223 /nfs/dbraw/zinc/44/82/23/649448223.db2.gz DXYODFNXJDREQP-ZDUSSCGKSA-N 0 3 290.407 2.624 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H]2c2ccnn2C)cc1 ZINC000932266393 649571214 /nfs/dbraw/zinc/57/12/14/649571214.db2.gz XPIYQBJSVLMWSG-QGZVFWFLSA-N 0 3 284.407 2.823 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)CC(C)C)c1[O-] ZINC000305784754 651078563 /nfs/dbraw/zinc/07/85/63/651078563.db2.gz RFVVQVGRKRHHGC-ZDUSSCGKSA-N 0 3 271.788 2.851 20 10 CFCDHN C[N@H+](Cc1ccc(CO)cc1)Cc1ccccc1[O-] ZINC000305828026 651084243 /nfs/dbraw/zinc/08/42/43/651084243.db2.gz NDOWRAPHSRHMGL-UHFFFAOYSA-N 0 3 257.333 2.517 20 10 CFCDHN C[N@@H+](Cc1ccc(CO)cc1)Cc1ccccc1[O-] ZINC000305828026 651084244 /nfs/dbraw/zinc/08/42/44/651084244.db2.gz NDOWRAPHSRHMGL-UHFFFAOYSA-N 0 3 257.333 2.517 20 10 CFCDHN CC(=O)OC(C)(C)CCC[N@@H+](C)Cc1ccccc1[O-] ZINC001209155173 770005152 /nfs/dbraw/zinc/00/51/52/770005152.db2.gz HHUKEQRTQAMDMY-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN CC(=O)OC(C)(C)CCC[N@H+](C)Cc1ccccc1[O-] ZINC001209155173 770005164 /nfs/dbraw/zinc/00/51/64/770005164.db2.gz HHUKEQRTQAMDMY-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC001207166917 770543933 /nfs/dbraw/zinc/54/39/33/770543933.db2.gz GGDUBEMNXOYUSZ-STQMWFEESA-N 0 3 293.432 2.894 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC001207166917 770543944 /nfs/dbraw/zinc/54/39/44/770543944.db2.gz GGDUBEMNXOYUSZ-STQMWFEESA-N 0 3 293.432 2.894 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCCSCC2)c([O-])c1 ZINC000692437927 775237464 /nfs/dbraw/zinc/23/74/64/775237464.db2.gz XTELXSAZGVRQSE-GFCCVEGCSA-N 0 3 267.394 2.776 20 10 CFCDHN CCc1cccc(C[NH2+][C@H](CCO)C2CCCC2)c1[O-] ZINC000725065416 775261061 /nfs/dbraw/zinc/26/10/61/775261061.db2.gz NZAJTPMBSDFZLM-MRXNPFEDSA-N 0 3 277.408 2.985 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000722320602 776466393 /nfs/dbraw/zinc/46/63/93/776466393.db2.gz GMASMRCXULKBMV-ZFWWWQNUSA-N 0 3 265.328 2.579 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@H](C)c2ccccc2[O-])CCOC1 ZINC000722353203 776513816 /nfs/dbraw/zinc/51/38/16/776513816.db2.gz OOCWEIQQFVMNLK-CZUORRHYSA-N 0 3 279.380 2.627 20 10 CFCDHN Oc1ccc2ccccc2c1CN1CCc2ncncc2C1 ZINC001231590356 777270547 /nfs/dbraw/zinc/27/05/47/777270547.db2.gz VQJRVDROSRRBGR-UHFFFAOYSA-N 0 3 291.354 2.894 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@]2(CC2(F)F)C1 ZINC001231854104 777352731 /nfs/dbraw/zinc/35/27/31/777352731.db2.gz ZAQUHJUISINVID-HNNXBMFYSA-N 0 3 296.361 2.992 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@@H+](C)C[C@H]32)cc1Cl ZINC001231871091 777358733 /nfs/dbraw/zinc/35/87/33/777358733.db2.gz XZJLPHMIEIASSC-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@H+](C)C[C@H]32)cc1Cl ZINC001231871091 777358738 /nfs/dbraw/zinc/35/87/38/777358738.db2.gz XZJLPHMIEIASSC-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN COc1cc([O-])c(CN2CCC([NH+](C)C)CC2)cc1Cl ZINC001232266075 777499530 /nfs/dbraw/zinc/49/95/30/777499530.db2.gz QDPAIMMGEVPFTN-UHFFFAOYSA-N 0 3 298.814 2.580 20 10 CFCDHN Oc1cc(CN2C[C@@H]3C[C@H](C2)c2ccccc23)cc(O)c1O ZINC001233015163 777764165 /nfs/dbraw/zinc/76/41/65/777764165.db2.gz HUYYILVLUJPBAN-BETUJISGSA-N 0 3 297.354 2.890 20 10 CFCDHN CC(C)(C)c1ccc(O)c(CN2CC(C)(CO)C2)c1 ZINC001233284004 777864567 /nfs/dbraw/zinc/86/45/67/777864567.db2.gz DNBSAYLZWFTYIE-UHFFFAOYSA-N 0 3 263.381 2.504 20 10 CFCDHN COC(CN(C)Cc1cc(C(C)(C)C)ccc1O)OC ZINC001233286480 777867251 /nfs/dbraw/zinc/86/72/51/777867251.db2.gz VZGATUIXTBNRGH-UHFFFAOYSA-N 0 3 281.396 2.740 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CO)c1[O-] ZINC001233287804 777870166 /nfs/dbraw/zinc/87/01/66/777870166.db2.gz HVJFXPPBKBUESH-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@H]2CO)c1[O-] ZINC001233287804 777870174 /nfs/dbraw/zinc/87/01/74/777870174.db2.gz HVJFXPPBKBUESH-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN Oc1cc(O)c(CN(Cc2ccccc2)C2CC2)cc1O ZINC001233486275 777963336 /nfs/dbraw/zinc/96/33/36/777963336.db2.gz GJJQWXZSFHFVBH-UHFFFAOYSA-N 0 3 285.343 2.968 20 10 CFCDHN Oc1cc(O)c(CN2CCC3(CC(F)(F)C3)CC2)cc1O ZINC001233483414 777963757 /nfs/dbraw/zinc/96/37/57/777963757.db2.gz YQMCWSQEPFSRNR-UHFFFAOYSA-N 0 3 299.317 2.815 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3[C@@H]([NH3+])[C@@H]3C2)cc1Cl ZINC001235209215 778415692 /nfs/dbraw/zinc/41/56/92/778415692.db2.gz JOWPRGGZRBEOTO-HBYGRHMLSA-N 0 3 294.826 2.732 20 10 CFCDHN [O-]c1c(CN2CCC[C@@H]3[NH2+]C[C@H]32)cccc1-c1ccccc1 ZINC001235303297 778451303 /nfs/dbraw/zinc/45/13/03/778451303.db2.gz KMJLCXOHCVIDJF-ZWKOTPCHSA-N 0 3 294.398 2.995 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@@H]1O ZINC001235674636 778532803 /nfs/dbraw/zinc/53/28/03/778532803.db2.gz HIHGLRYBXHJLGP-WFASDCNBSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@@H]1O ZINC001235674636 778532805 /nfs/dbraw/zinc/53/28/05/778532805.db2.gz HIHGLRYBXHJLGP-WFASDCNBSA-N 0 3 277.408 2.892 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@](C)(CO)C2)c([O-])c1 ZINC001235676947 778533793 /nfs/dbraw/zinc/53/37/93/778533793.db2.gz YFNMYMIUHSGYIC-QGZVFWFLSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@](C)(CO)C2)c([O-])c1 ZINC001235676947 778533795 /nfs/dbraw/zinc/53/37/95/778533795.db2.gz YFNMYMIUHSGYIC-QGZVFWFLSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](CO)C2)c([O-])c1 ZINC001235676955 778534203 /nfs/dbraw/zinc/53/42/03/778534203.db2.gz YPKMNMMBCCRMMO-ZDUSSCGKSA-N 0 3 277.408 2.894 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@H](CO)C2)c([O-])c1 ZINC001235676955 778534204 /nfs/dbraw/zinc/53/42/04/778534204.db2.gz YPKMNMMBCCRMMO-ZDUSSCGKSA-N 0 3 277.408 2.894 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@@]2(C)CCC[NH2+]C2)cc1Cl ZINC001236207039 778735134 /nfs/dbraw/zinc/73/51/34/778735134.db2.gz NGZPBJOOYOENRL-HNNXBMFYSA-N 0 3 298.814 2.628 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN(C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236236711 778746830 /nfs/dbraw/zinc/74/68/30/778746830.db2.gz LNKPVEHVHVLWFE-CQSZACIVSA-N 0 3 280.799 2.762 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](CO)CC2)c([O-])c1 ZINC001236782538 778934039 /nfs/dbraw/zinc/93/40/39/778934039.db2.gz CBIMGCQDJJZEOW-AWEZNQCLSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](CO)CC2)c([O-])c1 ZINC001236782538 778934042 /nfs/dbraw/zinc/93/40/42/778934042.db2.gz CBIMGCQDJJZEOW-AWEZNQCLSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](C(=O)OC)CC[C@H]2C)c([O-])c1 ZINC001236782701 778934317 /nfs/dbraw/zinc/93/43/17/778934317.db2.gz DETRXKTTWCSLDR-IUODEOHRSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](C(=O)OC)CC[C@H]2C)c([O-])c1 ZINC001236782701 778934322 /nfs/dbraw/zinc/93/43/22/778934322.db2.gz DETRXKTTWCSLDR-IUODEOHRSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(CN2CCN(c3ccccn3)CC2)c(O)c1 ZINC001236784043 778934745 /nfs/dbraw/zinc/93/47/45/778934745.db2.gz REKASNYAAQJKKP-UHFFFAOYSA-N 0 3 297.402 2.672 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236786614 778935502 /nfs/dbraw/zinc/93/55/02/778935502.db2.gz DDAVSYJFNBNFDR-DZGCQCFKSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236786614 778935508 /nfs/dbraw/zinc/93/55/08/778935508.db2.gz DDAVSYJFNBNFDR-DZGCQCFKSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236785626 778935517 /nfs/dbraw/zinc/93/55/17/778935517.db2.gz LLAOAKHIGROFES-KRWDZBQOSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236785626 778935521 /nfs/dbraw/zinc/93/55/21/778935521.db2.gz LLAOAKHIGROFES-KRWDZBQOSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784014 778935890 /nfs/dbraw/zinc/93/58/90/778935890.db2.gz RDHLVZXYIPCKBT-CXAGYDPISA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784014 778935896 /nfs/dbraw/zinc/93/58/96/778935896.db2.gz RDHLVZXYIPCKBT-CXAGYDPISA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784233 778935936 /nfs/dbraw/zinc/93/59/36/778935936.db2.gz SCBCEAZAHDRGPO-LRDDRELGSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784233 778935946 /nfs/dbraw/zinc/93/59/46/778935946.db2.gz SCBCEAZAHDRGPO-LRDDRELGSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236787439 778937065 /nfs/dbraw/zinc/93/70/65/778937065.db2.gz VGDOVUOHJIILBK-INIZCTEOSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236787439 778937071 /nfs/dbraw/zinc/93/70/71/778937071.db2.gz VGDOVUOHJIILBK-INIZCTEOSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC001236794872 778940412 /nfs/dbraw/zinc/94/04/12/778940412.db2.gz QNDKFBNELRSKGH-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC001236794872 778940418 /nfs/dbraw/zinc/94/04/18/778940418.db2.gz QNDKFBNELRSKGH-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC001236810780 778947966 /nfs/dbraw/zinc/94/79/66/778947966.db2.gz JBDGYBIJOCNSFM-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC001236810780 778947969 /nfs/dbraw/zinc/94/79/69/778947969.db2.gz JBDGYBIJOCNSFM-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236809031 778949354 /nfs/dbraw/zinc/94/93/54/778949354.db2.gz SRIWZTYQSZJFSY-KRWDZBQOSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC001236809031 778949360 /nfs/dbraw/zinc/94/93/60/778949360.db2.gz SRIWZTYQSZJFSY-KRWDZBQOSA-N 0 3 291.391 2.712 20 10 CFCDHN CCCO[C@@H]1CC[N@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814188 778950204 /nfs/dbraw/zinc/95/02/04/778950204.db2.gz QHTPXXNKMVYBDK-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN CCCO[C@@H]1CC[N@@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814188 778950206 /nfs/dbraw/zinc/95/02/06/778950206.db2.gz QHTPXXNKMVYBDK-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[NH+]2CCC(C)(OC)CC2)c([O-])c1 ZINC001236818446 778951637 /nfs/dbraw/zinc/95/16/37/778951637.db2.gz MSTYACCAQDDCNM-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826503 778954718 /nfs/dbraw/zinc/95/47/18/778954718.db2.gz LKRDTKJKWQEWQS-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826503 778954723 /nfs/dbraw/zinc/95/47/23/778954723.db2.gz LKRDTKJKWQEWQS-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CC2(CC(O)C2)C1 ZINC001236826213 778955471 /nfs/dbraw/zinc/95/54/71/778955471.db2.gz INECNPZTOVNOJA-UHFFFAOYSA-N 0 3 269.344 2.502 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826502 778955512 /nfs/dbraw/zinc/95/55/12/778955512.db2.gz LKRDTKJKWQEWQS-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826502 778955514 /nfs/dbraw/zinc/95/55/14/778955514.db2.gz LKRDTKJKWQEWQS-HNNXBMFYSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827398 778956665 /nfs/dbraw/zinc/95/66/65/778956665.db2.gz RMCBJSJRPDKTGO-LRDDRELGSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827398 778956668 /nfs/dbraw/zinc/95/66/68/778956668.db2.gz RMCBJSJRPDKTGO-LRDDRELGSA-N 0 3 271.360 2.748 20 10 CFCDHN Oc1cc2ccccc2cc1CN1CCOC2(CC2)C1 ZINC001236835241 778959942 /nfs/dbraw/zinc/95/99/42/778959942.db2.gz FMFQIXMKNYJCLZ-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN CC(C)c1ccc(CN2CCN(C3CC3)CC2)c(O)c1 ZINC001237045977 778997117 /nfs/dbraw/zinc/99/71/17/778997117.db2.gz OATRATDBTAVEQY-UHFFFAOYSA-N 0 3 274.408 2.796 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@H](C)C2)c([O-])c1 ZINC001237046088 778998633 /nfs/dbraw/zinc/99/86/33/778998633.db2.gz PHMWLHAIDYGRMU-DOMZBBRYSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H](O)[C@H](C)C2)c([O-])c1 ZINC001237046088 778998637 /nfs/dbraw/zinc/99/86/37/778998637.db2.gz PHMWLHAIDYGRMU-DOMZBBRYSA-N 0 3 263.381 2.718 20 10 CFCDHN CC1C[NH+](Cc2ccc(OCC(F)(F)F)cc2[O-])C1 ZINC001237054063 779001550 /nfs/dbraw/zinc/00/15/50/779001550.db2.gz UTUKLZJXDGPBPQ-UHFFFAOYSA-N 0 3 275.270 2.785 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCSCC(F)(F)F ZINC000698882974 779071945 /nfs/dbraw/zinc/07/19/45/779071945.db2.gz AIXZRQKFEMXEAR-UHFFFAOYSA-N 0 3 283.290 2.916 20 10 CFCDHN Cc1cccc(O)c1CN1CCN(c2ncccc2C)CC1 ZINC001237484059 779118010 /nfs/dbraw/zinc/11/80/10/779118010.db2.gz ZUHPBYPXNXTQDX-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CCc1ncnc2c1CC[N@H+](Cc1c(C)cccc1[O-])CC2 ZINC001237488561 779119380 /nfs/dbraw/zinc/11/93/80/779119380.db2.gz NSGYNKWYBAFKSP-UHFFFAOYSA-N 0 3 297.402 2.654 20 10 CFCDHN CCc1ncnc2c1CC[N@@H+](Cc1c(C)cccc1[O-])CC2 ZINC001237488561 779119384 /nfs/dbraw/zinc/11/93/84/779119384.db2.gz NSGYNKWYBAFKSP-UHFFFAOYSA-N 0 3 297.402 2.654 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@H]2CCCC(=O)[C@@H]2C1 ZINC001237491600 779120199 /nfs/dbraw/zinc/12/01/99/779120199.db2.gz PXMCGYJMNUYOGM-TZMCWYRMSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@H]2CCCC(=O)[C@@H]2C1 ZINC001237491600 779120204 /nfs/dbraw/zinc/12/02/04/779120204.db2.gz PXMCGYJMNUYOGM-TZMCWYRMSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2cccnc2C1 ZINC001237493337 779120282 /nfs/dbraw/zinc/12/02/82/779120282.db2.gz XKUKOZHBZIVFSI-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN Oc1cccc2c1CN(Cc1ccn3nccc3c1)CC2 ZINC001237544642 779130785 /nfs/dbraw/zinc/13/07/85/779130785.db2.gz LXQUTSYABWBZFZ-UHFFFAOYSA-N 0 3 279.343 2.598 20 10 CFCDHN COc1cc(CN2CC3(C2)CCCC3)c(O)c(OC)c1 ZINC001237669652 779158423 /nfs/dbraw/zinc/15/84/23/779158423.db2.gz MKQHJSFNXUWTCZ-UHFFFAOYSA-N 0 3 277.364 2.785 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)C[C@@H]2C)c1[O-] ZINC001237685093 779161398 /nfs/dbraw/zinc/16/13/98/779161398.db2.gz FBAPLRKQFVUODX-GXFFZTMASA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)C[C@@H]2C)c1[O-] ZINC001237685093 779161401 /nfs/dbraw/zinc/16/14/01/779161401.db2.gz FBAPLRKQFVUODX-GXFFZTMASA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC001238063594 779242006 /nfs/dbraw/zinc/24/20/06/779242006.db2.gz ZHYPURHEXKDDQO-UHFFFAOYSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC001238063594 779242009 /nfs/dbraw/zinc/24/20/09/779242009.db2.gz ZHYPURHEXKDDQO-UHFFFAOYSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(CN2CC(c3cccnc3)C2)c1O ZINC001238071164 779246511 /nfs/dbraw/zinc/24/65/11/779246511.db2.gz UXBCCUGMMZPIQX-UHFFFAOYSA-N 0 3 272.323 2.834 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@]23CCOC3)c1[O-] ZINC001238071390 779247313 /nfs/dbraw/zinc/24/73/13/779247313.db2.gz WKMGFVHSNMWXFK-OAHLLOKOSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@]23CCOC3)c1[O-] ZINC001238071390 779247316 /nfs/dbraw/zinc/24/73/16/779247316.db2.gz WKMGFVHSNMWXFK-OAHLLOKOSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH2+]C(C)(C)C2)cc1Cl ZINC001235834048 779382734 /nfs/dbraw/zinc/38/27/34/779382734.db2.gz INFKNSLRNWDFML-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC001236783383 779637549 /nfs/dbraw/zinc/63/75/49/779637549.db2.gz LCDVHKWPVGYSBC-MRXNPFEDSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC001236783383 779637554 /nfs/dbraw/zinc/63/75/54/779637554.db2.gz LCDVHKWPVGYSBC-MRXNPFEDSA-N 0 3 263.381 2.692 20 10 CFCDHN CCOC(=O)C[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC001203550265 780006820 /nfs/dbraw/zinc/00/68/20/780006820.db2.gz OTHIVOJGCQLZCC-CYBMUJFWSA-N 0 3 277.364 2.557 20 10 CFCDHN CCOC(=O)C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC001203550265 780006825 /nfs/dbraw/zinc/00/68/25/780006825.db2.gz OTHIVOJGCQLZCC-CYBMUJFWSA-N 0 3 277.364 2.557 20 10 CFCDHN CC(C)(C)c1cccc(CN2CC(C)(CO)C2)c1O ZINC001143103522 780386210 /nfs/dbraw/zinc/38/62/10/780386210.db2.gz FBKBWMCLSRWWPC-UHFFFAOYSA-N 0 3 263.381 2.504 20 10 CFCDHN CCO[C@H]1CCN(Cc2cc(Cl)cc(OC)c2O)C1 ZINC000701660898 780821416 /nfs/dbraw/zinc/82/14/16/780821416.db2.gz GUVGRZSJAHIRRC-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN CN1CCC=C(c2ccn(Cc3ccccc3F)c(=O)c2)C1 ZINC001241571976 780989989 /nfs/dbraw/zinc/98/99/89/780989989.db2.gz MCYZAVGYVNTMPH-UHFFFAOYSA-N 0 3 298.361 2.755 20 10 CFCDHN [NH3+][C@H]1CCCCCN(Cc2c([O-])cccc2Cl)C1 ZINC000709011904 781287234 /nfs/dbraw/zinc/28/72/34/781287234.db2.gz SVDMRCRPRPAFJR-NSHDSACASA-N 0 3 268.788 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)c1 ZINC000711869008 781483118 /nfs/dbraw/zinc/48/31/18/781483118.db2.gz JDJZRHDGMLEARP-PBHICJAKSA-N 0 3 275.392 2.995 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183507844 282281920 /nfs/dbraw/zinc/28/19/20/282281920.db2.gz RKMOOZRHVWCONV-XHDPSFHLSA-N 0 3 251.370 2.840 20 10 CFCDHN CO[C@H](C[NH2+]Cc1cc(C)c(C)cc1[O-])C(C)C ZINC000072924774 346949752 /nfs/dbraw/zinc/94/97/52/346949752.db2.gz DSJOZJWWOCBNGD-OAHLLOKOSA-N 0 3 251.370 2.770 20 10 CFCDHN [O-]c1ccccc1C[N@H+](C[C@H]1CCCO1)C[C@@H]1CCCO1 ZINC000072952776 346952379 /nfs/dbraw/zinc/95/23/79/346952379.db2.gz DLTDGFUIQAWOFW-IYBDPMFKSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](C[C@H]1CCCO1)C[C@@H]1CCCO1 ZINC000072952776 346952381 /nfs/dbraw/zinc/95/23/81/346952381.db2.gz DLTDGFUIQAWOFW-IYBDPMFKSA-N 0 3 291.391 2.552 20 10 CFCDHN COc1cccc(CN(C)[C@H](CO)c2ccccc2)c1O ZINC000295086378 199337762 /nfs/dbraw/zinc/33/77/62/199337762.db2.gz RBFANWYKZAYIQU-OAHLLOKOSA-N 0 3 287.359 2.566 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H](CO)C(C)(C)C)c1[O-] ZINC000093821966 347685232 /nfs/dbraw/zinc/68/52/32/347685232.db2.gz RUXTVWHLSVDYDL-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c1[O-] ZINC000093821966 347685234 /nfs/dbraw/zinc/68/52/34/347685234.db2.gz RUXTVWHLSVDYDL-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN C[C@@H](CN1CCCCC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295767360 295907515 /nfs/dbraw/zinc/90/75/15/295907515.db2.gz ACSOFCLIYJWAEP-ZFWWWQNUSA-N 0 3 274.408 2.844 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)CCCO)c1ccccc1[O-] ZINC000294759321 199170479 /nfs/dbraw/zinc/17/04/79/199170479.db2.gz IXADLFUUGAASEP-GXTWGEPZSA-N 0 3 251.370 2.842 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](SC)C2)c1[O-] ZINC000294925346 199252376 /nfs/dbraw/zinc/25/23/76/199252376.db2.gz BGQXEJFYCKCCIJ-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](SC)C2)c1[O-] ZINC000294925346 199252377 /nfs/dbraw/zinc/25/23/77/199252377.db2.gz BGQXEJFYCKCCIJ-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CCCCO)c1 ZINC000294925291 199252622 /nfs/dbraw/zinc/25/26/22/199252622.db2.gz BEVJGQHTUGXIRJ-RYUDHWBXSA-N 0 3 267.369 2.603 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)Cc1cccc(F)c1)c1ccccc1[O-] ZINC000297338767 200153613 /nfs/dbraw/zinc/15/36/13/200153613.db2.gz OIEUWXOOGCABAG-SWLSCSKDSA-N 0 3 289.350 2.786 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297553547 200226223 /nfs/dbraw/zinc/22/62/23/200226223.db2.gz FUNXTQFTSOTDAY-HIFRSBDPSA-N 0 3 263.381 2.766 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CO)c1ccccc1)CC2 ZINC000297568324 200230438 /nfs/dbraw/zinc/23/04/38/200230438.db2.gz GLKHEWCDAQDPET-HUUCEWRRSA-N 0 3 269.344 2.703 20 10 CFCDHN C[C@H](NCC[S@](=O)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000127304288 299301285 /nfs/dbraw/zinc/30/12/85/299301285.db2.gz HHRMCFBNKHZVPJ-RNODOKPDSA-N 0 3 296.480 2.950 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1[O-] ZINC000037643959 372679536 /nfs/dbraw/zinc/67/95/36/372679536.db2.gz WIOIGWIIPLFCEA-ZFWWWQNUSA-N 0 3 262.397 2.775 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]Cc2ccccc2C)c1 ZINC000037718960 372693726 /nfs/dbraw/zinc/69/37/26/372693726.db2.gz DONRABKNXZSTNS-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCc1nn(C)c(CC)c1CN(C)Cc1ccccc1O ZINC000091974764 375073796 /nfs/dbraw/zinc/07/37/96/375073796.db2.gz QNPLOBCBPSQOSL-UHFFFAOYSA-N 0 3 287.407 2.883 20 10 CFCDHN Cc1noc(C2CC[NH+](Cc3cc(C)ccc3[O-])CC2)n1 ZINC000091836540 375066492 /nfs/dbraw/zinc/06/64/92/375066492.db2.gz DUOXAXXPMGLQJX-UHFFFAOYSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+]Cc1c([O-])cccc1Cl ZINC000113335808 376010827 /nfs/dbraw/zinc/01/08/27/376010827.db2.gz NVSGZDGKNHVGTL-NSHDSACASA-N 0 3 293.798 2.976 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(Cc3nccn3C)CC2)c1 ZINC000121797409 376907602 /nfs/dbraw/zinc/90/76/02/376907602.db2.gz YGOFXAWSCDRLRK-UHFFFAOYSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C)CN2CCCCC2)c1[O-] ZINC000124698372 377078117 /nfs/dbraw/zinc/07/81/17/377078117.db2.gz DKRUKAKEIMHRIM-AWEZNQCLSA-N 0 3 262.397 2.665 20 10 CFCDHN C[C@@H](O)C[C@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000127707053 377298079 /nfs/dbraw/zinc/29/80/79/377298079.db2.gz VFGBZKZZPXOBAN-TZMCWYRMSA-N 0 3 280.387 2.627 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000129920511 377489632 /nfs/dbraw/zinc/48/96/32/377489632.db2.gz DMRWFWGGLCYIIS-CYBMUJFWSA-N 0 3 294.826 2.963 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)[C@H](C)COC)c([O-])c1 ZINC000132685272 377867412 /nfs/dbraw/zinc/86/74/12/377867412.db2.gz LZLWSDOJRRTEOK-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)[C@H](C)COC)c([O-])c1 ZINC000132685272 377867416 /nfs/dbraw/zinc/86/74/16/377867416.db2.gz LZLWSDOJRRTEOK-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCCC(=O)NC(C)C)cc1 ZINC000133798508 377958143 /nfs/dbraw/zinc/95/81/43/377958143.db2.gz YDDIOFUNZSQONW-AWEZNQCLSA-N 0 3 291.439 2.708 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+]Cc2ccccc2[O-])C12CCC2 ZINC000135200138 378097142 /nfs/dbraw/zinc/09/71/42/378097142.db2.gz XTHWKOYTKYFVJY-GJZGRUSLSA-N 0 3 261.365 2.830 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCSC(F)(F)F ZINC000136401238 378198672 /nfs/dbraw/zinc/19/86/72/378198672.db2.gz WOGINSRNLYOUJY-UHFFFAOYSA-N 0 3 251.273 2.735 20 10 CFCDHN CC(C)([NH2+]Cc1ccccc1[O-])C(=O)NCC1CCCC1 ZINC000136037676 378176846 /nfs/dbraw/zinc/17/68/46/378176846.db2.gz DVTBXZVKGABENP-UHFFFAOYSA-N 0 3 290.407 2.567 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)c1 ZINC000151438824 378326565 /nfs/dbraw/zinc/32/65/65/378326565.db2.gz KHQGBPNBWILCPU-HOCLYGCPSA-N 0 3 293.432 2.845 20 10 CFCDHN C[C@H](NCc1ccc(C(N)=O)cc1)c1ccc(N(C)C)cc1 ZINC000154667859 378587737 /nfs/dbraw/zinc/58/77/37/378587737.db2.gz QOGAJPRNTDCXQI-ZDUSSCGKSA-N 0 3 297.402 2.702 20 10 CFCDHN C[S@@](=O)C[C@H](NCc1ccccc1O)c1ccccc1 ZINC000154686907 378590075 /nfs/dbraw/zinc/59/00/75/378590075.db2.gz IUEKJIBRRFXKOZ-YWZLYKJASA-N 0 3 289.400 2.602 20 10 CFCDHN Oc1ccc(F)cc1CN1CC(Cc2ccco2)C1 ZINC000529649256 383741607 /nfs/dbraw/zinc/74/16/07/383741607.db2.gz OZEBEYNDSLLAHV-UHFFFAOYSA-N 0 3 261.296 2.799 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCN(C(C)C)C1=O ZINC000175284058 380038243 /nfs/dbraw/zinc/03/82/43/380038243.db2.gz ZGLCEDDBLBMZGE-OAHLLOKOSA-N 0 3 290.407 2.614 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCN(C(C)C)C1=O ZINC000175284058 380038255 /nfs/dbraw/zinc/03/82/55/380038255.db2.gz ZGLCEDDBLBMZGE-OAHLLOKOSA-N 0 3 290.407 2.614 20 10 CFCDHN COC(=O)C[C@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000178776521 380485576 /nfs/dbraw/zinc/48/55/76/380485576.db2.gz UOLRTRJVWQHFJE-CQSZACIVSA-N 0 3 277.364 2.537 20 10 CFCDHN COC(=O)C[C@H]1CCC[N@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000178776521 380485579 /nfs/dbraw/zinc/48/55/79/380485579.db2.gz UOLRTRJVWQHFJE-CQSZACIVSA-N 0 3 277.364 2.537 20 10 CFCDHN Cc1cccc(CN2CCN(c3cccc(O)c3)CC2)c1O ZINC000179621227 380564885 /nfs/dbraw/zinc/56/48/85/380564885.db2.gz WHGJNJKVGOTOCH-UHFFFAOYSA-N 0 3 298.386 2.728 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(c2ccccc2)C1=O)c1ccccc1[O-] ZINC000179875113 380589750 /nfs/dbraw/zinc/58/97/50/380589750.db2.gz OOAQJIFXKZTODD-CJNGLKHVSA-N 0 3 296.370 2.848 20 10 CFCDHN COc1cccc2c1CC[N@H+](Cc1ccccc1[O-])C2 ZINC000180784596 380699292 /nfs/dbraw/zinc/69/92/92/380699292.db2.gz WBCWOGLLGGEGJZ-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1cccc2c1CC[N@@H+](Cc1ccccc1[O-])C2 ZINC000180784596 380699294 /nfs/dbraw/zinc/69/92/94/380699294.db2.gz WBCWOGLLGGEGJZ-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@](C)(O)C2)c1[O-] ZINC000180378169 380649457 /nfs/dbraw/zinc/64/94/57/380649457.db2.gz CBCNYNLGEUHWDP-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@](C)(O)C2)c1[O-] ZINC000180378169 380649460 /nfs/dbraw/zinc/64/94/60/380649460.db2.gz CBCNYNLGEUHWDP-CQSZACIVSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC2(O)CCOCC2)c([O-])c1C ZINC000287761972 380931639 /nfs/dbraw/zinc/93/16/39/380931639.db2.gz ZWOGJJRHXXYVDF-CQSZACIVSA-N 0 3 293.407 2.591 20 10 CFCDHN CCOCc1cc(CN[C@@H]2CCCOC2)ccc1OC ZINC000288438951 381013254 /nfs/dbraw/zinc/01/32/54/381013254.db2.gz CCJHKRAGWIURGW-OAHLLOKOSA-N 0 3 279.380 2.500 20 10 CFCDHN C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1[O-] ZINC000296040728 381225392 /nfs/dbraw/zinc/22/53/92/381225392.db2.gz UHGJTPYKBZVVBZ-FUDCBSFHSA-N 0 3 260.381 2.668 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1)CC2 ZINC000296045523 381227847 /nfs/dbraw/zinc/22/78/47/381227847.db2.gz QWWGUFFBFYHBMB-HOCLYGCPSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccccc1[O-] ZINC000183431224 381271132 /nfs/dbraw/zinc/27/11/32/381271132.db2.gz RUVXMIYEBGIBJL-CYBMUJFWSA-N 0 3 274.408 2.917 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cc1O ZINC000183480711 381277119 /nfs/dbraw/zinc/27/71/19/381277119.db2.gz LKWUAVWSHFOYGT-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN C[C@@H]([NH2+]CCN(C)C(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183484087 381277773 /nfs/dbraw/zinc/27/77/73/381277773.db2.gz DCPDLWQZTXNAIB-GFCCVEGCSA-N 0 3 294.395 2.910 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1ccccc1[O-] ZINC000183549139 381285816 /nfs/dbraw/zinc/28/58/16/381285816.db2.gz NMIGXHKNLQPSPP-RWMBFGLXSA-N 0 3 260.381 2.668 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CCCO)c([O-])c1 ZINC000296440738 381397161 /nfs/dbraw/zinc/39/71/61/381397161.db2.gz MGZKXJCQKZLYML-CHWSQXEVSA-N 0 3 251.370 2.760 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCO[C@@]2(CCOC2)C1 ZINC000184286123 381397382 /nfs/dbraw/zinc/39/73/82/381397382.db2.gz ZCFBEVWBDNXCLD-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC000184286123 381397389 /nfs/dbraw/zinc/39/73/89/381397389.db2.gz ZCFBEVWBDNXCLD-SFHVURJKSA-N 0 3 299.370 2.537 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)c1 ZINC000184731949 381471628 /nfs/dbraw/zinc/47/16/28/381471628.db2.gz HTENFGGQJGSJLJ-OAHLLOKOSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](Cc3nccn3C)C2)c1 ZINC000184731949 381471635 /nfs/dbraw/zinc/47/16/35/381471635.db2.gz HTENFGGQJGSJLJ-OAHLLOKOSA-N 0 3 299.418 2.889 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C(C)C ZINC000296617319 381474273 /nfs/dbraw/zinc/47/42/73/381474273.db2.gz WQTVOFUIEWASIN-CJNGLKHVSA-N 0 3 292.423 2.854 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c1[O-] ZINC000184695421 381462469 /nfs/dbraw/zinc/46/24/69/381462469.db2.gz URFCIHLHQOTLLU-GWCFXTLKSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c1[O-] ZINC000184695421 381462473 /nfs/dbraw/zinc/46/24/73/381462473.db2.gz URFCIHLHQOTLLU-GWCFXTLKSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@]3(CCOC3)C2)c1[O-] ZINC000184701017 381463017 /nfs/dbraw/zinc/46/30/17/381463017.db2.gz BBYCEUFRCXIQHF-OAHLLOKOSA-N 0 3 297.782 2.667 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@]3(CCOC3)C2)c1[O-] ZINC000184701017 381463022 /nfs/dbraw/zinc/46/30/22/381463022.db2.gz BBYCEUFRCXIQHF-OAHLLOKOSA-N 0 3 297.782 2.667 20 10 CFCDHN CC[C@@H](C[NH2+][C@@H](C)c1cc(OC)ccc1[O-])N1CCCC1 ZINC000184990820 381507162 /nfs/dbraw/zinc/50/71/62/381507162.db2.gz NLXDVMXUTMLREX-KBPBESRZSA-N 0 3 292.423 2.926 20 10 CFCDHN C[C@@H](O)CC(C)(C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296815085 381545211 /nfs/dbraw/zinc/54/52/11/381545211.db2.gz MAAXENINJISPJZ-DGCLKSJQSA-N 0 3 263.381 2.766 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c1 ZINC000185368796 381613248 /nfs/dbraw/zinc/61/32/48/381613248.db2.gz URCWCPYHCQKPPN-VXGBXAGGSA-N 0 3 278.396 2.534 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H](c3ccncn3)C2)cc1 ZINC000371412335 381618029 /nfs/dbraw/zinc/61/80/29/381618029.db2.gz UPUPKDSPYIDETE-MRXNPFEDSA-N 0 3 296.418 2.922 20 10 CFCDHN CCn1cc(CNCc2c(C)c3ccccc3n2C)cn1 ZINC000355123270 381627220 /nfs/dbraw/zinc/62/72/20/381627220.db2.gz NGBSOXHSCLMHNB-UHFFFAOYSA-N 0 3 282.391 2.993 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c1[O-] ZINC000371488987 381642479 /nfs/dbraw/zinc/64/24/79/381642479.db2.gz MMPWAYXZSSCXGI-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@H]3CC[N@H+](C)[C@@H]3C2)c1[O-] ZINC000371488987 381642485 /nfs/dbraw/zinc/64/24/85/381642485.db2.gz MMPWAYXZSSCXGI-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C[C@@H](C)O)c([O-])c1 ZINC000185521709 381656234 /nfs/dbraw/zinc/65/62/34/381656234.db2.gz PCEFRUCAGHUJDQ-XQQFMLRXSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)C[C@@H](C)O)c1 ZINC000185521022 381657107 /nfs/dbraw/zinc/65/71/07/381657107.db2.gz YQSKMEWFMZRABK-XQQFMLRXSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2CN(C)Cc3ccccc32)c1 ZINC000359894942 381663340 /nfs/dbraw/zinc/66/33/40/381663340.db2.gz FYKVGHJYEFTYKQ-KRWDZBQOSA-N 0 3 298.386 2.677 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCO[C@H]2CCOC2)c([O-])c1 ZINC000185705076 381709516 /nfs/dbraw/zinc/70/95/16/381709516.db2.gz CDWFXFYTDJPQNA-KGLIPLIRSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c([O-])c1C ZINC000359963512 381700648 /nfs/dbraw/zinc/70/06/48/381700648.db2.gz ZRVGYSPWYAFYNE-GXTWGEPZSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CO[C@@H]2CCOC2)c([O-])c1 ZINC000185673766 381701002 /nfs/dbraw/zinc/70/10/02/381701002.db2.gz NGKKNCKVCXHJKE-MELADBBJSA-N 0 3 279.380 2.545 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)C2CCOCC2)c1 ZINC000185782508 381732149 /nfs/dbraw/zinc/73/21/49/381732149.db2.gz MWPHNMRQSITRFD-RYUDHWBXSA-N 0 3 279.380 2.867 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c([O-])c1 ZINC000185736496 381718756 /nfs/dbraw/zinc/71/87/56/381718756.db2.gz JYXKQIPHPAOSJM-MCIONIFRSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])[nH]n1 ZINC000186131679 381830259 /nfs/dbraw/zinc/83/02/59/381830259.db2.gz ZBPPQMHBZPDLPM-GXSJLCMTSA-N 0 3 277.343 2.845 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])n[nH]1 ZINC000186131679 381830269 /nfs/dbraw/zinc/83/02/69/381830269.db2.gz ZBPPQMHBZPDLPM-GXSJLCMTSA-N 0 3 277.343 2.845 20 10 CFCDHN C[C@H]([NH2+]CC1(C)OCCO1)c1cc2c(cc1[O-])CCCC2 ZINC000186211890 381854130 /nfs/dbraw/zinc/85/41/30/381854130.db2.gz RAQHQPDLBKVRHG-LBPRGKRZSA-N 0 3 291.391 2.685 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cc(F)ccc1[O-])OC ZINC000292830482 381856442 /nfs/dbraw/zinc/85/64/42/381856442.db2.gz RDIMKGFWAUPCHQ-UHFFFAOYSA-N 0 3 255.333 2.826 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@H](CC)c2ccccc2[O-])C1 ZINC000186424568 381907446 /nfs/dbraw/zinc/90/74/46/381907446.db2.gz VKSCDHSRDCXONR-GXTWGEPZSA-N 0 3 292.379 2.664 20 10 CFCDHN Cn1ccnc1[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000373227636 381955885 /nfs/dbraw/zinc/95/58/85/381955885.db2.gz KNOFYVWSBQIBTC-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1ccnc1[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000373227636 381955890 /nfs/dbraw/zinc/95/58/90/381955890.db2.gz KNOFYVWSBQIBTC-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H]3OCC[C@H]32)c([O-])c1 ZINC000373482767 382014671 /nfs/dbraw/zinc/01/46/71/382014671.db2.gz HUPKZJLXSOISGJ-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H]3OCC[C@H]32)c([O-])c1 ZINC000373482767 382014676 /nfs/dbraw/zinc/01/46/76/382014676.db2.gz HUPKZJLXSOISGJ-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000373535434 382018917 /nfs/dbraw/zinc/01/89/17/382018917.db2.gz REIWGUKNBRYKSQ-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000373535434 382018927 /nfs/dbraw/zinc/01/89/27/382018927.db2.gz REIWGUKNBRYKSQ-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000375252480 382073816 /nfs/dbraw/zinc/07/38/16/382073816.db2.gz IPMIPJOUEMTUAU-MLGOLLRUSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000375252480 382073823 /nfs/dbraw/zinc/07/38/23/382073823.db2.gz IPMIPJOUEMTUAU-MLGOLLRUSA-N 0 3 277.364 2.574 20 10 CFCDHN C[C@@H]1[N@H+](Cc2ccccc2[O-])CCC12CCOCC2 ZINC000375240468 382074310 /nfs/dbraw/zinc/07/43/10/382074310.db2.gz XIAUKKUOYITJNK-ZDUSSCGKSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H]1[N@@H+](Cc2ccccc2[O-])CCC12CCOCC2 ZINC000375240468 382074314 /nfs/dbraw/zinc/07/43/14/382074314.db2.gz XIAUKKUOYITJNK-ZDUSSCGKSA-N 0 3 261.365 2.783 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H]3COC[C@H]32)c([O-])c1 ZINC000375703792 382097772 /nfs/dbraw/zinc/09/77/72/382097772.db2.gz JJZCVYCTXIUCIJ-GOEBONIOSA-N 0 3 291.391 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H]3COC[C@H]32)c([O-])c1 ZINC000375703792 382097778 /nfs/dbraw/zinc/09/77/78/382097778.db2.gz JJZCVYCTXIUCIJ-GOEBONIOSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCN2C)c([O-])c1 ZINC000293586075 382186114 /nfs/dbraw/zinc/18/61/14/382186114.db2.gz FFRAAUOYGZIPFF-KGLIPLIRSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCCN2C)c([O-])c1 ZINC000293586077 382186084 /nfs/dbraw/zinc/18/60/84/382186084.db2.gz FFRAAUOYGZIPFF-UONOGXRCSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCN2CCSCC2)c([O-])c1 ZINC000293809904 382288568 /nfs/dbraw/zinc/28/85/68/382288568.db2.gz RONNREMPSNQERX-AWEZNQCLSA-N 0 3 294.464 2.708 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000377236949 382240341 /nfs/dbraw/zinc/24/03/41/382240341.db2.gz GWXLGRCVXJWKNJ-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000377236949 382240347 /nfs/dbraw/zinc/24/03/47/382240347.db2.gz GWXLGRCVXJWKNJ-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN COCC1(CC[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000293717608 382247625 /nfs/dbraw/zinc/24/76/25/382247625.db2.gz SYHAKTUGSBDDQG-UHFFFAOYSA-N 0 3 267.344 2.828 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000293728705 382255140 /nfs/dbraw/zinc/25/51/40/382255140.db2.gz OFDYQHCGTSAMCP-QWHCGFSZSA-N 0 3 278.396 2.595 20 10 CFCDHN C[C@]1(C[NH2+]Cc2ccccc2[O-])CCO[C@@H]1C1CC1 ZINC000364070133 382257899 /nfs/dbraw/zinc/25/78/99/382257899.db2.gz BGJORNHCPDBMCQ-HZPDHXFCSA-N 0 3 261.365 2.687 20 10 CFCDHN CCC[C@H](C[NH2+][C@@H](C)c1cc(OC)ccc1[O-])OC ZINC000293749248 382263469 /nfs/dbraw/zinc/26/34/69/382263469.db2.gz TWPNDWVLZJAUGO-WCQYABFASA-N 0 3 267.369 2.867 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000293767995 382271110 /nfs/dbraw/zinc/27/11/10/382271110.db2.gz RVRAUQLEBMEVBV-KGLIPLIRSA-N 0 3 292.423 2.904 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CC[C@H](O)C2)c1[O-] ZINC000187982626 382314808 /nfs/dbraw/zinc/31/48/08/382314808.db2.gz RLNDOCHHNXJNRL-GWCFXTLKSA-N 0 3 269.772 2.605 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000364637108 382345472 /nfs/dbraw/zinc/34/54/72/382345472.db2.gz NYQMFFMYEVKOPR-MELADBBJSA-N 0 3 291.391 2.820 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000364637108 382345476 /nfs/dbraw/zinc/34/54/76/382345476.db2.gz NYQMFFMYEVKOPR-MELADBBJSA-N 0 3 291.391 2.820 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000365467518 382398704 /nfs/dbraw/zinc/39/87/04/382398704.db2.gz HEKCSWATIBVKGH-CQSZACIVSA-N 0 3 282.815 2.962 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000188249468 382377078 /nfs/dbraw/zinc/37/70/78/382377078.db2.gz PTTYVWJCQURZRA-MRXNPFEDSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)c1 ZINC000294108791 382418294 /nfs/dbraw/zinc/41/82/94/382418294.db2.gz SODYMHUDSDCNNS-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c1 ZINC000294108791 382418299 /nfs/dbraw/zinc/41/82/99/382418299.db2.gz SODYMHUDSDCNNS-QGZVFWFLSA-N 0 3 293.407 2.631 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCOC[C@H](C)C2)c1[O-] ZINC000378445761 382463085 /nfs/dbraw/zinc/46/30/85/382463085.db2.gz WHZRAXAFDBKZOG-SNVBAGLBSA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCOC[C@H](C)C2)c1[O-] ZINC000378445761 382463086 /nfs/dbraw/zinc/46/30/86/382463086.db2.gz WHZRAXAFDBKZOG-SNVBAGLBSA-N 0 3 269.772 2.822 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000378499017 382474611 /nfs/dbraw/zinc/47/46/11/382474611.db2.gz SSJXITOTUNJKOL-CFVMTHIKSA-N 0 3 279.355 2.777 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000378499017 382474617 /nfs/dbraw/zinc/47/46/17/382474617.db2.gz SSJXITOTUNJKOL-CFVMTHIKSA-N 0 3 279.355 2.777 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000378637758 382497620 /nfs/dbraw/zinc/49/76/20/382497620.db2.gz OKCSHOCWIQGADE-AWEZNQCLSA-N 0 3 286.350 2.991 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000378637758 382497623 /nfs/dbraw/zinc/49/76/23/382497623.db2.gz OKCSHOCWIQGADE-AWEZNQCLSA-N 0 3 286.350 2.991 20 10 CFCDHN CCOCc1cc(CN[C@H]2CCOC2(C)C)ccc1OC ZINC000294802560 382528197 /nfs/dbraw/zinc/52/81/97/382528197.db2.gz NCDQNNOMTBKVEE-INIZCTEOSA-N 0 3 293.407 2.889 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000190221438 382657702 /nfs/dbraw/zinc/65/77/02/382657702.db2.gz RHGFDIBPYWKMBY-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000190221438 382657704 /nfs/dbraw/zinc/65/77/04/382657704.db2.gz RHGFDIBPYWKMBY-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCC2(C)OCCCO2)cc1 ZINC000190663801 382676848 /nfs/dbraw/zinc/67/68/48/382676848.db2.gz JCNWVGLATREWBB-CQSZACIVSA-N 0 3 292.423 2.946 20 10 CFCDHN C[C@@H]1CN2CCCC[C@H]2C[N@@H+]1Cc1cccc(F)c1[O-] ZINC000252780313 383434317 /nfs/dbraw/zinc/43/43/17/383434317.db2.gz SRYYGSGQIAFOEU-OCCSQVGLSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@@H]1CN2CCCC[C@H]2C[N@H+]1Cc1cccc(F)c1[O-] ZINC000252780313 383434325 /nfs/dbraw/zinc/43/43/25/383434325.db2.gz SRYYGSGQIAFOEU-OCCSQVGLSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@H]1CC[C@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000252962724 383439755 /nfs/dbraw/zinc/43/97/55/383439755.db2.gz PJDOYRXFPXVRKD-UMSPYCQHSA-N 0 3 263.337 2.789 20 10 CFCDHN CC[C@H](N[C@H]1CC[NH2+]C12CCC2)c1ccc(F)cc1[O-] ZINC000530215905 383768746 /nfs/dbraw/zinc/76/87/46/383768746.db2.gz KDGVPNIYRWGAQJ-ZFWWWQNUSA-N 0 3 278.371 2.857 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCNC12CCC2)c1ccc(F)cc1[O-] ZINC000530215905 383768749 /nfs/dbraw/zinc/76/87/49/383768749.db2.gz KDGVPNIYRWGAQJ-ZFWWWQNUSA-N 0 3 278.371 2.857 20 10 CFCDHN CC(C)(O)CC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000267387504 384376850 /nfs/dbraw/zinc/37/68/50/384376850.db2.gz CEMOMLNKAKHXHF-HNNXBMFYSA-N 0 3 293.407 2.534 20 10 CFCDHN CC(C)(O)CC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000267387504 384376856 /nfs/dbraw/zinc/37/68/56/384376856.db2.gz CEMOMLNKAKHXHF-HNNXBMFYSA-N 0 3 293.407 2.534 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H]2CCC(F)(F)C2)c1 ZINC000281278050 385189786 /nfs/dbraw/zinc/18/97/86/385189786.db2.gz ZAZPQTOOENBZCP-JTQLQIEISA-N 0 3 271.307 2.926 20 10 CFCDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c(O)c1C ZINC000281646447 385199804 /nfs/dbraw/zinc/19/98/04/385199804.db2.gz PIDPQFXXRQGQPK-KBPBESRZSA-N 0 3 290.407 2.671 20 10 CFCDHN C[N@H+](CCCO)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000281679384 385199980 /nfs/dbraw/zinc/19/99/80/385199980.db2.gz FASRNPSLRYCFLQ-UHFFFAOYSA-N 0 3 271.360 2.873 20 10 CFCDHN C[N@@H+](CCCO)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000281679384 385199992 /nfs/dbraw/zinc/19/99/92/385199992.db2.gz FASRNPSLRYCFLQ-UHFFFAOYSA-N 0 3 271.360 2.873 20 10 CFCDHN CO[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000282123059 385219085 /nfs/dbraw/zinc/21/90/85/385219085.db2.gz AYCKHJATAJYONJ-JSGCOSHPSA-N 0 3 280.387 2.891 20 10 CFCDHN CC(C)N(CC(N)=O)Cc1cc(-c2ccccc2)ccc1O ZINC000271042972 385315655 /nfs/dbraw/zinc/31/56/55/385315655.db2.gz PJVYHIUOPNSLBW-UHFFFAOYSA-N 0 3 298.386 2.755 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCC2([S@@](C)=O)CC2)cc1 ZINC000282279001 385268585 /nfs/dbraw/zinc/26/85/85/385268585.db2.gz KVZPXQAWRRRCGK-ZUOKHONESA-N 0 3 294.464 2.704 20 10 CFCDHN CCC[N@H+](CCn1ccnc1C)Cc1ccccc1[O-] ZINC000270932084 385272898 /nfs/dbraw/zinc/27/28/98/385272898.db2.gz WVPCKNYWDHSXAU-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN CCC[N@@H+](CCn1ccnc1C)Cc1ccccc1[O-] ZINC000270932084 385272903 /nfs/dbraw/zinc/27/29/03/385272903.db2.gz WVPCKNYWDHSXAU-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NC1CC1 ZINC000282547783 385339314 /nfs/dbraw/zinc/33/93/14/385339314.db2.gz WVIJVWQHVNHARL-CYBMUJFWSA-N 0 3 290.407 2.661 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NC1CC1 ZINC000282547783 385339319 /nfs/dbraw/zinc/33/93/19/385339319.db2.gz WVIJVWQHVNHARL-CYBMUJFWSA-N 0 3 290.407 2.661 20 10 CFCDHN Cc1cccc(CN2CCC[C@H]2[C@H](O)C(F)(F)F)c1O ZINC000271751026 385390093 /nfs/dbraw/zinc/39/00/93/385390093.db2.gz VIGGXKVFJCYMGW-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)c1[O-] ZINC000271751026 385390097 /nfs/dbraw/zinc/39/00/97/385390097.db2.gz VIGGXKVFJCYMGW-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)c1[O-] ZINC000271751026 385390099 /nfs/dbraw/zinc/39/00/99/385390099.db2.gz VIGGXKVFJCYMGW-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN COc1ccc([C@@H](CO)[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000271460149 385383029 /nfs/dbraw/zinc/38/30/29/385383029.db2.gz WZWMGWIUMKLCFS-MRXNPFEDSA-N 0 3 287.359 2.566 20 10 CFCDHN COc1ccc([C@@H](CO)[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000271460149 385383031 /nfs/dbraw/zinc/38/30/31/385383031.db2.gz WZWMGWIUMKLCFS-MRXNPFEDSA-N 0 3 287.359 2.566 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H]2CCO[C@H](C)C2)cc1C ZINC000271554454 385384984 /nfs/dbraw/zinc/38/49/84/385384984.db2.gz UZCRGCONNAAHST-ZIAGYGMSSA-N 0 3 263.381 2.914 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1O ZINC000271820783 385393686 /nfs/dbraw/zinc/39/36/86/385393686.db2.gz KNTNFKXMMTVCNA-GWCFXTLKSA-N 0 3 269.772 2.557 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1O ZINC000271820783 385393690 /nfs/dbraw/zinc/39/36/90/385393690.db2.gz KNTNFKXMMTVCNA-GWCFXTLKSA-N 0 3 269.772 2.557 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1O ZINC000271820788 385394342 /nfs/dbraw/zinc/39/43/42/385394342.db2.gz KNTNFKXMMTVCNA-MFKMUULPSA-N 0 3 269.772 2.557 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1O ZINC000271820788 385394346 /nfs/dbraw/zinc/39/43/46/385394346.db2.gz KNTNFKXMMTVCNA-MFKMUULPSA-N 0 3 269.772 2.557 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@](C)(CO)C2CCCCC2)c1 ZINC000271873175 385394962 /nfs/dbraw/zinc/39/49/62/385394962.db2.gz YNEWKEJCIQFNIX-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN Cc1cccc(CN[C@@H]2CCCc3nn(C)cc32)c1O ZINC000283126732 385439796 /nfs/dbraw/zinc/43/97/96/385439796.db2.gz VSJLXGSBOPOTNI-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2CCCc3nn(C)cc32)c1[O-] ZINC000283126732 385439802 /nfs/dbraw/zinc/43/98/02/385439802.db2.gz VSJLXGSBOPOTNI-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1cc([C@H]2CCC[N@H+](Cc3ccccc3[O-])C2)[nH]n1 ZINC000283090694 385434989 /nfs/dbraw/zinc/43/49/89/385434989.db2.gz SDEHQAYMORRASU-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)[nH]n1 ZINC000283090694 385434993 /nfs/dbraw/zinc/43/49/93/385434993.db2.gz SDEHQAYMORRASU-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n[nH]1 ZINC000283090694 385434996 /nfs/dbraw/zinc/43/49/96/385434996.db2.gz SDEHQAYMORRASU-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n[nH]1 ZINC000283090694 385434998 /nfs/dbraw/zinc/43/49/98/385434998.db2.gz SDEHQAYMORRASU-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCn2ccnc2)c([O-])c1 ZINC000284197354 385546003 /nfs/dbraw/zinc/54/60/03/385546003.db2.gz RXUYOAFVEICQBR-ZDUSSCGKSA-N 0 3 259.353 2.556 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H](C)CCCO)c([O-])c1 ZINC000284311441 385547265 /nfs/dbraw/zinc/54/72/65/385547265.db2.gz ZHKFDOLPAFKQKE-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H](C)CN2CCCC2=O)c([O-])c1 ZINC000284275184 385547832 /nfs/dbraw/zinc/54/78/32/385547832.db2.gz XBSNJHLSJZNNCW-KGLIPLIRSA-N 0 3 290.407 2.671 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000285003875 385551430 /nfs/dbraw/zinc/55/14/30/385551430.db2.gz GXSINURAIKUWFK-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285321038 385553790 /nfs/dbraw/zinc/55/37/90/385553790.db2.gz TVYVWENRLXMJSN-TUBUQKNSSA-N 0 3 293.407 2.590 20 10 CFCDHN Cc1cccc(CNCc2ccnc(OC(F)F)c2)c1O ZINC000285271295 385553899 /nfs/dbraw/zinc/55/38/99/385553899.db2.gz ULBMHUPKQQJPNL-UHFFFAOYSA-N 0 3 294.301 2.987 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000285320331 385554576 /nfs/dbraw/zinc/55/45/76/385554576.db2.gz WXGNAFFLJHMCFM-CABCVRRESA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000285320331 385554578 /nfs/dbraw/zinc/55/45/78/385554578.db2.gz WXGNAFFLJHMCFM-CABCVRRESA-N 0 3 261.365 2.844 20 10 CFCDHN CC(C)[C@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000272682450 385588616 /nfs/dbraw/zinc/58/86/16/385588616.db2.gz VQJSZNZGMXNJIY-UKRRQHHQSA-N 0 3 267.344 2.825 20 10 CFCDHN Cc1ccc([C@H](C)NC[C@@](C)(O)C(F)(F)F)c(O)c1C ZINC000273349501 385676880 /nfs/dbraw/zinc/67/68/80/385676880.db2.gz BLSWJFSGGVIYQP-GXFFZTMASA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1C ZINC000273349501 385676884 /nfs/dbraw/zinc/67/68/84/385676884.db2.gz BLSWJFSGGVIYQP-GXFFZTMASA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@@H](C)NC[C@@H](O)C(F)(F)F)c(O)c1C ZINC000273306108 385676899 /nfs/dbraw/zinc/67/68/99/385676899.db2.gz CWMKCMMHPHBHAC-MWLCHTKSSA-N 0 3 277.286 2.583 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@@H]2C)c([O-])c1 ZINC000273368887 385679359 /nfs/dbraw/zinc/67/93/59/385679359.db2.gz CANHCWJABDTMPK-HEHGZKQESA-N 0 3 274.408 2.834 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCN2CCCC2=O)c([O-])c1C ZINC000273421084 385682412 /nfs/dbraw/zinc/68/24/12/385682412.db2.gz SBXWRIDHZGDHPX-CQSZACIVSA-N 0 3 290.407 2.672 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2ccccc2[O-])C[C@@H]1O ZINC000273446135 385682835 /nfs/dbraw/zinc/68/28/35/385682835.db2.gz XNRBDEUNXWZOLU-ZFWWWQNUSA-N 0 3 263.381 2.621 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@@H]1O ZINC000273446135 385682839 /nfs/dbraw/zinc/68/28/39/385682839.db2.gz XNRBDEUNXWZOLU-ZFWWWQNUSA-N 0 3 263.381 2.621 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c1 ZINC000273460449 385684384 /nfs/dbraw/zinc/68/43/84/385684384.db2.gz IASSKXRXXZJUIK-BXKDBHETSA-N 0 3 277.286 2.665 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1 ZINC000273502193 385685679 /nfs/dbraw/zinc/68/56/79/385685679.db2.gz QLBCYBHEQGTNRY-JOYOIKCWSA-N 0 3 277.286 2.665 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCNc2ccccn2)c([O-])c1 ZINC000273563835 385687716 /nfs/dbraw/zinc/68/77/16/385687716.db2.gz IVVCFFHXHNDURA-ZDUSSCGKSA-N 0 3 271.364 2.858 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CCN(C)C)c([O-])c1C ZINC000273562988 385687760 /nfs/dbraw/zinc/68/77/60/385687760.db2.gz IRANUBBEIBKAAB-JSGCOSHPSA-N 0 3 264.413 3.000 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])CC1 ZINC000273535772 385688072 /nfs/dbraw/zinc/68/80/72/385688072.db2.gz XGRIQJAVPWJKRW-NHYWBVRUSA-N 0 3 281.371 2.979 20 10 CFCDHN C[C@H]([NH2+][C@H]1CN(C2CC2)C[C@@H]1C)c1cc(F)ccc1[O-] ZINC000273590360 385690194 /nfs/dbraw/zinc/69/01/94/385690194.db2.gz OYPFDPQOKPDAOD-PGUXBMHVSA-N 0 3 278.371 2.665 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCO2)[C@@H](O)c1ccccc1 ZINC000288478217 197089154 /nfs/dbraw/zinc/08/91/54/197089154.db2.gz GGVTUFHZPFHZEQ-SCLBCKFNSA-N 0 3 283.371 2.833 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1cccc(O)c1)CC2 ZINC000297664080 285391769 /nfs/dbraw/zinc/39/17/69/285391769.db2.gz KRYMHYCOGPVKPV-AWEZNQCLSA-N 0 3 255.317 2.875 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCN(C3CCC3)CC1)CC2 ZINC000297885755 285396740 /nfs/dbraw/zinc/39/67/40/285396740.db2.gz VHSKIPLKAIRKDA-INIZCTEOSA-N 0 3 286.419 2.986 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)CN1C1CC1 ZINC000297826143 393447971 /nfs/dbraw/zinc/44/79/71/393447971.db2.gz ROQAPXJAFCRGPB-KYOSRNDESA-N 0 3 272.392 2.594 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 ZINC000372397399 393448230 /nfs/dbraw/zinc/44/82/30/393448230.db2.gz DGHXRAJXZAKDFM-BMFZPTHFSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 ZINC000372397399 393448237 /nfs/dbraw/zinc/44/82/37/393448237.db2.gz DGHXRAJXZAKDFM-BMFZPTHFSA-N 0 3 275.392 2.946 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H](c2nnc[nH]2)C1 ZINC000372598859 393452510 /nfs/dbraw/zinc/45/25/10/393452510.db2.gz IOAGOQJLJHSASC-GXTWGEPZSA-N 0 3 286.379 2.841 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H](c2nnc[nH]2)C1 ZINC000372598859 393452520 /nfs/dbraw/zinc/45/25/20/393452520.db2.gz IOAGOQJLJHSASC-GXTWGEPZSA-N 0 3 286.379 2.841 20 10 CFCDHN COc1cccc(CN[C@@H]2CCc3c2cccc3O)c1O ZINC000105486509 393863777 /nfs/dbraw/zinc/86/37/77/393863777.db2.gz SYTWOUTYGJCGSY-CQSZACIVSA-N 0 3 285.343 2.884 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@@H](C3CC3)C2)cc1C ZINC000364424024 394211427 /nfs/dbraw/zinc/21/14/27/394211427.db2.gz YTMLLEMTHDJYKI-MRXNPFEDSA-N 0 3 261.365 2.620 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(F)cc1[O-] ZINC000293670308 394284487 /nfs/dbraw/zinc/28/44/87/394284487.db2.gz MNCRUTDPEHHLFN-BXUZGUMPSA-N 0 3 268.376 2.770 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN3CCCC[C@H]23)c([O-])c1 ZINC000036996272 292247882 /nfs/dbraw/zinc/24/78/82/292247882.db2.gz VOWNHQMHNHFUGO-NUEKZKHPSA-N 0 3 274.408 2.978 20 10 CFCDHN CC[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000006986409 170260394 /nfs/dbraw/zinc/26/03/94/170260394.db2.gz FKCTYNIBJMKNED-LBPRGKRZSA-N 0 3 263.337 2.885 20 10 CFCDHN CC[C@H]1CCCC[N@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000006986409 170260396 /nfs/dbraw/zinc/26/03/96/170260396.db2.gz FKCTYNIBJMKNED-LBPRGKRZSA-N 0 3 263.337 2.885 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCCC1)c1ccccc1[O-] ZINC000020128762 171016260 /nfs/dbraw/zinc/01/62/60/171016260.db2.gz GEWLFISCAIJKTM-CQSZACIVSA-N 0 3 262.397 2.919 20 10 CFCDHN CC[C@@H]([NH2+]CCCN1CCCC1)c1ccccc1[O-] ZINC000020129085 171016639 /nfs/dbraw/zinc/01/66/39/171016639.db2.gz IHXXXCJNRXBBCY-OAHLLOKOSA-N 0 3 262.397 2.919 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)N(C)C)c1 ZINC000035628804 172308303 /nfs/dbraw/zinc/30/83/03/172308303.db2.gz SIHZXSMOPBSJCX-LBPRGKRZSA-N 0 3 250.386 2.691 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCO[C@@H]2CCC[C@@H]21 ZINC000371527815 261294725 /nfs/dbraw/zinc/29/47/25/261294725.db2.gz JDBIWHSUVXRTCF-DZGCQCFKSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCO[C@@H]2CCC[C@@H]21 ZINC000371527815 261294728 /nfs/dbraw/zinc/29/47/28/261294728.db2.gz JDBIWHSUVXRTCF-DZGCQCFKSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCC1=CCCC1)OCO2 ZINC000120171673 262186844 /nfs/dbraw/zinc/18/68/44/262186844.db2.gz DERMURWFPGIHDV-UHFFFAOYSA-N 0 3 261.321 2.711 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCc2ccc(O)cc2)c1 ZINC000263642420 262850293 /nfs/dbraw/zinc/85/02/93/262850293.db2.gz ADVJRTQCIAWPGB-UHFFFAOYSA-N 0 3 287.359 2.829 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[NH+]1CC([C@@H]2CCOC2)C1 ZINC000368038750 267139925 /nfs/dbraw/zinc/13/99/25/267139925.db2.gz CZHUQNWSIUCAJI-IUODEOHRSA-N 0 3 261.365 2.812 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CC([C@H]3CCOC3)C2)c1[O-] ZINC000368440406 267173094 /nfs/dbraw/zinc/17/30/94/267173094.db2.gz CSNVITGPKNUWOK-NSHDSACASA-N 0 3 281.783 2.822 20 10 CFCDHN CN1CCc2cc(C[NH2+]Cc3cc(F)ccc3[O-])ccc21 ZINC000369812401 267268166 /nfs/dbraw/zinc/26/81/66/267268166.db2.gz YEGJWQSIAVAPLN-UHFFFAOYSA-N 0 3 286.350 2.813 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000369875595 267273501 /nfs/dbraw/zinc/27/35/01/267273501.db2.gz VVZSFIJIPKGMAH-DOTOQJQBSA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000369875595 267273504 /nfs/dbraw/zinc/27/35/04/267273504.db2.gz VVZSFIJIPKGMAH-DOTOQJQBSA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@H]([C@@H]2CCCO2)C1 ZINC000369888658 267273944 /nfs/dbraw/zinc/27/39/44/267273944.db2.gz OVOQEWUTMXDHAZ-HYVNUMGLSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@H]([C@@H]2CCCO2)C1 ZINC000369888658 267273945 /nfs/dbraw/zinc/27/39/45/267273945.db2.gz OVOQEWUTMXDHAZ-HYVNUMGLSA-N 0 3 291.391 2.723 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCO[C@@]2(CCOC2)C1)c1cc(F)ccc1[O-] ZINC000369902178 267275343 /nfs/dbraw/zinc/27/53/43/267275343.db2.gz KXURYFUSLXLOOE-GHJWDPDVSA-N 0 3 295.354 2.520 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@]3(CCOC3)C2)c([O-])c1 ZINC000369902196 267275547 /nfs/dbraw/zinc/27/55/47/267275547.db2.gz LCRIKMDAFQPLDJ-JJRVBVJISA-N 0 3 291.391 2.689 20 10 CFCDHN CCCN(CC)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297664100 275995108 /nfs/dbraw/zinc/99/51/08/275995108.db2.gz KSJXFTKZEBYLTC-CQSZACIVSA-N 0 3 262.397 2.701 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NC1CC1 ZINC000282547789 276233925 /nfs/dbraw/zinc/23/39/25/276233925.db2.gz WVIJVWQHVNHARL-ZDUSSCGKSA-N 0 3 290.407 2.661 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NC1CC1 ZINC000282547789 276233926 /nfs/dbraw/zinc/23/39/26/276233926.db2.gz WVIJVWQHVNHARL-ZDUSSCGKSA-N 0 3 290.407 2.661 20 10 CFCDHN COc1ncccc1CN[C@H]1CCc2cccc(O)c21 ZINC000296179925 278095961 /nfs/dbraw/zinc/09/59/61/278095961.db2.gz YCBOGPQQZBUINS-ZDUSSCGKSA-N 0 3 270.332 2.573 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000365836041 281025446 /nfs/dbraw/zinc/02/54/46/281025446.db2.gz GYPYUMZTQPPFAM-UKRRQHHQSA-N 0 3 271.364 2.987 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000365836041 281025448 /nfs/dbraw/zinc/02/54/48/281025448.db2.gz GYPYUMZTQPPFAM-UKRRQHHQSA-N 0 3 271.364 2.987 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1 ZINC000295069938 295167314 /nfs/dbraw/zinc/16/73/14/295167314.db2.gz PEPKSLXTLGRDBL-WDEREUQCSA-N 0 3 267.369 2.601 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1COc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000367996695 327087376 /nfs/dbraw/zinc/08/73/76/327087376.db2.gz ITFHRDSQSOYJFN-DAYGRLMNSA-N 0 3 299.370 2.928 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@H]3COC[C@H]32)c1 ZINC000368044789 327221062 /nfs/dbraw/zinc/22/10/62/327221062.db2.gz UFOMDALLPADNNN-TYNCELHUSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@H]3COC[C@H]32)c1 ZINC000368044789 327221063 /nfs/dbraw/zinc/22/10/63/327221063.db2.gz UFOMDALLPADNNN-TYNCELHUSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1cccc(C[N@@H+]2CCOCC3(CCCC3)C2)c1[O-] ZINC000375388332 329003240 /nfs/dbraw/zinc/00/32/40/329003240.db2.gz CFHQBSSSGVTCGJ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc(C[N@H+]2CCOCC3(CCCC3)C2)c1[O-] ZINC000375388332 329003242 /nfs/dbraw/zinc/00/32/42/329003242.db2.gz CFHQBSSSGVTCGJ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000359998244 329644663 /nfs/dbraw/zinc/64/46/63/329644663.db2.gz WPQZGYPOULBTKU-UHFFFAOYSA-N 0 3 261.365 2.783 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC23CC(C2)CO3)c([O-])c1 ZINC000527976742 330302058 /nfs/dbraw/zinc/30/20/58/330302058.db2.gz CVEDACXPRHNJFY-FUJMWEONSA-N 0 3 261.365 2.839 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000528008953 330303791 /nfs/dbraw/zinc/30/37/91/330303791.db2.gz ULHZMZNGUZFTPN-IWAHSAMASA-N 0 3 261.365 2.781 20 10 CFCDHN Cc1c2ccccc2n(C)c1CNCc1cncn1C ZINC000355136078 335767376 /nfs/dbraw/zinc/76/73/76/335767376.db2.gz PPXUFYFHYGIOQC-UHFFFAOYSA-N 0 3 268.364 2.510 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H]2CCCOC2)cc1F ZINC000236936573 520910419 /nfs/dbraw/zinc/91/04/19/520910419.db2.gz MWBIOYBBQPIZSR-AWEZNQCLSA-N 0 3 280.387 2.941 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCCCC1)c1ccccc1[O-] ZINC000049574500 522589671 /nfs/dbraw/zinc/58/96/71/522589671.db2.gz VODWXMWLPKAKMA-HNNXBMFYSA-N 0 3 262.397 2.919 20 10 CFCDHN CC(C)OCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000070976433 519765314 /nfs/dbraw/zinc/76/53/14/519765314.db2.gz XEQFNEKFLQODEF-MRXNPFEDSA-N 0 3 293.407 2.798 20 10 CFCDHN CC(C)OCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000070976433 519765315 /nfs/dbraw/zinc/76/53/15/519765315.db2.gz XEQFNEKFLQODEF-MRXNPFEDSA-N 0 3 293.407 2.798 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC000279599415 520349174 /nfs/dbraw/zinc/34/91/74/520349174.db2.gz DKNPLIASPVWGPM-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC000279599415 520349186 /nfs/dbraw/zinc/34/91/86/520349186.db2.gz DKNPLIASPVWGPM-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@@H](COC)C2)c([O-])c1 ZINC000211435634 520352765 /nfs/dbraw/zinc/35/27/65/520352765.db2.gz FURBEIFUCVAOFF-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@@H](COC)C2)c([O-])c1 ZINC000211435634 520352773 /nfs/dbraw/zinc/35/27/73/520352773.db2.gz FURBEIFUCVAOFF-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCOC[C@H]2C)c([O-])c1 ZINC000278041592 520375703 /nfs/dbraw/zinc/37/57/03/520375703.db2.gz XMMCSTRYJFVPIB-DOMZBBRYSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC[C@@H](O)C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000294952606 520796766 /nfs/dbraw/zinc/79/67/66/520796766.db2.gz MQDIOLLCHQPYII-CVEARBPZSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@@H](O)C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000294952606 520796774 /nfs/dbraw/zinc/79/67/74/520796774.db2.gz MQDIOLLCHQPYII-CVEARBPZSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@@H](O)C[N@H+](CCC)Cc1ccccc1[O-] ZINC000295054147 520797976 /nfs/dbraw/zinc/79/79/76/520797976.db2.gz OXAFOTMYNQXZBN-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[C@@H](O)C[N@@H+](CCC)Cc1ccccc1[O-] ZINC000295054147 520797987 /nfs/dbraw/zinc/79/79/87/520797987.db2.gz OXAFOTMYNQXZBN-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000283831270 520806326 /nfs/dbraw/zinc/80/63/26/520806326.db2.gz APHDVMRPPLNQEZ-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@H](O)C2CC2)cc1F ZINC000265813720 520904694 /nfs/dbraw/zinc/90/46/94/520904694.db2.gz WKPBNHUSCRLTRV-INIZCTEOSA-N 0 3 280.387 2.532 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@](C)(O)CC2)c1 ZINC000279688301 521144366 /nfs/dbraw/zinc/14/43/66/521144366.db2.gz PNPKVLQWXBSTAR-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@](C)(O)CC2)c1 ZINC000279688301 521144376 /nfs/dbraw/zinc/14/43/76/521144376.db2.gz PNPKVLQWXBSTAR-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCCCCC(=O)OC)c1 ZINC000289812477 521151330 /nfs/dbraw/zinc/15/13/30/521151330.db2.gz NQYSBZRYKXHOKL-UHFFFAOYSA-N 0 3 295.379 2.614 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H](C)CN(C)C(C)C)c1 ZINC000289706939 521154731 /nfs/dbraw/zinc/15/47/31/521154731.db2.gz FEXMNHSUHFYDAG-CYBMUJFWSA-N 0 3 280.412 2.609 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000290920856 521371882 /nfs/dbraw/zinc/37/18/82/521371882.db2.gz NUXCBVUCUBZWLR-INIZCTEOSA-N 0 3 293.407 2.678 20 10 CFCDHN CCC(CC)(CO)C[NH2+]Cc1cccc(C)c1[O-] ZINC000224921806 521452800 /nfs/dbraw/zinc/45/28/00/521452800.db2.gz XLRIYTIWMIMLKE-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN CCOC1CC([N@H+](C)Cc2cc(F)ccc2[O-])C1 ZINC000290296495 521650609 /nfs/dbraw/zinc/65/06/09/521650609.db2.gz AVNQGYAIODBMKL-UHFFFAOYSA-N 0 3 253.317 2.531 20 10 CFCDHN CCOC1CC([N@@H+](C)Cc2cc(F)ccc2[O-])C1 ZINC000290296495 521650611 /nfs/dbraw/zinc/65/06/11/521650611.db2.gz AVNQGYAIODBMKL-UHFFFAOYSA-N 0 3 253.317 2.531 20 10 CFCDHN CCC(O)(CC)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000266175348 521656178 /nfs/dbraw/zinc/65/61/78/521656178.db2.gz DLSSZVCDBQSZQZ-UHFFFAOYSA-N 0 3 251.370 2.650 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])CC1(C(=O)OC)CC1 ZINC000295046441 521689676 /nfs/dbraw/zinc/68/96/76/521689676.db2.gz OGHSIUKPINWONZ-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])CC1(C(=O)OC)CC1 ZINC000295046441 521689679 /nfs/dbraw/zinc/68/96/79/521689679.db2.gz OGHSIUKPINWONZ-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN CN(C)C[C@@H]([NH2+]Cc1ccccc1[O-])c1ccc(F)cc1 ZINC000290032072 521828262 /nfs/dbraw/zinc/82/82/62/521828262.db2.gz FBDVLVYOYKMXJO-MRXNPFEDSA-N 0 3 288.366 2.924 20 10 CFCDHN CC[C@H](CCO)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228676312 522143407 /nfs/dbraw/zinc/14/34/07/522143407.db2.gz YUYZLQHOAIQJDW-SNVBAGLBSA-N 0 3 287.787 2.552 20 10 CFCDHN CN(C)c1ccc(CN[C@@H](CO)c2ccccc2)cc1 ZINC000062998919 522211278 /nfs/dbraw/zinc/21/12/78/522211278.db2.gz LRXBGYYNTUJPHS-KRWDZBQOSA-N 0 3 270.376 2.576 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H](C)C2)c1[O-] ZINC000230935356 522542873 /nfs/dbraw/zinc/54/28/73/522542873.db2.gz IGSBXOJYNKETHB-SKDRFNHKSA-N 0 3 285.771 2.711 20 10 CFCDHN CCc1ncc(CNCc2cccc(OC)c2O)s1 ZINC000289449958 522554814 /nfs/dbraw/zinc/55/48/14/522554814.db2.gz NBJAEDGGEZIOPT-UHFFFAOYSA-N 0 3 278.377 2.710 20 10 CFCDHN CC[C@H]([NH2+]CCNC(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000279957168 522593499 /nfs/dbraw/zinc/59/34/99/522593499.db2.gz CBYTXTQLSXNHKH-AWEZNQCLSA-N 0 3 278.396 2.514 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)CCO)c1ccc(C)cc1[O-] ZINC000279990631 522606562 /nfs/dbraw/zinc/60/65/62/522606562.db2.gz FINSVKJARQLLBI-JSGCOSHPSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@H]([NH2+]Cc1cnn(C)c1C)c1ccccc1[O-] ZINC000121102851 522667874 /nfs/dbraw/zinc/66/78/74/522667874.db2.gz CROZWHOLNFLETO-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CC[S@](C)=O)c1ccccc1[O-] ZINC000253013910 522687114 /nfs/dbraw/zinc/68/71/14/522687114.db2.gz FPGRDYLIYQVIJY-FNFWKMNBSA-N 0 3 269.410 2.590 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CC[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000280134083 522687723 /nfs/dbraw/zinc/68/77/23/522687723.db2.gz PDGLRMXBUBLSEQ-PTAUBWNISA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@@H](CO)SC)c1ccccc1[O-] ZINC000155947443 522691177 /nfs/dbraw/zinc/69/11/77/522691177.db2.gz PGDWHCPVUMLYDZ-VHRBIJSZSA-N 0 3 269.410 2.545 20 10 CFCDHN CC[C@@H]([NH2+]CCCNC(=O)C1CCC1)c1ccccc1[O-] ZINC000156693491 522829253 /nfs/dbraw/zinc/82/92/53/522829253.db2.gz IGLKLELPKLPCDC-OAHLLOKOSA-N 0 3 290.407 2.739 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nnc(C)s1)c1ccccc1[O-] ZINC000289902013 522844180 /nfs/dbraw/zinc/84/41/80/522844180.db2.gz TZHUKUGKDNBTKJ-GFCCVEGCSA-N 0 3 277.393 2.836 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cn[nH]c1)c1ccc(C)cc1[O-] ZINC000289967120 522844503 /nfs/dbraw/zinc/84/45/03/522844503.db2.gz XGUJJYATFJSPGK-CQSZACIVSA-N 0 3 259.353 2.707 20 10 CFCDHN COC[C@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000228664096 522844704 /nfs/dbraw/zinc/84/47/04/522844704.db2.gz SZXKIKVUXSLYGJ-JTQLQIEISA-N 0 3 285.771 2.523 20 10 CFCDHN COC[C@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000228664096 522844708 /nfs/dbraw/zinc/84/47/08/522844708.db2.gz SZXKIKVUXSLYGJ-JTQLQIEISA-N 0 3 285.771 2.523 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000279007703 522856151 /nfs/dbraw/zinc/85/61/51/522856151.db2.gz SMPBJELHQIAFFD-DZGCQCFKSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)C[C@@H](C)O)c1ccccc1[O-] ZINC000155962779 522859027 /nfs/dbraw/zinc/85/90/27/522859027.db2.gz DITXSAHSKQHFIG-YRGRVCCFSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000156297594 522909536 /nfs/dbraw/zinc/90/95/36/522909536.db2.gz YTCHIVNUXHGURS-GZBFAFLISA-N 0 3 279.380 2.627 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C1CCC(CO)CC1 ZINC000290407550 523183169 /nfs/dbraw/zinc/18/31/69/523183169.db2.gz JWNZARVHICNQQF-UHFFFAOYSA-N 0 3 267.344 2.514 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C1CCC(CO)CC1 ZINC000290407550 523183177 /nfs/dbraw/zinc/18/31/77/523183177.db2.gz JWNZARVHICNQQF-UHFFFAOYSA-N 0 3 267.344 2.514 20 10 CFCDHN CC[C@@]1(CO)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000275123816 523738526 /nfs/dbraw/zinc/73/85/26/523738526.db2.gz IGFICUVGCZJEFK-QGZVFWFLSA-N 0 3 294.414 2.876 20 10 CFCDHN CO[C@@](C)(C[NH2+][C@@H]1CCc2cccc([O-])c21)C1CC1 ZINC000297467238 523799163 /nfs/dbraw/zinc/79/91/63/523799163.db2.gz YHNJJKXZWUGMPF-CJNGLKHVSA-N 0 3 261.365 2.784 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370478 523972458 /nfs/dbraw/zinc/97/24/58/523972458.db2.gz HKZFWXOYLHTCKT-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370478 523972460 /nfs/dbraw/zinc/97/24/60/523972460.db2.gz HKZFWXOYLHTCKT-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370478 523972463 /nfs/dbraw/zinc/97/24/63/523972463.db2.gz HKZFWXOYLHTCKT-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370478 523972469 /nfs/dbraw/zinc/97/24/69/523972469.db2.gz HKZFWXOYLHTCKT-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2Cc1cc(C)ccc1[O-] ZINC000289638322 524023557 /nfs/dbraw/zinc/02/35/57/524023557.db2.gz MHHTUUXKNIQPGJ-SAYFZHNOSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1cc(C)ccc1[O-] ZINC000289638322 524023559 /nfs/dbraw/zinc/02/35/59/524023559.db2.gz MHHTUUXKNIQPGJ-SAYFZHNOSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2Cc1cccc(C)c1[O-] ZINC000289706176 524024134 /nfs/dbraw/zinc/02/41/34/524024134.db2.gz ORXDSXFAJXHNLV-NBFUAULTSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1cccc(C)c1[O-] ZINC000289706176 524024135 /nfs/dbraw/zinc/02/41/35/524024135.db2.gz ORXDSXFAJXHNLV-NBFUAULTSA-N 0 3 273.376 2.556 20 10 CFCDHN COc1ccc(CNC[C@@H](O)c2ccccc2)cc1C ZINC000035052611 524071679 /nfs/dbraw/zinc/07/16/79/524071679.db2.gz KLIXUZFPNOWJBU-MRXNPFEDSA-N 0 3 271.360 2.827 20 10 CFCDHN COc1ccc(CNC[C@H](O)c2ccccc2)cc1C ZINC000035052609 524071936 /nfs/dbraw/zinc/07/19/36/524071936.db2.gz KLIXUZFPNOWJBU-INIZCTEOSA-N 0 3 271.360 2.827 20 10 CFCDHN COc1ccc(CNC[C@](C)(O)c2ccco2)cc1C ZINC000266155284 524072301 /nfs/dbraw/zinc/07/23/01/524072301.db2.gz LREAUJAKVAJSBA-INIZCTEOSA-N 0 3 275.348 2.594 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@]2(O)CCSC2)c([O-])c1 ZINC000294955687 524330689 /nfs/dbraw/zinc/33/06/89/524330689.db2.gz YRSDPABPNZOAHQ-IUODEOHRSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H]2CCCSC2)c1[O-] ZINC000290166006 524432036 /nfs/dbraw/zinc/43/20/36/524432036.db2.gz MIFXICRELHVIGL-LBPRGKRZSA-N 0 3 251.395 2.933 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])CN1CCCC1 ZINC000062077558 524496400 /nfs/dbraw/zinc/49/64/00/524496400.db2.gz DOPAMAJBKGHAMK-KGLIPLIRSA-N 0 3 262.397 2.775 20 10 CFCDHN Cc1cc(CN2CCC([C@@H](C)O)CC2)ccc1N(C)C ZINC000293141509 524679072 /nfs/dbraw/zinc/67/90/72/524679072.db2.gz QJPJTGXSTMUYAN-CQSZACIVSA-N 0 3 276.424 2.654 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280361670 524737296 /nfs/dbraw/zinc/73/72/96/524737296.db2.gz CUJTVCJNZJGRRA-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280361670 524737307 /nfs/dbraw/zinc/73/73/07/524737307.db2.gz CUJTVCJNZJGRRA-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC(C)(C)SC)c1 ZINC000164745245 524750320 /nfs/dbraw/zinc/75/03/20/524750320.db2.gz NPNPEHYAVNKLHK-UHFFFAOYSA-N 0 3 255.383 2.632 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]Cc2cccc(CO)c2)c1 ZINC000185373108 524762765 /nfs/dbraw/zinc/76/27/65/524762765.db2.gz SPQOSACQJXJCQF-GFCCVEGCSA-N 0 3 287.359 2.744 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C(C)C)C(C)(C)O)c1 ZINC000276610807 524770984 /nfs/dbraw/zinc/77/09/84/524770984.db2.gz CJPCGEHBGRYDPP-NHYWBVRUSA-N 0 3 281.396 2.847 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2c(C)nn(C)c2C)c1 ZINC000092324569 524772168 /nfs/dbraw/zinc/77/21/68/524772168.db2.gz XXLXCDDMLSMYQN-JTQLQIEISA-N 0 3 289.379 2.602 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c1[O-] ZINC000376853938 524873661 /nfs/dbraw/zinc/87/36/61/524873661.db2.gz FYJTYSSGRRJBMH-UPJWGTAASA-N 0 3 267.756 2.764 20 10 CFCDHN Cc1ccccc1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880182 525167910 /nfs/dbraw/zinc/16/79/10/525167910.db2.gz ZWDPWLJBABRAEO-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280610700 525342097 /nfs/dbraw/zinc/34/20/97/525342097.db2.gz YYDHTOJDXMZBLZ-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280610700 525342109 /nfs/dbraw/zinc/34/21/09/525342109.db2.gz YYDHTOJDXMZBLZ-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](O)c2ccc(F)cc2)c1 ZINC000277665145 525348584 /nfs/dbraw/zinc/34/85/84/525348584.db2.gz HHYWVYBVNARILI-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000368766936 525350626 /nfs/dbraw/zinc/35/06/26/525350626.db2.gz VPIDIMIHMDHWME-IAGOWNOFSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)Cn2ccnc2)c1 ZINC000037158372 525362702 /nfs/dbraw/zinc/36/27/02/525362702.db2.gz SQJAZNMFIPFFSL-CHWSQXEVSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C2CCN(C3CC3)CC2)c1 ZINC000037141078 525363331 /nfs/dbraw/zinc/36/33/31/525363331.db2.gz QQYANRWTOUTZCZ-ZDUSSCGKSA-N 0 3 274.408 2.978 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCc3nccn3C2)c1 ZINC000278854726 525364203 /nfs/dbraw/zinc/36/42/03/525364203.db2.gz ALJNMCLWLDLXDE-KBPBESRZSA-N 0 3 285.391 2.810 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094617093 525380171 /nfs/dbraw/zinc/38/01/71/525380171.db2.gz UVBNOISXRMQYMS-MEDUHNTESA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)N(C)C)c1cc(F)ccc1[O-] ZINC000094616858 525414539 /nfs/dbraw/zinc/41/45/39/525414539.db2.gz YCXDJXCQAVLILK-SNVBAGLBSA-N 0 3 254.349 2.522 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCSC1)c1cc(F)ccc1[O-] ZINC000228559005 525418709 /nfs/dbraw/zinc/41/87/09/525418709.db2.gz JWGFHJQAEMKWFG-VHSXEESVSA-N 0 3 255.358 2.935 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000278952785 525487013 /nfs/dbraw/zinc/48/70/13/525487013.db2.gz LONCYBWFWRGQJP-OLZOCXBDSA-N 0 3 271.364 2.502 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)c1ccccc1 ZINC000042879016 525516211 /nfs/dbraw/zinc/51/62/11/525516211.db2.gz AHCNDZYRWLLHJJ-LLVKDONJSA-N 0 3 271.316 2.972 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(F)ccc1[O-] ZINC000279894028 525626050 /nfs/dbraw/zinc/62/60/50/525626050.db2.gz ADNHEENOQVJGCU-ZWNOBZJWSA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@H]([NH2+][C@H]1COc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000290207535 525634753 /nfs/dbraw/zinc/63/47/53/525634753.db2.gz HCJYMYQTDKMCAQ-PZSREKOKSA-N 0 3 285.343 2.537 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(C)OCCCO2)c([O-])c1C ZINC000277260286 525722635 /nfs/dbraw/zinc/72/26/35/525722635.db2.gz OTQDNWVXGWRPGI-CYBMUJFWSA-N 0 3 279.380 2.813 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])C1CCCCC1 ZINC000191653412 525774841 /nfs/dbraw/zinc/77/48/41/525774841.db2.gz LQCZCGQXANQLRV-MRXNPFEDSA-N 0 3 281.371 2.952 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])cnn1C ZINC000094617580 525921924 /nfs/dbraw/zinc/92/19/24/525921924.db2.gz WBFJDLJJMCSHCB-UWVGGRQHSA-N 0 3 277.343 2.985 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCc3nccn3C2)c([O-])c1 ZINC000278952742 525922499 /nfs/dbraw/zinc/92/24/99/525922499.db2.gz LNSLBUFJXDFGAN-KBPBESRZSA-N 0 3 285.391 2.810 20 10 CFCDHN COc1cccc(CN2CCC(F)(F)[C@H](C)C2)c1O ZINC000291707801 525932022 /nfs/dbraw/zinc/93/20/22/525932022.db2.gz ZPIXCCWXQLQPFS-SNVBAGLBSA-N 0 3 271.307 2.878 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN3CCCC[C@@H]23)c([O-])c1 ZINC000217626147 525936547 /nfs/dbraw/zinc/93/65/47/525936547.db2.gz VOWNHQMHNHFUGO-IMJJTQAJSA-N 0 3 274.408 2.978 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2cc(C)ccc2[O-])cc1 ZINC000278547006 525975959 /nfs/dbraw/zinc/97/59/59/525975959.db2.gz YIUQJQDFINTRMW-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000278634173 525977410 /nfs/dbraw/zinc/97/74/10/525977410.db2.gz IJMWOLMIQULXKH-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN COc1cccc(C[NH2+]CC2(SC)CCC2)c1[O-] ZINC000193644256 526012931 /nfs/dbraw/zinc/01/29/31/526012931.db2.gz IBJKFOOAILUHBW-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN COc1cccc(C[NH2+]CCCc2ncccc2C)c1[O-] ZINC000295054946 526016173 /nfs/dbraw/zinc/01/61/73/526016173.db2.gz PVUIBZGAYQPWOU-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)CC(C)(C)OC)c1[O-] ZINC000174556414 526028819 /nfs/dbraw/zinc/02/88/19/526028819.db2.gz STLMBNDBTUZNOP-NSHDSACASA-N 0 3 267.369 2.694 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1[O-] ZINC000136716961 526035516 /nfs/dbraw/zinc/03/55/16/526035516.db2.gz AWMPLPCCMAJXPB-CQSZACIVSA-N 0 3 291.391 2.982 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000290828449 526372215 /nfs/dbraw/zinc/37/22/15/526372215.db2.gz HIKWKMOFTDTTPQ-JKSUJKDBSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000290828449 526372221 /nfs/dbraw/zinc/37/22/21/526372221.db2.gz HIKWKMOFTDTTPQ-JKSUJKDBSA-N 0 3 273.376 2.926 20 10 CFCDHN Cc1ncsc1CNCc1ccc(N(C)C)cc1 ZINC000071212314 527510736 /nfs/dbraw/zinc/51/07/36/527510736.db2.gz GDXFMYZQHXXEHP-UHFFFAOYSA-N 0 3 261.394 2.807 20 10 CFCDHN Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000361928956 527698153 /nfs/dbraw/zinc/69/81/53/527698153.db2.gz YLCKWHXWVLMRFH-HNNXBMFYSA-N 0 3 289.354 2.910 20 10 CFCDHN Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000361928956 527698156 /nfs/dbraw/zinc/69/81/56/527698156.db2.gz YLCKWHXWVLMRFH-HNNXBMFYSA-N 0 3 289.354 2.910 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)c2ccco2)c1 ZINC000756382925 574099229 /nfs/dbraw/zinc/09/92/29/574099229.db2.gz HGCPZRAHHQIDHO-SMDDNHRTSA-N 0 3 261.321 2.678 20 10 CFCDHN CC[N@@H+](Cc1cc(C)cc(OC)c1[O-])C[C@H]1CCOC1 ZINC000754731407 574117633 /nfs/dbraw/zinc/11/76/33/574117633.db2.gz AWDUMMOPVNKFSU-CYBMUJFWSA-N 0 3 279.380 2.568 20 10 CFCDHN CC[N@H+](Cc1cc(C)cc(OC)c1[O-])C[C@H]1CCOC1 ZINC000754731407 574117635 /nfs/dbraw/zinc/11/76/35/574117635.db2.gz AWDUMMOPVNKFSU-CYBMUJFWSA-N 0 3 279.380 2.568 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)COCC(C)C)c([O-])c1C ZINC000756460778 574118576 /nfs/dbraw/zinc/11/85/76/574118576.db2.gz SWBBGUKYDYBCMD-LSDHHAIUSA-N 0 3 295.423 2.693 20 10 CFCDHN C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)c2cc([O-])cs2)C1 ZINC000731871945 574131220 /nfs/dbraw/zinc/13/12/20/574131220.db2.gz RCQIJMCAMPKVOZ-TXEJJXNPSA-N 0 3 296.436 2.552 20 10 CFCDHN C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc([O-])cs2)C1 ZINC000731871945 574131222 /nfs/dbraw/zinc/13/12/22/574131222.db2.gz RCQIJMCAMPKVOZ-TXEJJXNPSA-N 0 3 296.436 2.552 20 10 CFCDHN CCCN(CCC)c1ccc(CN[C@@H](C)CC(N)=O)cc1 ZINC000746476170 574150919 /nfs/dbraw/zinc/15/09/19/574150919.db2.gz SHRSOSNCKHRWBU-AWEZNQCLSA-N 0 3 291.439 2.667 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@](C)(O)[C@H](C)CC)c([O-])c1 ZINC000732820962 574173298 /nfs/dbraw/zinc/17/32/98/574173298.db2.gz QSOJMCABRFRREQ-WBMJQRKESA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1ccccc1[C@H](CO)NCc1ccc(N(C)C)cc1 ZINC000747100544 574179740 /nfs/dbraw/zinc/17/97/40/574179740.db2.gz KJOGAMXZUDGZEW-SFHVURJKSA-N 0 3 284.403 2.884 20 10 CFCDHN COCCOCCC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756356980 574228801 /nfs/dbraw/zinc/22/88/01/574228801.db2.gz AOEMULOKIMQOJA-AAEUAGOBSA-N 0 3 297.370 2.722 20 10 CFCDHN CC(C)NC(=O)CC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756395181 574233522 /nfs/dbraw/zinc/23/35/22/574233522.db2.gz HREKQDWGPVTKEX-ZYHUDNBSSA-N 0 3 294.370 2.584 20 10 CFCDHN CC(C)NC(=O)CC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756395175 574233679 /nfs/dbraw/zinc/23/36/79/574233679.db2.gz HREKQDWGPVTKEX-CMPLNLGQSA-N 0 3 294.370 2.584 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C2CCOCC2)c2c1c(F)ccc2[O-] ZINC000756432211 574236802 /nfs/dbraw/zinc/23/68/02/574236802.db2.gz IKFQJIBHJFOXQH-BXKDBHETSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430441 574236827 /nfs/dbraw/zinc/23/68/27/574236827.db2.gz ICHUINDMLOJWCN-LKTVYLICSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430441 574236829 /nfs/dbraw/zinc/23/68/29/574236829.db2.gz ICHUINDMLOJWCN-LKTVYLICSA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2cnccn2)c([O-])c1 ZINC000756497033 574241504 /nfs/dbraw/zinc/24/15/04/574241504.db2.gz ZYGQWVNKUWWHLR-CHWSQXEVSA-N 0 3 271.364 2.772 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2cnccn2)c([O-])c1 ZINC000756497040 574241625 /nfs/dbraw/zinc/24/16/25/574241625.db2.gz ZYGQWVNKUWWHLR-STQMWFEESA-N 0 3 271.364 2.772 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1cc(F)ccc1[O-] ZINC000756550451 574246355 /nfs/dbraw/zinc/24/63/55/574246355.db2.gz HTBDQFBKVUJAKA-BXUZGUMPSA-N 0 3 278.371 2.666 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@H]2CCOC2)c([O-])c1C ZINC000756564180 574248154 /nfs/dbraw/zinc/24/81/54/574248154.db2.gz QYDFKDCCGCRDGI-GJZGRUSLSA-N 0 3 293.407 2.713 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@](C)(O)C2CC2)c2c1c(F)ccc2[O-] ZINC000756568625 574248729 /nfs/dbraw/zinc/24/87/29/574248729.db2.gz GYJVSQLAZHSCMP-ULMHFPJVSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756576763 574249862 /nfs/dbraw/zinc/24/98/62/574249862.db2.gz OHCFTDBQZZCXBS-ZIBATOQPSA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCOC[C@@H]2CCCO2)c1 ZINC000756583891 574250533 /nfs/dbraw/zinc/25/05/33/574250533.db2.gz RKRZBFYQRKGNPE-KGLIPLIRSA-N 0 3 279.380 2.547 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756603005 574251658 /nfs/dbraw/zinc/25/16/58/574251658.db2.gz HLSFLYPWMSIIBS-STQMWFEESA-N 0 3 283.437 2.774 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)c2ccc(C)o2)c1 ZINC000756606019 574252020 /nfs/dbraw/zinc/25/20/20/574252020.db2.gz KOZLUDZQBUXRJU-XHDPSFHLSA-N 0 3 291.347 2.686 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CC[C@H](C)C2)c([O-])c1 ZINC000756626222 574253099 /nfs/dbraw/zinc/25/30/99/574253099.db2.gz AXLCEGMEWGLSPP-UONOGXRCSA-N 0 3 262.397 2.693 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000756628616 574253194 /nfs/dbraw/zinc/25/31/94/574253194.db2.gz WKMPCCWPMSGFNH-RWMBFGLXSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@]2(O)CCSC2)c2c1c(F)ccc2[O-] ZINC000756636322 574253947 /nfs/dbraw/zinc/25/39/47/574253947.db2.gz ITTAJFZVBWCNIT-BPYAMOTFSA-N 0 3 297.395 2.537 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCNc2cnccn2)c([O-])c1C ZINC000756645704 574255033 /nfs/dbraw/zinc/25/50/33/574255033.db2.gz JGPHNRVQFFHSMP-ZDUSSCGKSA-N 0 3 286.379 2.562 20 10 CFCDHN C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756645058 574255337 /nfs/dbraw/zinc/25/53/37/574255337.db2.gz DLMKKVKCKOEGAQ-WOPDTQHZSA-N 0 3 267.344 2.997 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)C[C@@H]2CCOC2)c1 ZINC000756644949 574255343 /nfs/dbraw/zinc/25/53/43/574255343.db2.gz DJNCGFTTWAZOOC-AGIUHOORSA-N 0 3 279.380 2.867 20 10 CFCDHN COCCOC[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756732003 574259358 /nfs/dbraw/zinc/25/93/58/574259358.db2.gz FIVBLNXVSJJLOY-OCCSQVGLSA-N 0 3 281.396 2.711 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756731997 574259701 /nfs/dbraw/zinc/25/97/01/574259701.db2.gz FIVBLNXVSJJLOY-GXTWGEPZSA-N 0 3 281.396 2.711 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)C2CC2)c([O-])c1C ZINC000756738755 574259879 /nfs/dbraw/zinc/25/98/79/574259879.db2.gz KXHNHYRLMDFOFX-DOMZBBRYSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)[S@](C)=O)c([O-])c1C ZINC000756762116 574260896 /nfs/dbraw/zinc/26/08/96/574260896.db2.gz OPTSNDDABHUVAV-AGMRTUQYSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1c(C[NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)cnn1C ZINC000756774516 574261892 /nfs/dbraw/zinc/26/18/92/574261892.db2.gz DKAJWTPEYBTHGO-TVQRCGJNSA-N 0 3 289.354 2.911 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cnccn2)c([O-])c1C ZINC000756788919 574263280 /nfs/dbraw/zinc/26/32/80/574263280.db2.gz YZGKKXSRDAHQTG-CYBMUJFWSA-N 0 3 271.364 2.692 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)Cc2ccncc2)c1 ZINC000749300275 574288786 /nfs/dbraw/zinc/28/87/86/574288786.db2.gz XZMUHFIHGRWHBF-ZDUSSCGKSA-N 0 3 256.349 2.816 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1CCC(OC)CC1 ZINC000749922210 574316103 /nfs/dbraw/zinc/31/61/03/574316103.db2.gz AMPMZFLBFHPQMP-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCc2ccco2)c1 ZINC000725841426 574324597 /nfs/dbraw/zinc/32/45/97/574324597.db2.gz DETSVNWINJNQDO-UHFFFAOYSA-N 0 3 261.321 2.716 20 10 CFCDHN COCC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000725841471 574324667 /nfs/dbraw/zinc/32/46/67/574324667.db2.gz JOIMIYSHHSHLHE-UHFFFAOYSA-N 0 3 257.333 2.795 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccco2)c([O-])c1 ZINC000725841540 574324698 /nfs/dbraw/zinc/32/46/98/574324698.db2.gz MNVAFNZOLSKZHP-UHFFFAOYSA-N 0 3 261.321 2.716 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCSC(F)(F)F ZINC000725847218 574328270 /nfs/dbraw/zinc/32/82/70/574328270.db2.gz FVPZIHDPBMUJAM-UHFFFAOYSA-N 0 3 281.299 2.743 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CC)C[C@H](C)CO)c([O-])c1 ZINC000743499650 574366979 /nfs/dbraw/zinc/36/69/79/574366979.db2.gz MNKOYAPSDDOTAR-GXTWGEPZSA-N 0 3 281.396 2.678 20 10 CFCDHN CC[NH+](CC)CC1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000743539870 574368338 /nfs/dbraw/zinc/36/83/38/574368338.db2.gz GCIURRIBAXUGPP-UHFFFAOYSA-N 0 3 296.436 2.648 20 10 CFCDHN Cc1ncc(CNCCCSc2nccs2)cn1 ZINC000752264893 574389626 /nfs/dbraw/zinc/38/96/26/574389626.db2.gz JIOWQYFARAUYHN-UHFFFAOYSA-N 0 3 280.422 2.514 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]Cc2cccnc2)c1[O-] ZINC000076274235 617989018 /nfs/dbraw/zinc/98/90/18/617989018.db2.gz DEAJWLJNXCXRJA-UHFFFAOYSA-N 0 3 278.739 2.739 20 10 CFCDHN COc1cc(Cl)cc(CNCc2cccnc2)c1O ZINC000076274235 617989025 /nfs/dbraw/zinc/98/90/25/617989025.db2.gz DEAJWLJNXCXRJA-UHFFFAOYSA-N 0 3 278.739 2.739 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2c([O-])cccc2Cl)CCN1C ZINC000090721207 617793485 /nfs/dbraw/zinc/79/34/85/617793485.db2.gz WEVUQMUJFZKNMC-GHMZBOCLSA-N 0 3 268.788 2.618 20 10 CFCDHN CC1(C)CNCC[C@H]1[NH2+]Cc1cccc(Cl)c1[O-] ZINC000841072008 620761716 /nfs/dbraw/zinc/76/17/16/620761716.db2.gz DPKGFBPYLUITCB-GFCCVEGCSA-N 0 3 268.788 2.523 20 10 CFCDHN CC[C@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000891251211 618082512 /nfs/dbraw/zinc/08/25/12/618082512.db2.gz AVAUFYXYTCMNDJ-XJKSGUPXSA-N 0 3 291.439 2.518 20 10 CFCDHN OCc1ccc(CNCCCSc2nccs2)o1 ZINC000176797457 618184595 /nfs/dbraw/zinc/18/45/95/618184595.db2.gz UOSFPOLUPJCJLF-UHFFFAOYSA-N 0 3 284.406 2.500 20 10 CFCDHN COc1ccc(CN[C@H](C)c2cccnc2)c(O)c1OC ZINC000892480329 618355483 /nfs/dbraw/zinc/35/54/83/618355483.db2.gz BGFGTALACSKKRN-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cc(C)cc(CNCc2ccnc(F)c2)c1O ZINC000895448065 618591492 /nfs/dbraw/zinc/59/14/92/618591492.db2.gz XIGAQJACYICJIT-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN Cc1ccnc(N)c1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000895459390 618596652 /nfs/dbraw/zinc/59/66/52/618596652.db2.gz AJCXTDMFQGGLMC-LLVKDONJSA-N 0 3 257.337 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)CCO)c1[O-] ZINC000808697669 631030688 /nfs/dbraw/zinc/03/06/88/631030688.db2.gz QQXKFHNQXFNJCJ-UWVGGRQHSA-N 0 3 257.761 2.776 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000311806222 618723936 /nfs/dbraw/zinc/72/39/36/618723936.db2.gz CCDYLGZCUWRRQT-GXTWGEPZSA-N 0 3 262.397 2.699 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(=O)NC(C)(C)C)c([O-])c1 ZINC000228334801 618893298 /nfs/dbraw/zinc/89/32/98/618893298.db2.gz SCRAKUJOBTZEAU-GFCCVEGCSA-N 0 3 278.396 2.656 20 10 CFCDHN C[C@@H]([NH2+][C@H]1COCC1(C)C)c1cc(F)ccc1[O-] ZINC000313061250 618973959 /nfs/dbraw/zinc/97/39/59/618973959.db2.gz HZMMKTWVRFKMCT-RNCFNFMXSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COCC1(C)C)c1cc(F)ccc1[O-] ZINC000313061255 618974211 /nfs/dbraw/zinc/97/42/11/618974211.db2.gz HZMMKTWVRFKMCT-TVQRCGJNSA-N 0 3 253.317 2.607 20 10 CFCDHN Cn1cc(C[NH2+]Cc2ccccc2[O-])c(C(C)(C)C)n1 ZINC000162921194 619078866 /nfs/dbraw/zinc/07/88/66/619078866.db2.gz UPRDCSXQTQFUNF-UHFFFAOYSA-N 0 3 273.380 2.713 20 10 CFCDHN CCCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000005097660 619085689 /nfs/dbraw/zinc/08/56/89/619085689.db2.gz QSESATKMYMHENC-MRXNPFEDSA-N 0 3 291.439 2.662 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](C)CCOC)c([O-])c1 ZINC000840955638 619137448 /nfs/dbraw/zinc/13/74/48/619137448.db2.gz UCVFVCDBGXJVJY-LBPRGKRZSA-N 0 3 267.369 2.553 20 10 CFCDHN CNC(=O)[C@@]1(C)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000320139459 619158721 /nfs/dbraw/zinc/15/87/21/619158721.db2.gz FGWSRVRWUWXVIG-SFHVURJKSA-N 0 3 298.386 2.503 20 10 CFCDHN CNC(=O)[C@@]1(C)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000320139459 619158725 /nfs/dbraw/zinc/15/87/25/619158725.db2.gz FGWSRVRWUWXVIG-SFHVURJKSA-N 0 3 298.386 2.503 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781987 619465862 /nfs/dbraw/zinc/46/58/62/619465862.db2.gz IHHJEAPZASDMHS-NHYWBVRUSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781987 619465865 /nfs/dbraw/zinc/46/58/65/619465865.db2.gz IHHJEAPZASDMHS-NHYWBVRUSA-N 0 3 296.361 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000895528930 619547893 /nfs/dbraw/zinc/54/78/93/619547893.db2.gz BWLUCUVJWZTOED-ZDUSSCGKSA-N 0 3 263.381 2.995 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](CF)C2)c([O-])c1 ZINC000895572492 619557418 /nfs/dbraw/zinc/55/74/18/619557418.db2.gz FDZZOAKLTXBYII-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](CF)C2)c([O-])c1 ZINC000895572492 619557419 /nfs/dbraw/zinc/55/74/19/619557419.db2.gz FDZZOAKLTXBYII-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000895791618 619607725 /nfs/dbraw/zinc/60/77/25/619607725.db2.gz UAKIRLMUYIVMIR-CYBMUJFWSA-N 0 3 261.365 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000896281261 619709295 /nfs/dbraw/zinc/70/92/95/619709295.db2.gz VKYLFZURVKOXTC-GWCFXTLKSA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)CCc2ccccc2)c([O-])c1 ZINC000896517651 619755074 /nfs/dbraw/zinc/75/50/74/619755074.db2.gz HEOAMNMGFKHXQY-KRWDZBQOSA-N 0 3 285.387 2.784 20 10 CFCDHN CCc1[nH]nc(Cl)c1C[NH2+]Cc1c([O-])cccc1F ZINC000896642081 619781977 /nfs/dbraw/zinc/78/19/77/619781977.db2.gz PSGZACWMPRYINZ-UHFFFAOYSA-N 0 3 283.734 2.760 20 10 CFCDHN CCc1[nH]nc(Cl)c1CNCc1c(O)cccc1F ZINC000896642081 619781979 /nfs/dbraw/zinc/78/19/79/619781979.db2.gz PSGZACWMPRYINZ-UHFFFAOYSA-N 0 3 283.734 2.760 20 10 CFCDHN COc1cc(C)cc(CNCc2cccc3c2OCC3)c1O ZINC000897206554 619949911 /nfs/dbraw/zinc/94/99/11/619949911.db2.gz MRMBDFPPTWWRSQ-UHFFFAOYSA-N 0 3 299.370 2.934 20 10 CFCDHN Cc1cnccc1CNCc1ccc2c(c1)CCO2 ZINC000228654957 619964767 /nfs/dbraw/zinc/96/47/67/619964767.db2.gz YVJMWSJZYBGVFV-UHFFFAOYSA-N 0 3 254.333 2.615 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2cscn2)c1[O-] ZINC000228675389 620072831 /nfs/dbraw/zinc/07/28/31/620072831.db2.gz IIMCMIOKMZFYTE-UHFFFAOYSA-N 0 3 298.795 2.843 20 10 CFCDHN CN(C)c1ccc(CN(C)Cc2ccncc2)cc1 ZINC000163369567 620107825 /nfs/dbraw/zinc/10/78/25/620107825.db2.gz ZUKCVJJAYAWLSU-UHFFFAOYSA-N 0 3 255.365 2.780 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cncs2)c1O ZINC000897934525 620304423 /nfs/dbraw/zinc/30/44/23/620304423.db2.gz KWVMFIAPKPYROT-VIFPVBQESA-N 0 3 264.350 2.708 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]12C[C@H]1COC21CCC1 ZINC000898065467 620330393 /nfs/dbraw/zinc/33/03/93/620330393.db2.gz WCLNWGSGOMABAO-XJKSGUPXSA-N 0 3 273.376 2.749 20 10 CFCDHN CC[C@](C)(C[NH2+][C@@H](C)c1cc(F)ccc1[O-])OC ZINC000322839717 620392730 /nfs/dbraw/zinc/39/27/30/620392730.db2.gz FJSMNRIESZWDLX-IINYFYTJSA-N 0 3 255.333 2.997 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000927019963 620440281 /nfs/dbraw/zinc/44/02/81/620440281.db2.gz VBYUDJREOXYRBW-ZYHUDNBSSA-N 0 3 255.333 2.733 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1)c1ccccc1[O-] ZINC000183312224 625465133 /nfs/dbraw/zinc/46/51/33/625465133.db2.gz SAWZLENODSTGQI-HNNXBMFYSA-N 0 3 284.359 2.732 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H]2CNCCC2(F)F)cc1 ZINC000841075693 621280547 /nfs/dbraw/zinc/28/05/47/621280547.db2.gz UVNHUXPEFNMIJA-OAHLLOKOSA-N 0 3 297.393 2.620 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CO)CCc1ccccc1)CC2 ZINC000903292109 621311433 /nfs/dbraw/zinc/31/14/33/621311433.db2.gz BFDAYESCLCEZMJ-SJORKVTESA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1COCC[C@H]1OC)c1ccc(C)cc1[O-] ZINC000903300168 621314124 /nfs/dbraw/zinc/31/41/24/621314124.db2.gz WHULBALTCZJOSS-SQWLQELKSA-N 0 3 279.380 2.545 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCN(C)[C@@H]2C)c2c1c(F)ccc2[O-] ZINC000903301578 621315967 /nfs/dbraw/zinc/31/59/67/621315967.db2.gz SBFDROLFZXWHSR-AAXDQBDMSA-N 0 3 278.371 2.762 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c2c1c(F)ccc2[O-] ZINC000903286225 621318096 /nfs/dbraw/zinc/31/80/96/621318096.db2.gz DUQDQFKLMHLKTC-FUHNOWHXSA-N 0 3 289.350 2.845 20 10 CFCDHN CC[C@H]([NH2+]C1CC(CCO)C1)c1ccc(C)cc1[O-] ZINC000903328744 621340135 /nfs/dbraw/zinc/34/01/35/621340135.db2.gz FKCUFSONGCXTAS-PIMMBPRGSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+]CCCOCC1CCOCC1)c1ccccc1[O-] ZINC000183524824 625515013 /nfs/dbraw/zinc/51/50/13/625515013.db2.gz RORQKGCXQQPXLR-AWEZNQCLSA-N 0 3 293.407 2.876 20 10 CFCDHN COc1cc(CN2CC[C@H](OC(F)F)C2)c(O)cc1C ZINC000802746934 622241593 /nfs/dbraw/zinc/24/15/93/622241593.db2.gz BCANZZAPQXVYBY-NSHDSACASA-N 0 3 287.306 2.523 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCN1CCOC)c1ccccc1[O-] ZINC000155604815 622306926 /nfs/dbraw/zinc/30/69/26/622306926.db2.gz OBBHRMKQARYHDN-GOEBONIOSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1ccc(OCC[NH2+]Cc2ccccc2[O-])cc1 ZINC000076262600 625567972 /nfs/dbraw/zinc/56/79/72/625567972.db2.gz FLDBBEIJQLFTHK-UHFFFAOYSA-N 0 3 273.332 2.569 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000156685566 622954362 /nfs/dbraw/zinc/95/43/62/622954362.db2.gz BYQVBPUXVAHOTN-GXTWGEPZSA-N 0 3 290.407 2.832 20 10 CFCDHN Cc1noc(C)c1[C@H](C)NCc1cc(F)ccc1O ZINC000226610071 623083499 /nfs/dbraw/zinc/08/34/99/623083499.db2.gz WWMGDTCMQNTHFX-QMMMGPOBSA-N 0 3 264.300 2.987 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2CCC(O)CC2)c1 ZINC000227623527 623114387 /nfs/dbraw/zinc/11/43/87/623114387.db2.gz BAVQEPQTWVTCIV-HSBZDZAISA-N 0 3 263.381 2.902 20 10 CFCDHN CN(C)c1ccc(CN2CC(CC(F)F)C2)cc1 ZINC000822521201 623121246 /nfs/dbraw/zinc/12/12/46/623121246.db2.gz YEFWMNHUIMHBDA-UHFFFAOYSA-N 0 3 254.324 2.840 20 10 CFCDHN CCN(CCC[NH+](C)C)Cc1c([O-])cccc1Cl ZINC000230744847 623296324 /nfs/dbraw/zinc/29/63/24/623296324.db2.gz ILDOQQWTRXNFQA-UHFFFAOYSA-N 0 3 270.804 2.819 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@](C)(CC)OC)c([O-])c1 ZINC000824743983 623556594 /nfs/dbraw/zinc/55/65/94/623556594.db2.gz ULOOVOSCJLGMNU-OAHLLOKOSA-N 0 3 267.369 2.696 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000824914768 623586787 /nfs/dbraw/zinc/58/67/87/623586787.db2.gz YQGFEDDBCBPOSU-CYBMUJFWSA-N 0 3 267.369 2.859 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000824914768 623586794 /nfs/dbraw/zinc/58/67/94/623586794.db2.gz YQGFEDDBCBPOSU-CYBMUJFWSA-N 0 3 267.369 2.859 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCN(C)C(C)C)cc1Cl ZINC000825186083 623647093 /nfs/dbraw/zinc/64/70/93/623647093.db2.gz VWQUHDCJWKRQKO-UHFFFAOYSA-N 0 3 270.804 2.784 20 10 CFCDHN COC[C@@H]1CCCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000825294162 623665668 /nfs/dbraw/zinc/66/56/68/623665668.db2.gz IMHINDKZNPLBIU-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN Cc1cccc(CN2CCO[C@](C)(C3CC3)C2)c1O ZINC000826877770 623901248 /nfs/dbraw/zinc/90/12/48/623901248.db2.gz LYBLATOFKVVLOI-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@@](C)(C3CC3)C2)c1 ZINC000826877749 623901429 /nfs/dbraw/zinc/90/14/29/623901429.db2.gz LIPXXGVCALZRKQ-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN COc1cnccc1[C@H](C)NCc1cc(C)ccc1O ZINC000189561674 625697409 /nfs/dbraw/zinc/69/74/09/625697409.db2.gz PGSRBFMVXVCECE-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])NC(=O)OC(C)(C)C ZINC000194945490 625700851 /nfs/dbraw/zinc/70/08/51/625700851.db2.gz GLACPRISPMSCHT-SNVBAGLBSA-N 0 3 298.358 2.534 20 10 CFCDHN Cc1n[nH]cc1[C@@H](C)NCc1ccc(N(C)C)cc1 ZINC000180010911 624989417 /nfs/dbraw/zinc/98/94/17/624989417.db2.gz RTWLYGUOQOMCRE-LLVKDONJSA-N 0 3 258.369 2.635 20 10 CFCDHN Cc1cc(CN(C)C)cc(NC(=O)Cc2ccc(N)cc2)c1 ZINC000831466553 625030940 /nfs/dbraw/zinc/03/09/40/625030940.db2.gz YGBYYAUINAYTGL-UHFFFAOYSA-N 0 3 297.402 2.820 20 10 CFCDHN C[C@@H](Cc1ccncc1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834615873 625736115 /nfs/dbraw/zinc/73/61/15/625736115.db2.gz JKONIAYWVOBSRN-WFASDCNBSA-N 0 3 268.360 2.995 20 10 CFCDHN Cc1nn(C)c(C)c1CCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834701741 625791569 /nfs/dbraw/zinc/79/15/69/625791569.db2.gz FNPUJBNTPSGWRO-MRXNPFEDSA-N 0 3 299.418 2.952 20 10 CFCDHN CC(C)C[NH+]1CCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000112642517 625905061 /nfs/dbraw/zinc/90/50/61/625905061.db2.gz NNPOUWPMGIKSBL-UHFFFAOYSA-N 0 3 282.815 2.819 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCC2(CO)CC2)c2c1c(F)ccc2[O-] ZINC000834895971 625912810 /nfs/dbraw/zinc/91/28/10/625912810.db2.gz GFICKAMVWCYVMZ-ZYHUDNBSSA-N 0 3 279.355 2.832 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cnc(C)cn1)c1ccccc1[O-] ZINC000834908771 625920001 /nfs/dbraw/zinc/92/00/01/625920001.db2.gz MAJWRGLWHCLHRN-OAHLLOKOSA-N 0 3 271.364 2.774 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-])C(=O)NC ZINC000834913883 625920614 /nfs/dbraw/zinc/92/06/14/625920614.db2.gz QKNFAEDBAPCEBN-JOYOIKCWSA-N 0 3 284.787 2.529 20 10 CFCDHN CC[C@@H]([NH2+]C[C@](C)(O)C(C)C)c1ccccc1[O-] ZINC000186189190 626011966 /nfs/dbraw/zinc/01/19/66/626011966.db2.gz CUJHOACGYZHJQP-HIFRSBDPSA-N 0 3 251.370 2.840 20 10 CFCDHN Cn1cc(C(C)(C)NCc2ccc3c(c2)CCCO3)cn1 ZINC000921782603 626121483 /nfs/dbraw/zinc/12/14/83/626121483.db2.gz SNBYLBYZDGCYKW-UHFFFAOYSA-N 0 3 285.391 2.770 20 10 CFCDHN OCc1ccc(CNCc2ccc3c(c2)CCCO3)cc1 ZINC000922209664 626240342 /nfs/dbraw/zinc/24/03/42/626240342.db2.gz RFLUBRCYFOCPMQ-UHFFFAOYSA-N 0 3 283.371 2.794 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000922432302 626288950 /nfs/dbraw/zinc/28/89/50/626288950.db2.gz GJPYGPAWZSXUBO-YNEHKIRRSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC000922432299 626289192 /nfs/dbraw/zinc/28/91/92/626289192.db2.gz GJPYGPAWZSXUBO-AVGNSLFASA-N 0 3 261.365 2.927 20 10 CFCDHN CN1CC[C@@H]1C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000922576135 626314530 /nfs/dbraw/zinc/31/45/30/626314530.db2.gz UURVSNBOIKBLQD-QGZVFWFLSA-N 0 3 282.387 2.853 20 10 CFCDHN COCC[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-] ZINC000186914257 626403692 /nfs/dbraw/zinc/40/36/92/626403692.db2.gz LXWWZHPMGRLPRU-SECBINFHSA-N 0 3 288.185 2.760 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](C[C@@H](O)C1CC1)C1CCCC1 ZINC000838844904 626509963 /nfs/dbraw/zinc/50/99/63/626509963.db2.gz BGZONCGLPZNJHW-QGZVFWFLSA-N 0 3 275.392 2.908 20 10 CFCDHN [O-]c1ccccc1C[N@H+](C[C@@H](O)C1CC1)C1CCCC1 ZINC000838844904 626509964 /nfs/dbraw/zinc/50/99/64/626509964.db2.gz BGZONCGLPZNJHW-QGZVFWFLSA-N 0 3 275.392 2.908 20 10 CFCDHN CCN(C)c1ccc(CN2CCCc3c(cnn3C)C2)cc1 ZINC000839623892 626548554 /nfs/dbraw/zinc/54/85/54/626548554.db2.gz AYSKIIAJSCZDND-UHFFFAOYSA-N 0 3 298.434 2.825 20 10 CFCDHN C[C@@H]([NH3+])[C@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000843052417 626549083 /nfs/dbraw/zinc/54/90/83/626549083.db2.gz SUQLSTIOUSSZCN-ZJUUUORDSA-N 0 3 286.778 2.744 20 10 CFCDHN Cc1cccc(CNCc2nn(C)c3ccccc23)c1O ZINC000761226324 626817107 /nfs/dbraw/zinc/81/71/07/626817107.db2.gz OSBZDAAXNPFZPC-UHFFFAOYSA-N 0 3 281.359 2.877 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1COC(C)(C)O1 ZINC000851791797 634532416 /nfs/dbraw/zinc/53/24/16/634532416.db2.gz GWVQZAHQHURYNV-AWEZNQCLSA-N 0 3 279.380 2.756 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H]1COC(C)(C)O1 ZINC000851791797 634532419 /nfs/dbraw/zinc/53/24/19/634532419.db2.gz GWVQZAHQHURYNV-AWEZNQCLSA-N 0 3 279.380 2.756 20 10 CFCDHN CCOCc1cc(CNC2(COC)CC2)ccc1OC ZINC000765264468 627127592 /nfs/dbraw/zinc/12/75/92/627127592.db2.gz UINPKVFOYDYRPE-UHFFFAOYSA-N 0 3 279.380 2.500 20 10 CFCDHN CC[C@H](NCc1ccc2c(c1)CCO2)c1cnn(C)c1 ZINC000765609462 627150743 /nfs/dbraw/zinc/15/07/43/627150743.db2.gz OVIFIVSHNNUZTF-HNNXBMFYSA-N 0 3 271.364 2.596 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000766223718 627186053 /nfs/dbraw/zinc/18/60/53/627186053.db2.gz JEFOGYKWMVLIEG-CQSZACIVSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@]1(C)CCO[C@@H]1C1CC1 ZINC000767195175 627238651 /nfs/dbraw/zinc/23/86/51/627238651.db2.gz IXYXEGZBZVKMBT-SJORKVTESA-N 0 3 291.391 2.696 20 10 CFCDHN C[N@H+](CCCn1ccnc1)Cc1c([O-])ccc2ccncc21 ZINC000767759817 627283363 /nfs/dbraw/zinc/28/33/63/627283363.db2.gz UYVYVLVAKKVGLC-UHFFFAOYSA-N 0 3 296.374 2.659 20 10 CFCDHN C[N@@H+](CCCn1ccnc1)Cc1c([O-])ccc2ccncc21 ZINC000767759817 627283368 /nfs/dbraw/zinc/28/33/68/627283368.db2.gz UYVYVLVAKKVGLC-UHFFFAOYSA-N 0 3 296.374 2.659 20 10 CFCDHN CC[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768448429 627343877 /nfs/dbraw/zinc/34/38/77/627343877.db2.gz UXABBWNJKVYARL-BLLLJJGKSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768448429 627343880 /nfs/dbraw/zinc/34/38/80/627343880.db2.gz UXABBWNJKVYARL-BLLLJJGKSA-N 0 3 291.391 2.830 20 10 CFCDHN CN(Cc1n[nH]c2ccccc21)Cc1ccccc1O ZINC000768873640 627381882 /nfs/dbraw/zinc/38/18/82/627381882.db2.gz STNGEHVCYXTQAK-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN CCCC[N@H+](CCOC)Cc1c([O-])cccc1OC ZINC000769390010 627433806 /nfs/dbraw/zinc/43/38/06/627433806.db2.gz TXYNYMNSGPGICK-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCC[N@@H+](CCOC)Cc1c([O-])cccc1OC ZINC000769390010 627433807 /nfs/dbraw/zinc/43/38/07/627433807.db2.gz TXYNYMNSGPGICK-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000769519581 627451440 /nfs/dbraw/zinc/45/14/40/627451440.db2.gz SQXSGEPLCBSNDG-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000769519581 627451444 /nfs/dbraw/zinc/45/14/44/627451444.db2.gz SQXSGEPLCBSNDG-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000770374986 627516167 /nfs/dbraw/zinc/51/61/67/627516167.db2.gz PMKLUSVJWIWBBR-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000770374986 627516172 /nfs/dbraw/zinc/51/61/72/627516172.db2.gz PMKLUSVJWIWBBR-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN CC(C)[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)N(C)C ZINC000773018931 627769946 /nfs/dbraw/zinc/76/99/46/627769946.db2.gz JKESNTARTHJBIP-XJKSGUPXSA-N 0 3 291.439 2.516 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](O)c1ccc(C)cc1 ZINC000775021686 627985493 /nfs/dbraw/zinc/98/54/93/627985493.db2.gz SVAWCSFGBAVUJR-INIZCTEOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ncc(CN[C@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000775363990 628015386 /nfs/dbraw/zinc/01/53/86/628015386.db2.gz ONSZKBDHCVIYLY-GFCCVEGCSA-N 0 3 270.380 2.702 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCO)C1CCOCC1)c1ccccc1[O-] ZINC000775555189 628036892 /nfs/dbraw/zinc/03/68/92/628036892.db2.gz KCYHOHOKDIOJQT-HOTGVXAUSA-N 0 3 293.407 2.611 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCOC[C@@H]2C)c1[O-] ZINC000775704321 628056607 /nfs/dbraw/zinc/05/66/07/628056607.db2.gz APRJNNKILRBEIW-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCOC[C@@H]2C)c1[O-] ZINC000775704321 628056610 /nfs/dbraw/zinc/05/66/10/628056610.db2.gz APRJNNKILRBEIW-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCCOC[C@@H]2C)c1O ZINC000775704321 628056612 /nfs/dbraw/zinc/05/66/12/628056612.db2.gz APRJNNKILRBEIW-NSHDSACASA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cccc(CNCc2cccc3c2OCCO3)c1O ZINC000775758373 628063655 /nfs/dbraw/zinc/06/36/55/628063655.db2.gz BXNPOOSODLBJSL-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN CCC(C)(C)NC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775829946 628073441 /nfs/dbraw/zinc/07/34/41/628073441.db2.gz BHIJCHCQRMNDTI-CYBMUJFWSA-N 0 3 291.439 2.708 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](COC)OC ZINC000852018303 634627628 /nfs/dbraw/zinc/62/76/28/634627628.db2.gz LJQKAJIHKOQEID-OAHLLOKOSA-N 0 3 281.396 2.656 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](COC)OC ZINC000852018303 634627632 /nfs/dbraw/zinc/62/76/32/634627632.db2.gz LJQKAJIHKOQEID-OAHLLOKOSA-N 0 3 281.396 2.656 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H](C)N(C)C[C@H]2C)c1O ZINC000775985510 628091329 /nfs/dbraw/zinc/09/13/29/628091329.db2.gz LZBWYEVTCWVRMP-GHMZBOCLSA-N 0 3 298.814 2.579 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H]1CCN(CC)C1=O ZINC000852019457 634629358 /nfs/dbraw/zinc/62/93/58/634629358.db2.gz ZEVWWVMDSWJWDZ-HNNXBMFYSA-N 0 3 290.407 2.615 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H]1CCN(CC)C1=O ZINC000852019457 634629362 /nfs/dbraw/zinc/62/93/62/634629362.db2.gz ZEVWWVMDSWJWDZ-HNNXBMFYSA-N 0 3 290.407 2.615 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000779035304 628347438 /nfs/dbraw/zinc/34/74/38/628347438.db2.gz YIGMTEROIZZVHV-OLZOCXBDSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000779035304 628347442 /nfs/dbraw/zinc/34/74/42/628347442.db2.gz YIGMTEROIZZVHV-OLZOCXBDSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000779035308 628347806 /nfs/dbraw/zinc/34/78/06/628347806.db2.gz YIGMTEROIZZVHV-STQMWFEESA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000779035308 628347810 /nfs/dbraw/zinc/34/78/10/628347810.db2.gz YIGMTEROIZZVHV-STQMWFEESA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCN1CCc2ccccc21 ZINC000779058256 628348275 /nfs/dbraw/zinc/34/82/75/628348275.db2.gz LDBRACMCFGLBLN-UHFFFAOYSA-N 0 3 286.350 2.684 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC=CO2)c([O-])c1 ZINC000780565635 628477851 /nfs/dbraw/zinc/47/78/51/628477851.db2.gz DVKUCRLAEWMXLS-CQSZACIVSA-N 0 3 263.337 2.573 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000783504878 628713653 /nfs/dbraw/zinc/71/36/53/628713653.db2.gz PCGYGNJSDJVXDM-HOCLYGCPSA-N 0 3 285.387 2.894 20 10 CFCDHN C[C@H]([NH2+]CCOc1cccnc1)c1ccccc1[O-] ZINC000783508562 628714346 /nfs/dbraw/zinc/71/43/46/628714346.db2.gz FMVWTYBZYOZIJV-LBPRGKRZSA-N 0 3 258.321 2.517 20 10 CFCDHN C[C@H]([NH2+]C1CCN(CC(F)F)CC1)c1ccccc1[O-] ZINC000783509521 628714649 /nfs/dbraw/zinc/71/46/49/628714649.db2.gz SZYACERWXAXRLT-NSHDSACASA-N 0 3 284.350 2.772 20 10 CFCDHN CCCCN(C)CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000783510659 628714701 /nfs/dbraw/zinc/71/47/01/628714701.db2.gz QRULQTOGFPOPLT-CYBMUJFWSA-N 0 3 250.386 2.775 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)C[C@@H](C)O)c1[O-] ZINC000783602556 628725967 /nfs/dbraw/zinc/72/59/67/628725967.db2.gz PDHMQBOHYZDVPP-VHSXEESVSA-N 0 3 257.761 2.603 20 10 CFCDHN CO[C@H](C)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000785572423 628894593 /nfs/dbraw/zinc/89/45/93/628894593.db2.gz GSCGOLGKEAYBQM-NGZCFLSTSA-N 0 3 253.317 2.704 20 10 CFCDHN COc1cccc(O)c1CN1CC(C)(C)OC(C)(C)C1 ZINC000785991524 628928339 /nfs/dbraw/zinc/92/83/39/628928339.db2.gz NHRIUFGISCVNPJ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000785989174 628928735 /nfs/dbraw/zinc/92/87/35/628928735.db2.gz TWOPEZIBYVXJHK-SUNKGSAMSA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000785989174 628928736 /nfs/dbraw/zinc/92/87/36/628928736.db2.gz TWOPEZIBYVXJHK-SUNKGSAMSA-N 0 3 267.344 2.513 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@H](O)C[C@@H]2C)cc1F ZINC000788270832 629054424 /nfs/dbraw/zinc/05/44/24/629054424.db2.gz SOGOTXMNYHCXBP-GXTWGEPZSA-N 0 3 280.387 2.627 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2(CO)CCC2)c([O-])c1 ZINC000788741040 629096256 /nfs/dbraw/zinc/09/62/56/629096256.db2.gz SLTFJRLPVSMQLP-CYBMUJFWSA-N 0 3 263.381 2.822 20 10 CFCDHN C[C@@H](O)CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000789347506 629149178 /nfs/dbraw/zinc/14/91/78/629149178.db2.gz GHYVRTGFIYDWLO-GDBMZVCRSA-N 0 3 293.407 2.534 20 10 CFCDHN C[C@@H](O)CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000789347506 629149180 /nfs/dbraw/zinc/14/91/80/629149180.db2.gz GHYVRTGFIYDWLO-GDBMZVCRSA-N 0 3 293.407 2.534 20 10 CFCDHN Cc1c(CN(C)Cc2cc(C)c(C)cc2O)cnn1C ZINC000790418314 629237645 /nfs/dbraw/zinc/23/76/45/629237645.db2.gz UUNDRUDQGZLILI-UHFFFAOYSA-N 0 3 273.380 2.683 20 10 CFCDHN Cc1c(CN(C)Cc2cc3c(cc2O)CCCC3)cnn1C ZINC000790417163 629237742 /nfs/dbraw/zinc/23/77/42/629237742.db2.gz GRBHRTCOFCKNKL-UHFFFAOYSA-N 0 3 299.418 2.945 20 10 CFCDHN CCN(C)c1ccc(CNCc2ccc3c(c2)CCO3)cn1 ZINC000790954957 629273403 /nfs/dbraw/zinc/27/34/03/629273403.db2.gz HHBFSPLJUAIKGS-UHFFFAOYSA-N 0 3 297.402 2.762 20 10 CFCDHN C[C@@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CCCO1 ZINC000835024905 629320839 /nfs/dbraw/zinc/32/08/39/629320839.db2.gz ASADKHZBINEDSB-CSPWOOARSA-N 0 3 274.408 2.877 20 10 CFCDHN CCC(C)(C)OCC[NH2+]Cc1c([O-])cccc1OC ZINC000835085394 629384193 /nfs/dbraw/zinc/38/41/93/629384193.db2.gz PAGCAAMHUCNDCX-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CC(C)C1CN(Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000793190723 629502002 /nfs/dbraw/zinc/50/20/02/629502002.db2.gz WOVHZKNOOPCCNZ-UHFFFAOYSA-N 0 3 292.398 2.750 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC000793250060 629513695 /nfs/dbraw/zinc/51/36/95/629513695.db2.gz JDXFNCPUEBLIDZ-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](C)(O)CC2)c([O-])c1 ZINC000793250060 629513698 /nfs/dbraw/zinc/51/36/98/629513698.db2.gz JDXFNCPUEBLIDZ-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc(C[NH2+]CC2=Cc3ccccc3OC2)c([O-])c1 ZINC000793387264 629535932 /nfs/dbraw/zinc/53/59/32/629535932.db2.gz BNHABPPZBLFONH-UHFFFAOYSA-N 0 3 297.354 2.966 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])C[C@@H]1Cc1ccccc1 ZINC000793620047 629579990 /nfs/dbraw/zinc/57/99/90/629579990.db2.gz JWUAKWLQMPXSPY-SFHVURJKSA-N 0 3 296.414 2.751 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])C[C@@H]1Cc1ccccc1 ZINC000793620047 629579992 /nfs/dbraw/zinc/57/99/92/629579992.db2.gz JWUAKWLQMPXSPY-SFHVURJKSA-N 0 3 296.414 2.751 20 10 CFCDHN CC[C@@H]([NH2+]CCCOCCOC)c1ccc(C)cc1[O-] ZINC000794791286 629686522 /nfs/dbraw/zinc/68/65/22/629686522.db2.gz HLWZCEMYERUXPK-OAHLLOKOSA-N 0 3 281.396 2.794 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)COCC1CC1)c1ccc(C)cc1[O-] ZINC000794802659 629687667 /nfs/dbraw/zinc/68/76/67/629687667.db2.gz GIDUPDKNPWINSN-HOCLYGCPSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)COCC(C)C)c1ccc(C)cc1[O-] ZINC000794801924 629688118 /nfs/dbraw/zinc/68/81/18/629688118.db2.gz LIKUFNDSBOYSIF-GOEBONIOSA-N 0 3 295.423 2.775 20 10 CFCDHN CC[C@@H]([NH2+]C[C@]1(CCO)CCOC1)c1ccc(C)cc1[O-] ZINC000794811573 629688793 /nfs/dbraw/zinc/68/87/93/629688793.db2.gz RQMVXQMGDBMNJO-WBVHZDCISA-N 0 3 293.407 2.530 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCC[C@@H]1C(=O)NC)c1ccc(C)cc1[O-] ZINC000794817847 629690318 /nfs/dbraw/zinc/69/03/18/629690318.db2.gz PKEBDQSMHUVLGT-SOUVJXGZSA-N 0 3 290.407 2.656 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)CC(F)F)c1ccc(C)cc1[O-] ZINC000794817695 629690531 /nfs/dbraw/zinc/69/05/31/629690531.db2.gz UUJCCNXQDNCQDS-CMPLNLGQSA-N 0 3 273.323 2.757 20 10 CFCDHN CN(CCC[NH+]1CCCC1)Cc1c([O-])cccc1Cl ZINC000798958090 630263966 /nfs/dbraw/zinc/26/39/66/630263966.db2.gz LYTMVQXCOGXLAE-UHFFFAOYSA-N 0 3 282.815 2.963 20 10 CFCDHN CCCC[N@H+](CCCNC(C)=O)Cc1ccccc1[O-] ZINC000801595732 630461194 /nfs/dbraw/zinc/46/11/94/630461194.db2.gz RKIWPBJHAZZTIH-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN CCCC[N@@H+](CCCNC(C)=O)Cc1ccccc1[O-] ZINC000801595732 630461197 /nfs/dbraw/zinc/46/11/97/630461197.db2.gz RKIWPBJHAZZTIH-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN COC[C@H]1CC[N@@H+]1Cc1c([O-])ccc2ccc(OC)cc21 ZINC000840082423 630855720 /nfs/dbraw/zinc/85/57/20/630855720.db2.gz FFYQBVRYMBHICJ-CYBMUJFWSA-N 0 3 287.359 2.775 20 10 CFCDHN COC[C@H]1CC[N@H+]1Cc1c([O-])ccc2ccc(OC)cc21 ZINC000840082423 630855724 /nfs/dbraw/zinc/85/57/24/630855724.db2.gz FFYQBVRYMBHICJ-CYBMUJFWSA-N 0 3 287.359 2.775 20 10 CFCDHN COC[C@@H]1CC[N@@H+]1Cc1c([O-])ccc2ccc(OC)cc21 ZINC000840082425 630856053 /nfs/dbraw/zinc/85/60/53/630856053.db2.gz FFYQBVRYMBHICJ-ZDUSSCGKSA-N 0 3 287.359 2.775 20 10 CFCDHN COC[C@@H]1CC[N@H+]1Cc1c([O-])ccc2ccc(OC)cc21 ZINC000840082425 630856057 /nfs/dbraw/zinc/85/60/57/630856057.db2.gz FFYQBVRYMBHICJ-ZDUSSCGKSA-N 0 3 287.359 2.775 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCCN(C)C2=O)c1[O-] ZINC000808699957 631031311 /nfs/dbraw/zinc/03/13/11/631031311.db2.gz FZOYWOLMHRMADC-GXFFZTMASA-N 0 3 296.798 2.625 20 10 CFCDHN CC(C)NC(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000840891358 631253533 /nfs/dbraw/zinc/25/35/33/631253533.db2.gz RCMPCRBWXMMBTG-JFGNBEQYSA-N 0 3 294.370 2.582 20 10 CFCDHN CO[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000809693161 631264926 /nfs/dbraw/zinc/26/49/26/631264926.db2.gz OXYZRKOHCZYEGK-BETUJISGSA-N 0 3 269.772 2.963 20 10 CFCDHN CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000809693161 631264930 /nfs/dbraw/zinc/26/49/30/631264930.db2.gz OXYZRKOHCZYEGK-BETUJISGSA-N 0 3 269.772 2.963 20 10 CFCDHN CCCCCN(CC(N)=O)Cc1ccc(N(C)C)cc1C ZINC000840936501 631269433 /nfs/dbraw/zinc/26/94/33/631269433.db2.gz KGZHNQNLLNHTHE-UHFFFAOYSA-N 0 3 291.439 2.539 20 10 CFCDHN COC(=O)c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000809732997 631274300 /nfs/dbraw/zinc/27/43/00/631274300.db2.gz NVIXLIGIXKFQAA-UHFFFAOYSA-N 0 3 289.306 2.608 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCCc2c(cnn2C)C1 ZINC000840955447 631283313 /nfs/dbraw/zinc/28/33/13/631283313.db2.gz WKTSGOSAUVDKJR-UHFFFAOYSA-N 0 3 298.434 2.743 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H](CO)CC(C)C)c([O-])c1 ZINC000809767189 631284361 /nfs/dbraw/zinc/28/43/61/631284361.db2.gz HAIVRNOZCPGTDD-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H](CO)CC(C)C)c([O-])c1 ZINC000809767189 631284367 /nfs/dbraw/zinc/28/43/67/631284367.db2.gz HAIVRNOZCPGTDD-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN C[C@H](NCc1c([O-])ccc(Cl)c1F)[C@H]1CCC[NH2+]C1 ZINC000841034127 631314933 /nfs/dbraw/zinc/31/49/33/631314933.db2.gz WDPSPQCKAOFWHN-UWVGGRQHSA-N 0 3 286.778 2.662 20 10 CFCDHN C[C@@H](NCc1c([O-])ccc(Cl)c1F)[C@H]1CCC[NH2+]C1 ZINC000841034136 631315041 /nfs/dbraw/zinc/31/50/41/631315041.db2.gz WDPSPQCKAOFWHN-ZJUUUORDSA-N 0 3 286.778 2.662 20 10 CFCDHN C[C@@H]1CNCC[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841062806 631327594 /nfs/dbraw/zinc/32/75/94/631327594.db2.gz CORTYXCDABCKIX-PRHODGIISA-N 0 3 289.206 2.787 20 10 CFCDHN CC1([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CCNCC1 ZINC000841065067 631327855 /nfs/dbraw/zinc/32/78/55/631327855.db2.gz MEHNDEIWFYNAGO-UHFFFAOYSA-N 0 3 289.206 2.931 20 10 CFCDHN CC[C@H]([NH3+])CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000841069658 631328548 /nfs/dbraw/zinc/32/85/48/631328548.db2.gz CIBWKNYRHVUPKG-VIFPVBQESA-N 0 3 263.168 2.526 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1[O-])CN(C)C ZINC000841756825 631467728 /nfs/dbraw/zinc/46/77/28/631467728.db2.gz KLPRVRHYFXTMJH-MNOVXSKESA-N 0 3 270.804 2.894 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(CC(F)F)C2)c([O-])c1 ZINC000841763853 631469111 /nfs/dbraw/zinc/46/91/11/631469111.db2.gz DHNQIAUMKPXZIH-NEPJUHHUSA-N 0 3 284.350 2.691 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N(C)C)CC1)c1ccc(C)cc1[O-] ZINC000841764240 631469340 /nfs/dbraw/zinc/46/93/40/631469340.db2.gz UWUXIXDRBLFMMS-CQSZACIVSA-N 0 3 262.397 2.836 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C2CC2)C(C)(C)CO)c([O-])c1 ZINC000811518406 631575666 /nfs/dbraw/zinc/57/56/66/631575666.db2.gz JHFXGOGFVGTHJQ-MRXNPFEDSA-N 0 3 293.407 2.678 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCS[C@@H]2C)c([O-])c1 ZINC000842777716 631737853 /nfs/dbraw/zinc/73/78/53/631737853.db2.gz CNKZAWINULFSJH-ZWNOBZJWSA-N 0 3 267.394 2.775 20 10 CFCDHN C[C@@H]([NH2+]Cc1c2c(nn1C)CCCC2)c1ccccc1[O-] ZINC000812736430 631765142 /nfs/dbraw/zinc/76/51/42/631765142.db2.gz GCYLXECDUGXNFF-GFCCVEGCSA-N 0 3 285.391 2.855 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000842913661 631781396 /nfs/dbraw/zinc/78/13/96/631781396.db2.gz CXOVJNYRMNIOTJ-AVGNSLFASA-N 0 3 251.370 2.840 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@H+](C1CC1)C1CCNCC1 ZINC000843043879 631812086 /nfs/dbraw/zinc/81/20/86/631812086.db2.gz OOAQPCCFXNUYFH-UHFFFAOYSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@@H+](C1CC1)C1CCNCC1 ZINC000843043879 631812088 /nfs/dbraw/zinc/81/20/88/631812088.db2.gz OOAQPCCFXNUYFH-UHFFFAOYSA-N 0 3 280.799 2.762 20 10 CFCDHN C[NH2+]C[C@@H]1CCCN1Cc1c([O-])cc(C)cc1Cl ZINC000843055895 631819408 /nfs/dbraw/zinc/81/94/08/631819408.db2.gz RUANXJQFEKETIQ-NSHDSACASA-N 0 3 268.788 2.538 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843417074 631948781 /nfs/dbraw/zinc/94/87/81/631948781.db2.gz OWENVHZDHHUAKJ-DZGCQCFKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843417074 631948785 /nfs/dbraw/zinc/94/87/85/631948785.db2.gz OWENVHZDHHUAKJ-DZGCQCFKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419650 631949861 /nfs/dbraw/zinc/94/98/61/631949861.db2.gz NUBCJDHZBDURTL-AWEZNQCLSA-N 0 3 284.359 2.785 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419650 631949867 /nfs/dbraw/zinc/94/98/67/631949867.db2.gz NUBCJDHZBDURTL-AWEZNQCLSA-N 0 3 284.359 2.785 20 10 CFCDHN CCOc1ccc(CN2C[C@@H](C)OC3(CCC3)C2)c(O)c1 ZINC000843435146 631959856 /nfs/dbraw/zinc/95/98/56/631959856.db2.gz JATQYIOKQPAYSK-CYBMUJFWSA-N 0 3 291.391 2.934 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cc(F)cc(F)c1[O-] ZINC000813877176 631971646 /nfs/dbraw/zinc/97/16/46/631971646.db2.gz NIYJIVAFWFSATA-VHSXEESVSA-N 0 3 272.339 2.519 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnnn2-c2ccccc2)c1 ZINC000814296989 632050196 /nfs/dbraw/zinc/05/01/96/632050196.db2.gz AOPWHTKQJBWJAE-UHFFFAOYSA-N 0 3 294.358 2.571 20 10 CFCDHN [O-]c1c(C[NH2+]CCN2CCCC2)ccc2ccccc21 ZINC000816560970 632484183 /nfs/dbraw/zinc/48/41/83/632484183.db2.gz HEEAQMUCTCNTDK-UHFFFAOYSA-N 0 3 270.376 2.731 20 10 CFCDHN CCN1CCC[N@H+](Cc2ccc3ccccc3c2[O-])CC1=O ZINC000816588200 632490716 /nfs/dbraw/zinc/49/07/16/632490716.db2.gz IFKWRTRXQODUMA-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CCN1CCC[N@@H+](Cc2ccc3ccccc3c2[O-])CC1=O ZINC000816588200 632490719 /nfs/dbraw/zinc/49/07/19/632490719.db2.gz IFKWRTRXQODUMA-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CCNC(=O)[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])C(C)C ZINC000816637609 632499951 /nfs/dbraw/zinc/49/99/51/632499951.db2.gz JHQKYUDPDWPVGD-ZDUSSCGKSA-N 0 3 298.814 2.604 20 10 CFCDHN CCCN1C[C@@H](C[NH2+][C@H](CC)c2ccccc2[O-])CC1=O ZINC000817411724 632623789 /nfs/dbraw/zinc/62/37/89/632623789.db2.gz UOQXNGUMIYCFGR-UKRRQHHQSA-N 0 3 290.407 2.691 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412509 632624080 /nfs/dbraw/zinc/62/40/80/632624080.db2.gz MBRUNHOJWHOWJW-QWRGUYRKSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c1[O-] ZINC000817412509 632624082 /nfs/dbraw/zinc/62/40/82/632624082.db2.gz MBRUNHOJWHOWJW-QWRGUYRKSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCCC2(O)CCC2)c1[O-] ZINC000817415215 632626216 /nfs/dbraw/zinc/62/62/16/632626216.db2.gz UZAVSIQJIBOZPR-UHFFFAOYSA-N 0 3 299.798 2.839 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)COCC2CC2)c1[O-] ZINC000846072852 632629474 /nfs/dbraw/zinc/62/94/74/632629474.db2.gz JIFYGXYWCPJQNV-SNVBAGLBSA-N 0 3 299.798 2.959 20 10 CFCDHN COc1cccc([C@@H](C)N[C@@H]2CCCc3c[nH]nc32)c1O ZINC000846154732 632649143 /nfs/dbraw/zinc/64/91/43/632649143.db2.gz RQMUOCATXOIXAS-ZWNOBZJWSA-N 0 3 287.363 2.852 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000846185832 632656677 /nfs/dbraw/zinc/65/66/77/632656677.db2.gz YMRVPTRTDFUVRS-MJVIPROJSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2c1c(F)ccc2[O-] ZINC000846189130 632657292 /nfs/dbraw/zinc/65/72/92/632657292.db2.gz KPERVXMKROBCRS-PWRJXJELSA-N 0 3 277.339 2.989 20 10 CFCDHN C[C@H](COCC1CC1)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000846206427 632659676 /nfs/dbraw/zinc/65/96/76/632659676.db2.gz YRUDVNQITKORTE-GHMZBOCLSA-N 0 3 267.344 2.997 20 10 CFCDHN CCN1C[C@@H](C[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])CC1=O ZINC000846209689 632660864 /nfs/dbraw/zinc/66/08/64/632660864.db2.gz SDDRPDIRKNEILJ-UONOGXRCSA-N 0 3 290.407 2.528 20 10 CFCDHN COC1([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000817588862 632671920 /nfs/dbraw/zinc/67/19/20/632671920.db2.gz RZMYVGSKPUYIHE-KBPBESRZSA-N 0 3 293.407 2.935 20 10 CFCDHN CON1CCC([NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)CC1 ZINC000817589588 632672477 /nfs/dbraw/zinc/67/24/77/632672477.db2.gz ZDEOTAZPCNXZTB-GWCFXTLKSA-N 0 3 294.370 2.695 20 10 CFCDHN CCCN1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1O ZINC000846473633 632715557 /nfs/dbraw/zinc/71/55/57/632715557.db2.gz VDJMNTCBBDARBQ-ZDUSSCGKSA-N 0 3 296.798 2.536 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCCN1)c1ccc(F)cc1[O-] ZINC000817949837 632750354 /nfs/dbraw/zinc/75/03/54/632750354.db2.gz NSMGGYUEXUMYMQ-TZMCWYRMSA-N 0 3 266.360 2.714 20 10 CFCDHN CC[C@H](NC[C@@H]1CCC[NH2+]1)c1cc(Cl)ccc1[O-] ZINC000817951673 632751316 /nfs/dbraw/zinc/75/13/16/632751316.db2.gz JHQZJKKBIPXLST-AAEUAGOBSA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](N)c1ccccc1)c1ccccc1[O-] ZINC000817955017 632754695 /nfs/dbraw/zinc/75/46/95/632754695.db2.gz OSXWZPQYDRRXGX-DOMZBBRYSA-N 0 3 256.349 2.743 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@H]2CNCCC2(F)F)cc1 ZINC000817981349 632778033 /nfs/dbraw/zinc/77/80/33/632778033.db2.gz RGAALVBJZGUMQV-WFASDCNBSA-N 0 3 297.393 2.791 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CN)C1CCCC1)c1ccccc1[O-] ZINC000817980985 632778177 /nfs/dbraw/zinc/77/81/77/632778177.db2.gz GCEVZSQFINIXDL-HUUCEWRRSA-N 0 3 262.397 2.950 20 10 CFCDHN C[C@H](N[C@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1[O-] ZINC000817981101 632778233 /nfs/dbraw/zinc/77/82/33/632778233.db2.gz PYBFFHCQPVGMLO-UFBFGSQYSA-N 0 3 290.741 2.693 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1ccc(F)cc1[O-] ZINC000817984888 632780963 /nfs/dbraw/zinc/78/09/63/632780963.db2.gz BNRCHWWYXCUVGT-DGCLKSJQSA-N 0 3 278.371 2.857 20 10 CFCDHN Nc1ccc(NC(=O)[C@H](N)CC2CCCCC2)cc1 ZINC000818556294 632865372 /nfs/dbraw/zinc/86/53/72/632865372.db2.gz JELSUCRBDBHUIC-CQSZACIVSA-N 0 3 261.369 2.505 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H]2CCC[C@@H]2CCO)c1[O-] ZINC000848904096 633390332 /nfs/dbraw/zinc/39/03/32/633390332.db2.gz KKZZLWUKSPRVCR-UKRRQHHQSA-N 0 3 263.381 2.595 20 10 CFCDHN CCc1cccc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000848914253 633399691 /nfs/dbraw/zinc/39/96/91/633399691.db2.gz GHIHYVLJXKEFSB-OAHLLOKOSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1cccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000848914253 633399700 /nfs/dbraw/zinc/39/97/00/633399700.db2.gz GHIHYVLJXKEFSB-OAHLLOKOSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H]([C@H](CO)C2CC2)C2CC2)c1[O-] ZINC000848916130 633400887 /nfs/dbraw/zinc/40/08/87/633400887.db2.gz PELFUTXKPJLZSL-IAGOWNOFSA-N 0 3 289.419 2.841 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000848926529 633410298 /nfs/dbraw/zinc/41/02/98/633410298.db2.gz RQPMNPJXJRJFQX-JTQLQIEISA-N 0 3 283.343 2.599 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc(N)c2)cc1F ZINC000849350727 633626245 /nfs/dbraw/zinc/62/62/45/633626245.db2.gz UDFQAOIKDSKMEG-UHFFFAOYSA-N 0 3 273.355 2.764 20 10 CFCDHN CC1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CCCC1 ZINC000108881073 633727319 /nfs/dbraw/zinc/72/73/19/633727319.db2.gz OFGFXTQHPYMHRX-UHFFFAOYSA-N 0 3 263.337 2.791 20 10 CFCDHN c1csc(SCCCNCc2cc3n(n2)CCC3)n1 ZINC000850143047 633854969 /nfs/dbraw/zinc/85/49/69/633854969.db2.gz BISGTZIOFQUXQQ-UHFFFAOYSA-N 0 3 294.449 2.558 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](C)c1ccccn1 ZINC000850342783 633947028 /nfs/dbraw/zinc/94/70/28/633947028.db2.gz VSCCOISHOMLHPY-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccoc3)C2)cc1 ZINC000850345897 633947732 /nfs/dbraw/zinc/94/77/32/633947732.db2.gz NHJRCNPXFYUUQV-CQSZACIVSA-N 0 3 272.348 2.657 20 10 CFCDHN O[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000850369546 633959652 /nfs/dbraw/zinc/95/96/52/633959652.db2.gz BAPIOJIDOUCCKF-IAGOWNOFSA-N 0 3 281.355 2.890 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCC1SCCS1 ZINC000850407939 633980626 /nfs/dbraw/zinc/98/06/26/633980626.db2.gz VCQJALVLPPVMTO-UHFFFAOYSA-N 0 3 285.434 2.687 20 10 CFCDHN CCCN(C)CC(C)(C)[NH2+]Cc1ccccc1[O-] ZINC000850410587 633981625 /nfs/dbraw/zinc/98/16/25/633981625.db2.gz XINLZOJFTNTHJV-UHFFFAOYSA-N 0 3 250.386 2.602 20 10 CFCDHN C[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000850502463 634021511 /nfs/dbraw/zinc/02/15/11/634021511.db2.gz PXVIMFCHEYTSRY-BSGIZYOKSA-N 0 3 293.432 2.659 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H](O)C12CCC2)c1ccccc1[O-] ZINC000850544876 634045715 /nfs/dbraw/zinc/04/57/15/634045715.db2.gz BSAXNXMYNOFKNP-NWANDNLSSA-N 0 3 261.365 2.736 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](O)C23CCC3)c([O-])c1 ZINC000850548255 634048256 /nfs/dbraw/zinc/04/82/56/634048256.db2.gz ZTNDTSFGNGWDDL-GLQYFDAESA-N 0 3 261.365 2.655 20 10 CFCDHN COc1cc(C)nc(CNCc2cc(C)ccc2O)c1 ZINC000858239767 636161630 /nfs/dbraw/zinc/16/16/30/636161630.db2.gz SVQAQSBBSCBGEM-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(O)CCC(C)CC2)c([O-])c1 ZINC000853092204 634901736 /nfs/dbraw/zinc/90/17/36/634901736.db2.gz IHFMNPOPPPTEBK-UHFFFAOYSA-N 0 3 293.407 2.822 20 10 CFCDHN C[C@H]1CSC[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858163754 636144330 /nfs/dbraw/zinc/14/43/30/636144330.db2.gz KVQNTMMLIDKSDF-TVQRCGJNSA-N 0 3 286.391 2.872 20 10 CFCDHN C[C@H]1CC[C@H](CNCc2cc(F)c(N(C)C)cc2F)O1 ZINC000858174307 636147700 /nfs/dbraw/zinc/14/77/00/636147700.db2.gz BVSIEEIQVYBNOT-CMPLNLGQSA-N 0 3 284.350 2.688 20 10 CFCDHN CCO[C@H]1C[C@@H](NCc2cc(F)c(N(C)C)cc2F)C1 ZINC000858176291 636148194 /nfs/dbraw/zinc/14/81/94/636148194.db2.gz SSFPXEVLUWECNT-TXEJJXNPSA-N 0 3 284.350 2.688 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858284139 636175412 /nfs/dbraw/zinc/17/54/12/636175412.db2.gz XORNENMAHWTLLW-ZAQLIGFBSA-N 0 3 298.377 2.932 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000858506590 636276335 /nfs/dbraw/zinc/27/63/35/636276335.db2.gz VCADZDZMBHXJSO-GXFFZTMASA-N 0 3 293.338 2.834 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccnc(F)c2C)c([O-])c1 ZINC000862353545 637326931 /nfs/dbraw/zinc/32/69/31/637326931.db2.gz RJNOSDYLHCNUQC-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN COC(=O)[C@@H]1CN(Cc2ccccc2O)Cc2ccccc21 ZINC000862536990 637411361 /nfs/dbraw/zinc/41/13/61/637411361.db2.gz PDCLYUDEXJFRFV-MRXNPFEDSA-N 0 3 297.354 2.665 20 10 CFCDHN COC(=O)[C@@H]1C[N@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000862536990 637411367 /nfs/dbraw/zinc/41/13/67/637411367.db2.gz PDCLYUDEXJFRFV-MRXNPFEDSA-N 0 3 297.354 2.665 20 10 CFCDHN COC(=O)[C@@H]1C[N@@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000862536990 637411373 /nfs/dbraw/zinc/41/13/73/637411373.db2.gz PDCLYUDEXJFRFV-MRXNPFEDSA-N 0 3 297.354 2.665 20 10 CFCDHN Oc1cc2c(cc1CN1CCO[C@@H]3CCC[C@@H]31)CCC2 ZINC000863307299 637623282 /nfs/dbraw/zinc/62/32/82/637623282.db2.gz WEIFRBCEAWPBHG-DOTOQJQBSA-N 0 3 273.376 2.634 20 10 CFCDHN Cc1ncc([C@@H](C)NCc2cc3c(cc2O)OCO3)s1 ZINC000865700990 638524666 /nfs/dbraw/zinc/52/46/66/638524666.db2.gz DUWKQAPCKZCXBJ-MRVPVSSYSA-N 0 3 292.360 2.737 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1([C@@H]2CCCCO2)CCC1 ZINC000865857994 638618996 /nfs/dbraw/zinc/61/89/96/638618996.db2.gz XXVCUIFJVOGCAE-HNNXBMFYSA-N 0 3 261.365 2.974 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC[C@H](O)C(F)F)c2c1c(F)ccc2[O-] ZINC000866442479 638821822 /nfs/dbraw/zinc/82/18/22/638821822.db2.gz MNUKUNCKGHBHMS-HDBBIHSSSA-N 0 3 289.297 2.685 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1cc(F)ccc1[O-] ZINC000866612614 638854145 /nfs/dbraw/zinc/85/41/45/638854145.db2.gz ACKVCSJFEHFEHJ-ZJUUUORDSA-N 0 3 263.316 2.677 20 10 CFCDHN C[C@H](NC(=O)[C@H](N)CC1CCCCC1)c1ccccc1O ZINC000870988612 641139843 /nfs/dbraw/zinc/13/98/43/641139843.db2.gz UZBKUGNRACGAAR-SWLSCSKDSA-N 0 3 290.407 2.867 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1C[C@H]3CCC[C@H]3O1)CC2 ZINC000872106936 641638771 /nfs/dbraw/zinc/63/87/71/641638771.db2.gz JBQPUUYXKPQLGC-HLPPOEQASA-N 0 3 273.376 2.927 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CCOC2=O)c([O-])c1 ZINC000872112595 641643246 /nfs/dbraw/zinc/64/32/46/641643246.db2.gz KLVWSUXEENQQDF-STQMWFEESA-N 0 3 277.364 2.695 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@H]1CCOC1=O)c1ccccc1[O-] ZINC000872114893 641646078 /nfs/dbraw/zinc/64/60/78/641646078.db2.gz YPQYTBBJNXNOLV-JSGCOSHPSA-N 0 3 277.364 2.776 20 10 CFCDHN Cc1nccnc1[C@H](C)N[C@@H](C)c1ccccc1O ZINC000872134685 641662062 /nfs/dbraw/zinc/66/20/62/641662062.db2.gz UGJAVMXVJSEKFK-JQWIXIFHSA-N 0 3 257.337 2.902 20 10 CFCDHN Cc1ccc(CN2CCO[C@H](C(F)F)CC2)c(O)c1 ZINC000872254102 641719606 /nfs/dbraw/zinc/71/96/06/641719606.db2.gz RNARHSTVAABGQL-ZDUSSCGKSA-N 0 3 271.307 2.557 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC(C)(C)COC)c([O-])c1 ZINC000873153258 642034518 /nfs/dbraw/zinc/03/45/18/642034518.db2.gz IERQHEPFHBARKP-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CC(C)(C)CO2)c([O-])c1 ZINC000873155299 642036903 /nfs/dbraw/zinc/03/69/03/642036903.db2.gz HBFVKALNSCSZTK-CQSZACIVSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cccc(CN2CCOc3cc(N)ccc3C2)c1O ZINC000873220861 642073909 /nfs/dbraw/zinc/07/39/09/642073909.db2.gz ZFALCUYVFCTBLO-UHFFFAOYSA-N 0 3 284.359 2.677 20 10 CFCDHN CC(C)(C)[C@@]1(CN)CC[N@H+](Cc2cccc(F)c2[O-])C1 ZINC000873223619 642076880 /nfs/dbraw/zinc/07/68/80/642076880.db2.gz PLAKHNMDYHTSIU-MRXNPFEDSA-N 0 3 280.387 2.728 20 10 CFCDHN CC(C)(C)[C@@]1(CN)CC[N@@H+](Cc2cccc(F)c2[O-])C1 ZINC000873223619 642076885 /nfs/dbraw/zinc/07/68/85/642076885.db2.gz PLAKHNMDYHTSIU-MRXNPFEDSA-N 0 3 280.387 2.728 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1Cc2ccccc2CN1)c1ccccc1[O-] ZINC000873294463 642125962 /nfs/dbraw/zinc/12/59/62/642125962.db2.gz SYWCHSGBJKKDNI-BBRMVZONSA-N 0 3 282.387 2.757 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c([O-])c1 ZINC000876618989 642947825 /nfs/dbraw/zinc/94/78/25/642947825.db2.gz LEMUFQHGRKNLMO-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c([O-])c1 ZINC000876618989 642947830 /nfs/dbraw/zinc/94/78/30/642947830.db2.gz LEMUFQHGRKNLMO-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000876632106 642951523 /nfs/dbraw/zinc/95/15/23/642951523.db2.gz GVUKPNZKUGTOLD-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@H](C[NH2+]Cc1ccc(F)c(F)c1[O-])CN1CCCCC1 ZINC000876949314 643076446 /nfs/dbraw/zinc/07/64/46/643076446.db2.gz UZJOOXGHSNBZOF-GFCCVEGCSA-N 0 3 298.377 2.882 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](CO)Cc2ccccc2)c([O-])c1 ZINC000876965817 643086239 /nfs/dbraw/zinc/08/62/39/643086239.db2.gz LPFIKBLWTJZIDA-MRXNPFEDSA-N 0 3 285.387 2.641 20 10 CFCDHN COc1cccc2c1OC[C@@H]([NH2+]Cc1c(C)cccc1[O-])C2 ZINC000877007091 643102596 /nfs/dbraw/zinc/10/25/96/643102596.db2.gz CUPTXDKJVJPKNW-AWEZNQCLSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1noc(C)c1CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877011640 643103171 /nfs/dbraw/zinc/10/31/71/643103171.db2.gz FQSKIISJTUIMRR-UHFFFAOYSA-N 0 3 260.337 2.638 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)CC(C)(C)C ZINC000877040863 643116830 /nfs/dbraw/zinc/11/68/30/643116830.db2.gz SPPJZABNBKAOAB-GFCCVEGCSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)CC(C)(C)C)c([O-])c1 ZINC000877041512 643117451 /nfs/dbraw/zinc/11/74/51/643117451.db2.gz YGXAIQCWDIOUEX-CYBMUJFWSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)CCC(C)C ZINC000877051294 643121588 /nfs/dbraw/zinc/12/15/88/643121588.db2.gz VCDCGYSXKJRFTP-MRXNPFEDSA-N 0 3 265.397 2.977 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c([O-])c1 ZINC000877070834 643134699 /nfs/dbraw/zinc/13/46/99/643134699.db2.gz WXCDKUUEEUJKRS-IMJJTQAJSA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c([O-])c1 ZINC000877126508 643164916 /nfs/dbraw/zinc/16/49/16/643164916.db2.gz MITNBDDSFXTIQO-IMJJTQAJSA-N 0 3 273.376 2.748 20 10 CFCDHN Cc1ccc(C[NH2+]CC2([C@@H](C)CCO)CCC2)c([O-])c1 ZINC000877139008 643172414 /nfs/dbraw/zinc/17/24/14/643172414.db2.gz VSMCNFIHRWCWOZ-AWEZNQCLSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)CCc2ccccc2)c([O-])c1 ZINC000877315584 643234405 /nfs/dbraw/zinc/23/44/05/643234405.db2.gz KIFLVUPPSAXQRB-KRWDZBQOSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)CCc1ccccc1 ZINC000877315234 643234673 /nfs/dbraw/zinc/23/46/73/643234673.db2.gz DSBKDUOAJPOISG-INIZCTEOSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@@H](C2CC2)C1 ZINC000877375129 643249852 /nfs/dbraw/zinc/24/98/52/643249852.db2.gz OPGNTNPSLRNDHC-XJKSGUPXSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2[C@@H](C)O)c([O-])c1 ZINC000877465236 643285603 /nfs/dbraw/zinc/28/56/03/643285603.db2.gz RSJHGPHKRNCKCD-GZBFAFLISA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2[C@@H](C)O)c([O-])c1 ZINC000877465236 643285607 /nfs/dbraw/zinc/28/56/07/643285607.db2.gz RSJHGPHKRNCKCD-GZBFAFLISA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000877479061 643295879 /nfs/dbraw/zinc/29/58/79/643295879.db2.gz RCEYMTJIZMMSEO-HNNXBMFYSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCCCN2C2CC2)c([O-])c1 ZINC000877479520 643296891 /nfs/dbraw/zinc/29/68/91/643296891.db2.gz WRDRGTWQRICZAQ-MRXNPFEDSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)c([O-])c1 ZINC000877481181 643298645 /nfs/dbraw/zinc/29/86/45/643298645.db2.gz XIJRLKKQXCTHIP-OAHLLOKOSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](c3nccn3C)C2)c([O-])c1 ZINC000877481181 643298649 /nfs/dbraw/zinc/29/86/49/643298649.db2.gz XIJRLKKQXCTHIP-OAHLLOKOSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(CN(CCO)Cc2c(C)cccc2O)o1 ZINC000877492471 643305881 /nfs/dbraw/zinc/30/58/81/643305881.db2.gz LWEABQXEUXUYOA-UHFFFAOYSA-N 0 3 275.348 2.597 20 10 CFCDHN Cc1ccc(C[NH+]2CC(C3CCOCC3)C2)c([O-])c1 ZINC000877499796 643310997 /nfs/dbraw/zinc/31/09/97/643310997.db2.gz LNTZSJWINXBFGF-UHFFFAOYSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCCC[C@@H]2CCO)c([O-])c1 ZINC000877507155 643317474 /nfs/dbraw/zinc/31/74/74/643317474.db2.gz LPYRDRLVDJZAGU-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCCC[C@@H]2CCO)c([O-])c1 ZINC000877507155 643317478 /nfs/dbraw/zinc/31/74/78/643317478.db2.gz LPYRDRLVDJZAGU-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@]2(C)CCCO)c([O-])c1 ZINC000877529141 643332424 /nfs/dbraw/zinc/33/24/24/643332424.db2.gz UJKBIHWAAQORHW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@]2(C)CCCO)c([O-])c1 ZINC000877529141 643332433 /nfs/dbraw/zinc/33/24/33/643332433.db2.gz UJKBIHWAAQORHW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877536394 643338675 /nfs/dbraw/zinc/33/86/75/643338675.db2.gz OGTAFHDUWBHGDS-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](O)C23CCCC3)c([O-])c1 ZINC000877548940 643349537 /nfs/dbraw/zinc/34/95/37/643349537.db2.gz CWBDEBVGZZRLMO-HNNXBMFYSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)c([O-])c1 ZINC000877548940 643349541 /nfs/dbraw/zinc/34/95/41/643349541.db2.gz CWBDEBVGZZRLMO-HNNXBMFYSA-N 0 3 261.365 2.580 20 10 CFCDHN COCC1(CC[NH2+]Cc2c(C)cccc2[O-])CCC1 ZINC000877551399 643350978 /nfs/dbraw/zinc/35/09/78/643350978.db2.gz YBAJXUFJTNHADX-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000877553709 643354128 /nfs/dbraw/zinc/35/41/28/643354128.db2.gz BNQUSDVCRFXRKI-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000877553709 643354133 /nfs/dbraw/zinc/35/41/33/643354133.db2.gz BNQUSDVCRFXRKI-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc(O)c1CN1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000877555174 643355908 /nfs/dbraw/zinc/35/59/08/643355908.db2.gz RTVBHSFEPLWVHG-SJORKVTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]([C@H](CO)C2CC2)C2CC2)c([O-])c1 ZINC000877566647 643366267 /nfs/dbraw/zinc/36/62/67/643366267.db2.gz LNJAOEOVZOJGJJ-NVXWUHKLSA-N 0 3 275.392 2.587 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])CC1 ZINC000877577334 643374234 /nfs/dbraw/zinc/37/42/34/643374234.db2.gz VTZFNNSJBMCPCT-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])CC1 ZINC000877577334 643374244 /nfs/dbraw/zinc/37/42/44/643374244.db2.gz VTZFNNSJBMCPCT-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCOC(C)(C)C1 ZINC000877578013 643375496 /nfs/dbraw/zinc/37/54/96/643375496.db2.gz QJWFXWDBGDQMIV-CYBMUJFWSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(CN2CCOC[C@H]2C2CCC2)c(O)c1 ZINC000877606408 643393398 /nfs/dbraw/zinc/39/33/98/643393398.db2.gz AMECVCPRWBPAHI-HNNXBMFYSA-N 0 3 261.365 2.702 20 10 CFCDHN CCCC[C@](C)(CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605546 643394009 /nfs/dbraw/zinc/39/40/09/643394009.db2.gz DMWDIIIZRXPCOQ-OAHLLOKOSA-N 0 3 251.370 2.731 20 10 CFCDHN Cc1ccc(C[NH+]2CCC([C@@H](C)CO)CC2)c([O-])c1 ZINC000877613094 643399554 /nfs/dbraw/zinc/39/95/54/643399554.db2.gz WNRRIFJIRVNUCR-ZDUSSCGKSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCCN3CCCC[C@H]23)c([O-])c1 ZINC000877618880 643404539 /nfs/dbraw/zinc/40/45/39/643404539.db2.gz HSUBGGOHZRPJCB-JKSUJKDBSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1cccc(O)c1CNCc1c(C(F)(F)F)cnn1C ZINC000877650959 643432325 /nfs/dbraw/zinc/43/23/25/643432325.db2.gz VGPYXZYEYUZDOJ-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](O)C(F)(F)F)c1[O-] ZINC000877693600 643459247 /nfs/dbraw/zinc/45/92/47/643459247.db2.gz LTBKYXQZJPSPIS-HQJQHLMTSA-N 0 3 297.704 2.755 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc(Cl)c1F)[C@H]1CN2CCC1CC2 ZINC000877707199 643474936 /nfs/dbraw/zinc/47/49/36/643474936.db2.gz ZPTDPKCGJDQQOI-ZDUSSCGKSA-N 0 3 298.789 2.711 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc(Cl)c1F)[C@H]1CN2CCC1CC2 ZINC000877707199 643474939 /nfs/dbraw/zinc/47/49/39/643474939.db2.gz ZPTDPKCGJDQQOI-ZDUSSCGKSA-N 0 3 298.789 2.711 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@H]2C2CCOCC2)c([O-])c1 ZINC000877728605 643489251 /nfs/dbraw/zinc/48/92/51/643489251.db2.gz HJHDUPPFBVESIT-HOTGVXAUSA-N 0 3 275.392 2.853 20 10 CFCDHN COC(=O)C1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000877755799 643535813 /nfs/dbraw/zinc/53/58/13/643535813.db2.gz NEOVJNPQOURJLK-PNESKVBLSA-N 0 3 277.364 2.775 20 10 CFCDHN C[C@H](O)c1ncc(CN[C@@H](C)c2ccccc2O)s1 ZINC000877758105 643539079 /nfs/dbraw/zinc/53/90/79/643539079.db2.gz JBXOEFZTYKZCES-UWVGGRQHSA-N 0 3 278.377 2.753 20 10 CFCDHN C[C@H](O)c1ncc(C[NH2+][C@@H](C)c2ccccc2[O-])s1 ZINC000877758105 643539087 /nfs/dbraw/zinc/53/90/87/643539087.db2.gz JBXOEFZTYKZCES-UWVGGRQHSA-N 0 3 278.377 2.753 20 10 CFCDHN C[C@H]([NH2+]C1CC(n2cccn2)C1)c1ccccc1[O-] ZINC000877758262 643539182 /nfs/dbraw/zinc/53/91/82/643539182.db2.gz PRBYSLLLPAEWDE-HIFPTAJRSA-N 0 3 257.337 2.643 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](C(C)(C)O)C2)c([O-])c1 ZINC000877797076 643564796 /nfs/dbraw/zinc/56/47/96/643564796.db2.gz PSHFDLYOYCXKGT-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](C(C)(C)O)C2)c([O-])c1 ZINC000877797076 643564802 /nfs/dbraw/zinc/56/48/02/643564802.db2.gz PSHFDLYOYCXKGT-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CC(C)OC1(C[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000877806758 643569590 /nfs/dbraw/zinc/56/95/90/643569590.db2.gz KFUDDLFQMSPFFX-UHFFFAOYSA-N 0 3 267.344 2.969 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N[C@H]1CCCC[C@H]1C)c1ccccc1[O-] ZINC000879647611 644361649 /nfs/dbraw/zinc/36/16/49/644361649.db2.gz GCTNYFIJNOJTJK-NFAWXSAZSA-N 0 3 290.407 2.738 20 10 CFCDHN CC(C)C[C@H](C)N(C)C(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651199 644364705 /nfs/dbraw/zinc/36/47/05/644364705.db2.gz MILSQKFANFJUQZ-KBPBESRZSA-N 0 3 292.423 2.936 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N[C@@H]1CCCC[C@@H]1C)c1ccccc1[O-] ZINC000879652594 644365718 /nfs/dbraw/zinc/36/57/18/644365718.db2.gz GCTNYFIJNOJTJK-KCQAQPDRSA-N 0 3 290.407 2.738 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1C[C@H](C)C[C@@H](C)C1)c1ccccc1[O-] ZINC000879653283 644366487 /nfs/dbraw/zinc/36/64/87/644366487.db2.gz MODHKISOLJJKCH-MCIONIFRSA-N 0 3 290.407 2.547 20 10 CFCDHN CCOCCN(C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000092885611 650927813 /nfs/dbraw/zinc/92/78/13/650927813.db2.gz ZGIAMRUOCYRYJC-UHFFFAOYSA-N 0 3 281.396 2.864 20 10 CFCDHN CC[N@H+](C)C[C@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000093770268 650946266 /nfs/dbraw/zinc/94/62/66/650946266.db2.gz CFDXZWQZPIRZSH-GFCCVEGCSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[N@@H+](C)C[C@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000093770268 650946267 /nfs/dbraw/zinc/94/62/67/650946267.db2.gz CFDXZWQZPIRZSH-GFCCVEGCSA-N 0 3 282.815 2.819 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC(C)CC1)c1cc(F)ccc1[O-] ZINC000094617830 650960222 /nfs/dbraw/zinc/96/02/22/650960222.db2.gz VXTPQGZBJGLMPA-CYBMUJFWSA-N 0 3 280.387 2.914 20 10 CFCDHN CC[C@H](CCO)C[NH2+][C@H](CC)c1ccccc1[O-] ZINC000094949537 650965967 /nfs/dbraw/zinc/96/59/67/650965967.db2.gz AMFMUGYUUZFWHO-TZMCWYRMSA-N 0 3 251.370 2.842 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)cc(F)c1[O-])CN1CCCCC1 ZINC000882905179 645503496 /nfs/dbraw/zinc/50/34/96/645503496.db2.gz VSEFNZRLSHDVIM-LBPRGKRZSA-N 0 3 298.377 2.882 20 10 CFCDHN CCN1CC[N@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000252730868 651021171 /nfs/dbraw/zinc/02/11/71/651021171.db2.gz NFVMOYCHGLWKFS-LLVKDONJSA-N 0 3 268.788 2.572 20 10 CFCDHN CCN1CC[N@@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000252730868 651021172 /nfs/dbraw/zinc/02/11/72/651021172.db2.gz NFVMOYCHGLWKFS-LLVKDONJSA-N 0 3 268.788 2.572 20 10 CFCDHN [O-]c1c(F)cc(F)cc1C[NH2+]C1CC(N2CCCCC2)C1 ZINC000883108274 645606827 /nfs/dbraw/zinc/60/68/27/645606827.db2.gz BQPQBDDTEQCCPR-UHFFFAOYSA-N 0 3 296.361 2.777 20 10 CFCDHN [O-]c1c(F)cc(F)cc1CNC1CC([NH+]2CCCCC2)C1 ZINC000883108274 645606829 /nfs/dbraw/zinc/60/68/29/645606829.db2.gz BQPQBDDTEQCCPR-UHFFFAOYSA-N 0 3 296.361 2.777 20 10 CFCDHN CCN1CC[C@@H]1C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000883354931 645760059 /nfs/dbraw/zinc/76/00/59/645760059.db2.gz FMARDRWERWHEBR-WZRBSPASSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@@H]([NH2+]CC1(N(C)C)CCCC1)c1ccccc1[O-] ZINC000132040414 645865819 /nfs/dbraw/zinc/86/58/19/645865819.db2.gz ZFFNSNBOIIDQOJ-CYBMUJFWSA-N 0 3 262.397 2.917 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3cc(C)co3)C2)cc1 ZINC000886158393 646900708 /nfs/dbraw/zinc/90/07/08/646900708.db2.gz YMNBHVJCIGYNKY-CQSZACIVSA-N 0 3 286.375 2.965 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CC3(CCC3)CO2)c([O-])c1 ZINC000886289018 646955650 /nfs/dbraw/zinc/95/56/50/646955650.db2.gz MICMBWDVMDZDFR-HNNXBMFYSA-N 0 3 291.391 2.840 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504301 647022038 /nfs/dbraw/zinc/02/20/38/647022038.db2.gz ZSSZFXGRVKZPLO-IACUBPJLSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504301 647022040 /nfs/dbraw/zinc/02/20/40/647022040.db2.gz ZSSZFXGRVKZPLO-IACUBPJLSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1c([O-])cccc1F ZINC000886504301 647022042 /nfs/dbraw/zinc/02/20/42/647022042.db2.gz ZSSZFXGRVKZPLO-IACUBPJLSA-N 0 3 278.371 2.809 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@@H](C)c2c([O-])cccc2F)C1 ZINC000886506130 647023147 /nfs/dbraw/zinc/02/31/47/647023147.db2.gz CZLFYRHDMZGDQD-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886517558 647025846 /nfs/dbraw/zinc/02/58/46/647025846.db2.gz IJHOBYLNZAUADH-GHMZBOCLSA-N 0 3 254.349 2.522 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1c([O-])cccc1F ZINC000886517561 647026095 /nfs/dbraw/zinc/02/60/95/647026095.db2.gz IJHOBYLNZAUADH-WDEREUQCSA-N 0 3 254.349 2.522 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886603690 647063628 /nfs/dbraw/zinc/06/36/28/647063628.db2.gz UGWAMENMILDZRE-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1c([O-])cccc1F ZINC000886620518 647071378 /nfs/dbraw/zinc/07/13/78/647071378.db2.gz MBOMXVSDBXALHT-ODWCKFRGSA-N 0 3 278.371 2.807 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CC3(CCC3)CO1)CC2 ZINC000886701825 647116926 /nfs/dbraw/zinc/11/69/26/647116926.db2.gz WJUWVXLPFOKNKL-KBPBESRZSA-N 0 3 273.376 2.928 20 10 CFCDHN CC[C@@H]([NH2+]CC1CC2(C1)OCCO2)c1ccc(C)cc1[O-] ZINC000927000593 648678676 /nfs/dbraw/zinc/67/86/76/648678676.db2.gz IMSBWEXBUHTYGN-OAHLLOKOSA-N 0 3 291.391 2.894 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2CC3(C2)OCCO3)c([O-])c1 ZINC000927002446 648679115 /nfs/dbraw/zinc/67/91/15/648679115.db2.gz WEMAOTNSZYTDIN-CYBMUJFWSA-N 0 3 291.391 2.813 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC2(C[C@H]2CCO)CC1 ZINC001140057650 770114487 /nfs/dbraw/zinc/11/44/87/770114487.db2.gz JFQCWEKCPDBNPJ-CYBMUJFWSA-N 0 3 279.355 2.516 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cccc2c1OCC2 ZINC000693111124 770238889 /nfs/dbraw/zinc/23/88/89/770238889.db2.gz DYMPZOGYEPVWOK-UHFFFAOYSA-N 0 3 255.317 2.617 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000690750974 773222752 /nfs/dbraw/zinc/22/27/52/773222752.db2.gz TYSFRJDUTGGXNJ-HNNXBMFYSA-N 0 3 255.317 2.875 20 10 CFCDHN Oc1ccc(O)c(CN2CC[C@@](CF)(C(F)(F)F)C2)c1 ZINC001141156890 775963097 /nfs/dbraw/zinc/96/30/97/775963097.db2.gz WPIDOQIYEQIHEA-LBPRGKRZSA-N 0 3 293.260 2.822 20 10 CFCDHN CCC(O)(CC)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000184706617 776449065 /nfs/dbraw/zinc/44/90/65/776449065.db2.gz LXZGJVLSXNBXKO-UHFFFAOYSA-N 0 3 287.787 2.695 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@H](C)c2ccccc2[O-])CCOC1 ZINC000722353200 776514149 /nfs/dbraw/zinc/51/41/49/776514149.db2.gz OOCWEIQQFVMNLK-CJNGLKHVSA-N 0 3 279.380 2.627 20 10 CFCDHN C[NH2+]CCN(C)Cc1cc(Cl)c(C(C)(C)C)cc1[O-] ZINC001204727624 776973181 /nfs/dbraw/zinc/97/31/81/776973181.db2.gz GMDGZIGZBXOVOU-UHFFFAOYSA-N 0 3 284.831 2.994 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH+]1CC2(CC(O)C2)C1 ZINC001231587434 777269559 /nfs/dbraw/zinc/26/95/59/777269559.db2.gz CCPUJQWQBOMAKG-UHFFFAOYSA-N 0 3 269.344 2.502 20 10 CFCDHN CO[C@@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587685 777269944 /nfs/dbraw/zinc/26/99/44/777269944.db2.gz HEDVVZBPFRCXAW-GOEBONIOSA-N 0 3 275.323 2.714 20 10 CFCDHN CO[C@@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587685 777269948 /nfs/dbraw/zinc/26/99/48/777269948.db2.gz HEDVVZBPFRCXAW-GOEBONIOSA-N 0 3 275.323 2.714 20 10 CFCDHN CO[C@@H]1CN(Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC001231587685 777269951 /nfs/dbraw/zinc/26/99/51/777269951.db2.gz HEDVVZBPFRCXAW-GOEBONIOSA-N 0 3 275.323 2.714 20 10 CFCDHN Cc1cccc(N2CCN(Cc3cccc(C)c3O)CC2)n1 ZINC001231591062 777270483 /nfs/dbraw/zinc/27/04/83/777270483.db2.gz RUCCWJFJMYRDRR-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN COC(C[N@H+](C)Cc1c([O-])ccc2ccccc21)OC ZINC001231590467 777271024 /nfs/dbraw/zinc/27/10/24/777271024.db2.gz CLFYVPWMEDCTLH-UHFFFAOYSA-N 0 3 275.348 2.596 20 10 CFCDHN COC(C[N@@H+](C)Cc1c([O-])ccc2ccccc21)OC ZINC001231590467 777271029 /nfs/dbraw/zinc/27/10/29/777271029.db2.gz CLFYVPWMEDCTLH-UHFFFAOYSA-N 0 3 275.348 2.596 20 10 CFCDHN Cc1cccc(CN2CCc3cc4c(cc3C2)OCO4)c1O ZINC001231591381 777272220 /nfs/dbraw/zinc/27/22/20/777272220.db2.gz CAPNCFBHVICHAM-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH+]1CCC(N2CCC2)CC1 ZINC001231914067 777383007 /nfs/dbraw/zinc/38/30/07/777383007.db2.gz XNHMONDMKCRUEG-UHFFFAOYSA-N 0 3 280.799 2.716 20 10 CFCDHN COC(=O)c1c(CN2CCC3(CC3)C2)c2ccccc2n1C ZINC001232401640 777549406 /nfs/dbraw/zinc/54/94/06/777549406.db2.gz AHJZVLLLHMMGGI-UHFFFAOYSA-N 0 3 298.386 2.951 20 10 CFCDHN COc1cc(Cl)cc(CN2CC3CC(C3)C2)c1O ZINC001233290835 777868308 /nfs/dbraw/zinc/86/83/08/777868308.db2.gz YVBVISKBCZXUIP-UHFFFAOYSA-N 0 3 267.756 2.896 20 10 CFCDHN COc1cc(Cl)cc(C[NH+]2CC3CC(C3)C2)c1[O-] ZINC001233290835 777868317 /nfs/dbraw/zinc/86/83/17/777868317.db2.gz YVBVISKBCZXUIP-UHFFFAOYSA-N 0 3 267.756 2.896 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@](C)(O)C2)c1[O-] ZINC001233287906 777869154 /nfs/dbraw/zinc/86/91/54/777869154.db2.gz MSIOIYHXCGEPEO-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCC[C@@](C)(O)C2)c1[O-] ZINC001233287906 777869159 /nfs/dbraw/zinc/86/91/59/777869159.db2.gz MSIOIYHXCGEPEO-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H]3C[C@H]2C[C@@H]3F)c1O ZINC001233290353 777869882 /nfs/dbraw/zinc/86/98/82/777869882.db2.gz YLFOTOZEVLLART-UWJYBYFXSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1[O-] ZINC001233290353 777869890 /nfs/dbraw/zinc/86/98/90/777869890.db2.gz YLFOTOZEVLLART-UWJYBYFXSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1[O-] ZINC001233290353 777869899 /nfs/dbraw/zinc/86/98/99/777869899.db2.gz YLFOTOZEVLLART-UWJYBYFXSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](O)CC2)c1[O-] ZINC001233287767 777870435 /nfs/dbraw/zinc/87/04/35/777870435.db2.gz GWKDQEORFQYKHM-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](O)CC2)c1[O-] ZINC001233287767 777870449 /nfs/dbraw/zinc/87/04/49/777870449.db2.gz GWKDQEORFQYKHM-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN Oc1c(CN2CC=CC2)cccc1OC(F)(F)F ZINC001233727938 778056048 /nfs/dbraw/zinc/05/60/48/778056048.db2.gz RUVNBPGWGVGLBI-UHFFFAOYSA-N 0 3 259.227 2.663 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CCC[C@@H]3CO)c2c1 ZINC001234526132 778243433 /nfs/dbraw/zinc/24/34/33/778243433.db2.gz QNKXEWOKCVYOKZ-CYBMUJFWSA-N 0 3 287.359 2.511 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CCC[C@@H]3CO)c2c1 ZINC001234526132 778243437 /nfs/dbraw/zinc/24/34/37/778243437.db2.gz QNKXEWOKCVYOKZ-CYBMUJFWSA-N 0 3 287.359 2.511 20 10 CFCDHN CCN(Cc1ccccn1)Cc1ccc(OC)cc1O ZINC000093338951 778293060 /nfs/dbraw/zinc/29/30/60/778293060.db2.gz HJGKRJGCRAQYNR-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235676907 778534334 /nfs/dbraw/zinc/53/43/34/778534334.db2.gz WVUBUUCXCZBKLJ-RISCZKNCSA-N 0 3 263.381 2.645 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235676907 778534335 /nfs/dbraw/zinc/53/43/35/778534335.db2.gz WVUBUUCXCZBKLJ-RISCZKNCSA-N 0 3 263.381 2.645 20 10 CFCDHN COC[C@@H]1CC[N@@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235681940 778535429 /nfs/dbraw/zinc/53/54/29/778535429.db2.gz SHEYSTOSFYHFRR-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN COC[C@@H]1CC[N@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235681940 778535436 /nfs/dbraw/zinc/53/54/36/778535436.db2.gz SHEYSTOSFYHFRR-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN CCC[C@@H]1C[NH2+]CCN1Cc1c([O-])cccc1Cl ZINC001236130913 778706039 /nfs/dbraw/zinc/70/60/39/778706039.db2.gz KTKHBXWHMHLSNN-LLVKDONJSA-N 0 3 268.788 2.620 20 10 CFCDHN CN(Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219803 778744058 /nfs/dbraw/zinc/74/40/58/778744058.db2.gz XOMCMYBCYCWHJB-QWHCGFSZSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@@H]1N ZINC001236219803 778744060 /nfs/dbraw/zinc/74/40/60/778744060.db2.gz XOMCMYBCYCWHJB-QWHCGFSZSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@@H]1N ZINC001236219803 778744062 /nfs/dbraw/zinc/74/40/62/778744062.db2.gz XOMCMYBCYCWHJB-QWHCGFSZSA-N 0 3 286.778 2.886 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]([NH3+])[C@H]2C)cc1Cl ZINC001236417640 778811816 /nfs/dbraw/zinc/81/18/16/778811816.db2.gz CKSORMDUWCRGMZ-ZWNOBZJWSA-N 0 3 268.788 2.666 20 10 CFCDHN Cc1cc([O-])c(CN(C(C)C)[C@@H]2CC[NH2+]C2)cc1Cl ZINC001236531149 778865240 /nfs/dbraw/zinc/86/52/40/778865240.db2.gz VNRBANLQSOORSM-CYBMUJFWSA-N 0 3 282.815 2.926 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@@H](C)[NH2+]1 ZINC001236581397 778884247 /nfs/dbraw/zinc/88/42/47/778884247.db2.gz WNMDXMRHVANUOX-NXEZZACHSA-N 0 3 288.313 2.593 20 10 CFCDHN CC(C)C[N@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236772975 778931656 /nfs/dbraw/zinc/93/16/56/778931656.db2.gz MCWUVUHTALZDGL-UHFFFAOYSA-N 0 3 288.185 2.948 20 10 CFCDHN CC(C)C[N@@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236772975 778931661 /nfs/dbraw/zinc/93/16/61/778931661.db2.gz MCWUVUHTALZDGL-UHFFFAOYSA-N 0 3 288.185 2.948 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236807228 778946186 /nfs/dbraw/zinc/94/61/86/778946186.db2.gz DTXYVWHVQBGTSC-SUMWQHHRSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236807228 778946190 /nfs/dbraw/zinc/94/61/90/778946190.db2.gz DTXYVWHVQBGTSC-SUMWQHHRSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c([O-])c1 ZINC001236811226 778948997 /nfs/dbraw/zinc/94/89/97/778948997.db2.gz NERTZZUTOPGIMX-OKILXGFUSA-N 0 3 261.365 2.797 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c([O-])c1 ZINC001236811226 778949001 /nfs/dbraw/zinc/94/90/01/778949001.db2.gz NERTZZUTOPGIMX-OKILXGFUSA-N 0 3 261.365 2.797 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])CC[C@@H]1O ZINC001236827841 778956915 /nfs/dbraw/zinc/95/69/15/778956915.db2.gz VRAAYYVXIMVEJB-WBMJQRKESA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])CC[C@@H]1O ZINC001236827841 778956920 /nfs/dbraw/zinc/95/69/20/778956920.db2.gz VRAAYYVXIMVEJB-WBMJQRKESA-N 0 3 271.360 2.748 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@H](CO)C1 ZINC001236831570 778958265 /nfs/dbraw/zinc/95/82/65/778958265.db2.gz AOOZPIBDQSNITD-ZDUSSCGKSA-N 0 3 271.360 2.750 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@H](CO)C1 ZINC001236831570 778958268 /nfs/dbraw/zinc/95/82/68/778958268.db2.gz AOOZPIBDQSNITD-ZDUSSCGKSA-N 0 3 271.360 2.750 20 10 CFCDHN COC(=O)[C@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])C[C@@H]1C ZINC001236834572 778959303 /nfs/dbraw/zinc/95/93/03/778959303.db2.gz BNOTVBFFLKGKRA-LRDDRELGSA-N 0 3 299.370 2.786 20 10 CFCDHN COC(=O)[C@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])C[C@@H]1C ZINC001236834572 778959305 /nfs/dbraw/zinc/95/93/05/778959305.db2.gz BNOTVBFFLKGKRA-LRDDRELGSA-N 0 3 299.370 2.786 20 10 CFCDHN COC(C[N@H+](C)Cc1cc2ccccc2cc1[O-])OC ZINC001236834512 778959899 /nfs/dbraw/zinc/95/98/99/778959899.db2.gz ZRIREKKJUJJAHQ-UHFFFAOYSA-N 0 3 275.348 2.596 20 10 CFCDHN COC(C[N@@H+](C)Cc1cc2ccccc2cc1[O-])OC ZINC001236834512 778959904 /nfs/dbraw/zinc/95/99/04/778959904.db2.gz ZRIREKKJUJJAHQ-UHFFFAOYSA-N 0 3 275.348 2.596 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc2ccccc2cc1[O-] ZINC001236836093 778960827 /nfs/dbraw/zinc/96/08/27/778960827.db2.gz XKTHERYXRGYSBQ-IRXDYDNUSA-N 0 3 282.387 2.824 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1cc2ccccc2cc1[O-] ZINC001236836093 778960831 /nfs/dbraw/zinc/96/08/31/778960831.db2.gz XKTHERYXRGYSBQ-IRXDYDNUSA-N 0 3 282.387 2.824 20 10 CFCDHN COC(=O)CC[N@H+](C)Cc1cc2ccccc2cc1[O-] ZINC001236837069 778960865 /nfs/dbraw/zinc/96/08/65/778960865.db2.gz MTHCJGARPSVLCI-UHFFFAOYSA-N 0 3 273.332 2.540 20 10 CFCDHN COC(=O)CC[N@@H+](C)Cc1cc2ccccc2cc1[O-] ZINC001236837069 778960870 /nfs/dbraw/zinc/96/08/70/778960870.db2.gz MTHCJGARPSVLCI-UHFFFAOYSA-N 0 3 273.332 2.540 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@](C)(F)C2)c(O)c1 ZINC001232835728 778982447 /nfs/dbraw/zinc/98/24/47/778982447.db2.gz GRTIIIQKZOSNFE-HNNXBMFYSA-N 0 3 266.360 2.782 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237045982 778997269 /nfs/dbraw/zinc/99/72/69/778997269.db2.gz OFQMHAQPCPLVHU-CVEARBPZSA-N 0 3 275.392 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237045982 778997271 /nfs/dbraw/zinc/99/72/71/778997271.db2.gz OFQMHAQPCPLVHU-CVEARBPZSA-N 0 3 275.392 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCCC[C@@H](O)C2)c([O-])c1 ZINC001237046982 778998550 /nfs/dbraw/zinc/99/85/50/778998550.db2.gz YCYSHGWBDAWKSJ-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCCC[C@@H](O)C2)c([O-])c1 ZINC001237046982 778998555 /nfs/dbraw/zinc/99/85/55/778998555.db2.gz YCYSHGWBDAWKSJ-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC3(COC3)C2)c([O-])c1 ZINC001237046256 778998729 /nfs/dbraw/zinc/99/87/29/778998729.db2.gz SDNSOESIZDVSQD-UHFFFAOYSA-N 0 3 261.365 2.738 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC3(COC3)C2)c([O-])c1 ZINC001237046256 778998731 /nfs/dbraw/zinc/99/87/31/778998731.db2.gz SDNSOESIZDVSQD-UHFFFAOYSA-N 0 3 261.365 2.738 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c([O-])c1 ZINC001237049747 778999936 /nfs/dbraw/zinc/99/99/36/778999936.db2.gz IUHJHZLLTDGQIS-AAEUAGOBSA-N 0 3 267.344 2.971 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2CF)c([O-])c1 ZINC001237049747 778999940 /nfs/dbraw/zinc/99/99/40/778999940.db2.gz IUHJHZLLTDGQIS-AAEUAGOBSA-N 0 3 267.344 2.971 20 10 CFCDHN CCOc1ccc(CN2C[C@@H](C)C[C@H]2CF)c(O)c1 ZINC001237049747 778999943 /nfs/dbraw/zinc/99/99/43/778999943.db2.gz IUHJHZLLTDGQIS-AAEUAGOBSA-N 0 3 267.344 2.971 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001237049477 779000515 /nfs/dbraw/zinc/00/05/15/779000515.db2.gz GLOSNRDHGIEQOH-SUMWQHHRSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001237049477 779000522 /nfs/dbraw/zinc/00/05/22/779000522.db2.gz GLOSNRDHGIEQOH-SUMWQHHRSA-N 0 3 291.391 2.792 20 10 CFCDHN COC(=O)C[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237050558 779000694 /nfs/dbraw/zinc/00/06/94/779000694.db2.gz CJBKVUQNJORMRA-CYBMUJFWSA-N 0 3 291.391 2.901 20 10 CFCDHN COC(=O)C[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237050558 779000698 /nfs/dbraw/zinc/00/06/98/779000698.db2.gz CJBKVUQNJORMRA-CYBMUJFWSA-N 0 3 291.391 2.901 20 10 CFCDHN CN(Cc1c(O)cccc1OC(F)(F)F)[C@@H]1CCOC1 ZINC001237118688 779016166 /nfs/dbraw/zinc/01/61/66/779016166.db2.gz AIVQKWTTXPROTB-SECBINFHSA-N 0 3 291.269 2.512 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(C[C@H]2CCO)CC1 ZINC001237484970 779117480 /nfs/dbraw/zinc/11/74/80/779117480.db2.gz KPWIXDXUGFZJEX-CQSZACIVSA-N 0 3 275.392 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(CCCO2)CC1 ZINC001237487701 779118923 /nfs/dbraw/zinc/11/89/23/779118923.db2.gz LUBVECFFAMSHCO-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN COC[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC001237680898 779159819 /nfs/dbraw/zinc/15/98/19/779159819.db2.gz JLQHZIMMDMPUBE-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN COC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC001237680898 779159822 /nfs/dbraw/zinc/15/98/22/779159822.db2.gz JLQHZIMMDMPUBE-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CCN(CCC[NH+](C)C)Cc1cc(F)cc(Cl)c1[O-] ZINC001237801987 779182136 /nfs/dbraw/zinc/18/21/36/779182136.db2.gz JRJIPLCAXUCBJE-UHFFFAOYSA-N 0 3 288.794 2.958 20 10 CFCDHN CC[N@H+](CCN(C)C)Cc1cc(F)c(Cl)cc1[O-] ZINC001237946357 779214486 /nfs/dbraw/zinc/21/44/86/779214486.db2.gz KBGVMPXSEDFZEW-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CC[N@@H+](CCN(C)C)Cc1cc(F)c(Cl)cc1[O-] ZINC001237946357 779214488 /nfs/dbraw/zinc/21/44/88/779214488.db2.gz KBGVMPXSEDFZEW-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(C[C@@H]3CCO)CC2)c1[O-] ZINC001238063706 779243101 /nfs/dbraw/zinc/24/31/01/779243101.db2.gz LTHJYDAJPBFBEP-AWEZNQCLSA-N 0 3 293.382 2.824 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@H](OC(C)C)C2)c1[O-] ZINC001238066219 779243667 /nfs/dbraw/zinc/24/36/67/779243667.db2.gz JRTKXZOKEIVBPV-CQSZACIVSA-N 0 3 267.344 2.839 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@H](OC(C)C)C2)c1[O-] ZINC001238066219 779243668 /nfs/dbraw/zinc/24/36/68/779243668.db2.gz JRTKXZOKEIVBPV-CQSZACIVSA-N 0 3 267.344 2.839 20 10 CFCDHN C[C@@H](CN(C)C(=O)OC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000701923120 780857378 /nfs/dbraw/zinc/85/73/78/780857378.db2.gz GYMLKNSPVZRHSS-LBPRGKRZSA-N 0 3 294.395 2.737 20 10 CFCDHN CN(C)[C@H]1CCC[C@@H]([NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000708421152 781273694 /nfs/dbraw/zinc/27/36/94/781273694.db2.gz PXBXWARZJADONC-OLZOCXBDSA-N 0 3 284.350 2.633 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185425023 282282142 /nfs/dbraw/zinc/28/21/42/282282142.db2.gz BYPIHYGMBHZUGK-MEBBXXQBSA-N 0 3 269.360 2.979 20 10 CFCDHN CCOCc1cc(CNC[C@H](OC)C(C)C)ccc1OC ZINC000072924475 346948459 /nfs/dbraw/zinc/94/84/59/346948459.db2.gz DUCXOFQVZLZCBM-KRWDZBQOSA-N 0 3 295.423 2.992 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C(C)(C)O ZINC000295106685 199348529 /nfs/dbraw/zinc/34/85/29/199348529.db2.gz WTXPCDNARQWXES-BXUZGUMPSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](C)CCCCO)cc1C ZINC000295122361 199356521 /nfs/dbraw/zinc/35/65/21/199356521.db2.gz WTYJPYXDKYLIEF-ZDUSSCGKSA-N 0 3 251.370 2.650 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H](CO)C(C)(C)C)cc1C ZINC000093821934 347684585 /nfs/dbraw/zinc/68/45/85/347684585.db2.gz WMFPBXGHHCBMLR-HNNXBMFYSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H](CO)C(C)(C)C)cc1C ZINC000093821934 347684586 /nfs/dbraw/zinc/68/45/86/347684586.db2.gz WMFPBXGHHCBMLR-HNNXBMFYSA-N 0 3 265.397 2.848 20 10 CFCDHN CN(C)CCN(C(=O)/C=C\c1cccnc1)c1ccccc1 ZINC000491323311 348627231 /nfs/dbraw/zinc/62/72/31/348627231.db2.gz ZCJXWLCWFZSGGZ-KHPPLWFESA-N 0 3 295.386 2.690 20 10 CFCDHN CN1CCC[C@@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178345 539881567 /nfs/dbraw/zinc/88/15/67/539881567.db2.gz VQIBVAMSZMEKKQ-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CCC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178345 539881568 /nfs/dbraw/zinc/88/15/68/539881568.db2.gz VQIBVAMSZMEKKQ-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178345 539881570 /nfs/dbraw/zinc/88/15/70/539881570.db2.gz VQIBVAMSZMEKKQ-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000228178345 539881572 /nfs/dbraw/zinc/88/15/72/539881572.db2.gz VQIBVAMSZMEKKQ-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@H](C)CCO)c1ccccc1[O-] ZINC000295178858 199389984 /nfs/dbraw/zinc/38/99/84/199389984.db2.gz VHZMZMCGIGEBSM-GXTWGEPZSA-N 0 3 251.370 2.842 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCOC2(C)C)c1[O-] ZINC000294687752 199133824 /nfs/dbraw/zinc/13/38/24/199133824.db2.gz CAIOXGYXYDRPMY-LBPRGKRZSA-N 0 3 285.771 2.711 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](OC)C(C)(C)C2)c1[O-] ZINC000294934908 199258602 /nfs/dbraw/zinc/25/86/02/199258602.db2.gz GNMRHVLNSRMQGY-AWEZNQCLSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](OC)C(C)(C)C2)c1[O-] ZINC000294934908 199258603 /nfs/dbraw/zinc/25/86/03/199258603.db2.gz GNMRHVLNSRMQGY-AWEZNQCLSA-N 0 3 279.380 2.648 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CO)CC1CCC1)CC2 ZINC000296294447 199843930 /nfs/dbraw/zinc/84/39/30/199843930.db2.gz DFKDAJUAELIDJZ-KBPBESRZSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1cccs1 ZINC000297547190 200223967 /nfs/dbraw/zinc/22/39/67/200223967.db2.gz FLMUSOVAXVBPNI-LRDDRELGSA-N 0 3 289.400 2.938 20 10 CFCDHN C[C@H]([NH2+]Cc1cccnc1-n1ccnc1)c1ccccc1[O-] ZINC000183410096 299324734 /nfs/dbraw/zinc/32/47/34/299324734.db2.gz QCMJJAFGVRJJCM-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(C)C ZINC000296349042 284307427 /nfs/dbraw/zinc/30/74/27/284307427.db2.gz IGABYDDDYJLIJR-DOMZBBRYSA-N 0 3 278.396 2.546 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000038013585 372766232 /nfs/dbraw/zinc/76/62/32/372766232.db2.gz GNYPTLNBOKPVGP-OCCSQVGLSA-N 0 3 278.396 2.738 20 10 CFCDHN CC[C@H](C)NC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000038014106 372768155 /nfs/dbraw/zinc/76/81/55/372768155.db2.gz RDRSAMTWXAOXCM-KBPBESRZSA-N 0 3 291.439 2.708 20 10 CFCDHN COc1cccc(C[NH2+]C2Cc3ccccc3C2)c1[O-] ZINC000083514195 374751514 /nfs/dbraw/zinc/75/15/14/374751514.db2.gz VXGKUCAQNSIACS-UHFFFAOYSA-N 0 3 269.344 2.658 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CC)C[C@H]2CCCO2)c1 ZINC000092407752 375109663 /nfs/dbraw/zinc/10/96/63/375109663.db2.gz NGVAFVPDDCUYQH-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CC)C[C@H]2CCCO2)c1 ZINC000092407752 375109667 /nfs/dbraw/zinc/10/96/67/375109667.db2.gz NGVAFVPDDCUYQH-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000093644243 375280007 /nfs/dbraw/zinc/28/00/07/375280007.db2.gz TYAQBQNKVZKSKO-UKRRQHHQSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000093644243 375280010 /nfs/dbraw/zinc/28/00/10/375280010.db2.gz TYAQBQNKVZKSKO-UKRRQHHQSA-N 0 3 292.423 2.705 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@@H]2CCOC2)c([O-])c1 ZINC000093840186 375320497 /nfs/dbraw/zinc/32/04/97/375320497.db2.gz QCUYGDGWESAFPA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@@H]2CCOC2)c([O-])c1 ZINC000093840186 375320504 /nfs/dbraw/zinc/32/05/04/375320504.db2.gz QCUYGDGWESAFPA-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccccc1CC[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000112016844 375877137 /nfs/dbraw/zinc/87/71/37/375877137.db2.gz ITFITGXVIPFBNR-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN CCOc1cccc(CNCc2c(C)noc2C)c1O ZINC000112017537 375877215 /nfs/dbraw/zinc/87/72/15/375877215.db2.gz XECKJGBMGYWFCD-UHFFFAOYSA-N 0 3 276.336 2.686 20 10 CFCDHN Cc1cccc(C[NH2+]CCCOCC(C)C)c1[O-] ZINC000124674714 377075079 /nfs/dbraw/zinc/07/50/79/377075079.db2.gz OPANIAJWZXBGCM-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCn2cccn2)c([O-])c1 ZINC000126265764 377219282 /nfs/dbraw/zinc/21/92/82/377219282.db2.gz ISJCBCXSICDWRT-CYBMUJFWSA-N 0 3 259.353 2.638 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C[C@@H]2CCOC2)C2CC2)c1 ZINC000130034777 377504246 /nfs/dbraw/zinc/50/42/46/377504246.db2.gz QPCUVZMIBPENOD-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c1 ZINC000130034777 377504250 /nfs/dbraw/zinc/50/42/50/377504250.db2.gz QPCUVZMIBPENOD-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C)C2CC(F)(F)C2)c1 ZINC000529550722 383730033 /nfs/dbraw/zinc/73/00/33/383730033.db2.gz PKTGXJKRYMKAHZ-VIFPVBQESA-N 0 3 271.307 2.924 20 10 CFCDHN Cc1ccc([O-])c(CN(C)Cc2ccc(N(C)C)cc2)n1 ZINC000155187793 378615489 /nfs/dbraw/zinc/61/54/89/378615489.db2.gz ZWSLTIBXLUHDCS-UHFFFAOYSA-N 0 3 285.391 2.794 20 10 CFCDHN Cc1ccc(O)c(CN(C)Cc2ccc(N(C)C)cc2)n1 ZINC000155187793 378615491 /nfs/dbraw/zinc/61/54/91/378615491.db2.gz ZWSLTIBXLUHDCS-UHFFFAOYSA-N 0 3 285.391 2.794 20 10 CFCDHN COCCC1CC[NH+](Cc2cccc(OC)c2[O-])CC1 ZINC000529637350 383739452 /nfs/dbraw/zinc/73/94/52/383739452.db2.gz FDIHAWAYJSIFBZ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[NH2+]CC1COC1 ZINC000529675115 383746192 /nfs/dbraw/zinc/74/61/92/383746192.db2.gz PNWPJZXPVOZLRY-UHFFFAOYSA-N 0 3 299.370 2.707 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1COc2ccccc2O1 ZINC000178856976 380489162 /nfs/dbraw/zinc/48/91/62/380489162.db2.gz LRDRBMDGSDNARJ-AWEZNQCLSA-N 0 3 285.343 2.664 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1COc2ccccc2O1 ZINC000178856976 380489169 /nfs/dbraw/zinc/48/91/69/380489169.db2.gz LRDRBMDGSDNARJ-AWEZNQCLSA-N 0 3 285.343 2.664 20 10 CFCDHN CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179566168 380558514 /nfs/dbraw/zinc/55/85/14/380558514.db2.gz NJQOMDUWKPXGQY-OAHLLOKOSA-N 0 3 290.407 2.521 20 10 CFCDHN CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179566168 380558519 /nfs/dbraw/zinc/55/85/19/380558519.db2.gz NJQOMDUWKPXGQY-OAHLLOKOSA-N 0 3 290.407 2.521 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2ccccc2[O-])C[C@@H]1n1ccnc1 ZINC000179586130 380561177 /nfs/dbraw/zinc/56/11/77/380561177.db2.gz UTZHPBPQVFNEKU-HIFRSBDPSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@@H]1n1ccnc1 ZINC000179586130 380561180 /nfs/dbraw/zinc/56/11/80/380561180.db2.gz UTZHPBPQVFNEKU-HIFRSBDPSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000179667804 380569872 /nfs/dbraw/zinc/56/98/72/380569872.db2.gz ADPJSIWWFTVTLL-CXMBCZLWSA-N 0 3 269.344 2.701 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@H](C)CCSC)cc1OC ZINC000180349843 380647884 /nfs/dbraw/zinc/64/78/84/380647884.db2.gz XEHDDCOPVXIRDR-LLVKDONJSA-N 0 3 299.436 2.983 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@H](C)CCSC)cc1OC ZINC000180349843 380647887 /nfs/dbraw/zinc/64/78/87/380647887.db2.gz XEHDDCOPVXIRDR-LLVKDONJSA-N 0 3 299.436 2.983 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[N@H+](C)Cc1cc(F)ccc1[O-] ZINC000180245856 380638093 /nfs/dbraw/zinc/63/80/93/380638093.db2.gz UAHVFYASEXOMKJ-AWEZNQCLSA-N 0 3 289.354 2.774 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1cc(F)ccc1[O-] ZINC000180245856 380638098 /nfs/dbraw/zinc/63/80/98/380638098.db2.gz UAHVFYASEXOMKJ-AWEZNQCLSA-N 0 3 289.354 2.774 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000180479218 380666428 /nfs/dbraw/zinc/66/64/28/380666428.db2.gz GEQWRELCGJPOOK-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000180479218 380666436 /nfs/dbraw/zinc/66/64/36/380666436.db2.gz GEQWRELCGJPOOK-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1ccc(O)c(CN(C)CCC(=O)OC(C)(C)C)c1 ZINC000180479218 380666440 /nfs/dbraw/zinc/66/64/40/380666440.db2.gz GEQWRELCGJPOOK-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1[O-] ZINC000180370051 380649566 /nfs/dbraw/zinc/64/95/66/380649566.db2.gz PXPGDSNUFWJXMI-CYBMUJFWSA-N 0 3 279.380 2.837 20 10 CFCDHN CC1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C(C)(C)O1 ZINC000181054466 380730309 /nfs/dbraw/zinc/73/03/09/380730309.db2.gz QFEICTHLKVJKHF-CYBMUJFWSA-N 0 3 267.344 2.967 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC2(O)CCOCC2)c([O-])c1C ZINC000287761970 380931664 /nfs/dbraw/zinc/93/16/64/380931664.db2.gz ZWOGJJRHXXYVDF-AWEZNQCLSA-N 0 3 293.407 2.591 20 10 CFCDHN Cc1nc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)cs1 ZINC000295861547 381122839 /nfs/dbraw/zinc/12/28/39/381122839.db2.gz GOBYHUFMOKJPDG-CYBMUJFWSA-N 0 3 274.389 2.977 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCN1CCCCCC1)CC2 ZINC000295974702 381193059 /nfs/dbraw/zinc/19/30/59/381193059.db2.gz MWZZODCBEBEDIC-HNNXBMFYSA-N 0 3 274.408 2.845 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cccc(C(=O)NC)c1)c1ccccc1[O-] ZINC000183345311 381258175 /nfs/dbraw/zinc/25/81/75/381258175.db2.gz XYFFZTVZGYLEJV-MRXNPFEDSA-N 0 3 298.386 2.993 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1)CC2 ZINC000296045526 381227911 /nfs/dbraw/zinc/22/79/11/381227911.db2.gz QWWGUFFBFYHBMB-ZBFHGGJFSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@H](O)CC(C)(C)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183612076 381293229 /nfs/dbraw/zinc/29/32/29/381293229.db2.gz SOKHNLPRJHMEIK-RYUDHWBXSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccccc1[O-] ZINC000183623430 381296794 /nfs/dbraw/zinc/29/67/94/381296794.db2.gz DPPIYRQCTKJULR-NEPJUHHUSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)N1CCCCCC1)c1ccccc1[O-] ZINC000183473655 381275843 /nfs/dbraw/zinc/27/58/43/381275843.db2.gz YVLZQEVZTJMMTH-CQSZACIVSA-N 0 3 290.407 2.836 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccccc1[O-] ZINC000183527747 381283415 /nfs/dbraw/zinc/28/34/15/381283415.db2.gz WWIQGAKHDRGSPO-BQPHKTIFSA-N 0 3 261.365 2.856 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCCO)c([O-])c1 ZINC000296313001 381342697 /nfs/dbraw/zinc/34/26/97/381342697.db2.gz GLPPXQMWXCNIAW-CHWSQXEVSA-N 0 3 251.370 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CCCCO)c([O-])c1 ZINC000296313003 381342716 /nfs/dbraw/zinc/34/27/16/381342716.db2.gz GLPPXQMWXCNIAW-OLZOCXBDSA-N 0 3 251.370 2.902 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCSC2)c1[O-] ZINC000184678910 381458925 /nfs/dbraw/zinc/45/89/25/381458925.db2.gz BVLBOPOWWWJINC-LLVKDONJSA-N 0 3 287.812 2.992 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCSC2)c1[O-] ZINC000184678910 381458933 /nfs/dbraw/zinc/45/89/33/381458933.db2.gz BVLBOPOWWWJINC-LLVKDONJSA-N 0 3 287.812 2.992 20 10 CFCDHN COC[C@H](C)[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184682347 381461145 /nfs/dbraw/zinc/46/11/45/381461145.db2.gz ILZZALFALLNGKX-VIFPVBQESA-N 0 3 273.760 2.521 20 10 CFCDHN COC[C@H](C)[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184682347 381461150 /nfs/dbraw/zinc/46/11/50/381461150.db2.gz ILZZALFALLNGKX-VIFPVBQESA-N 0 3 273.760 2.521 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000184695451 381462602 /nfs/dbraw/zinc/46/26/02/381462602.db2.gz URFCIHLHQOTLLU-GXFFZTMASA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000184695451 381462605 /nfs/dbraw/zinc/46/26/05/381462605.db2.gz URFCIHLHQOTLLU-GXFFZTMASA-N 0 3 299.798 2.790 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000296596616 381465009 /nfs/dbraw/zinc/46/50/09/381465009.db2.gz VIZXAYSMSMYBNT-ZANVPECISA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1ncsc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296658071 381495625 /nfs/dbraw/zinc/49/56/25/381495625.db2.gz ZMQZPYUDAXQWQB-GFCCVEGCSA-N 0 3 274.389 2.977 20 10 CFCDHN CCC[N@H+](CCc1cn[nH]c1)Cc1ccccc1[O-] ZINC000298002501 381577660 /nfs/dbraw/zinc/57/76/60/381577660.db2.gz ZQTYGXUYEGEKJH-UHFFFAOYSA-N 0 3 259.353 2.570 20 10 CFCDHN CCC[N@@H+](CCc1cn[nH]c1)Cc1ccccc1[O-] ZINC000298002501 381577667 /nfs/dbraw/zinc/57/76/67/381577667.db2.gz ZQTYGXUYEGEKJH-UHFFFAOYSA-N 0 3 259.353 2.570 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CCN(c3ccccn3)C1)CC2 ZINC000297144854 381553251 /nfs/dbraw/zinc/55/32/51/381553251.db2.gz ZRLPZHHHYPYUFT-GJZGRUSLSA-N 0 3 295.386 2.643 20 10 CFCDHN COc1ccncc1CN[C@@H]1CCc2cccc(O)c21 ZINC000297311613 381557095 /nfs/dbraw/zinc/55/70/95/381557095.db2.gz MWMGPEPKYVFBRB-CYBMUJFWSA-N 0 3 270.332 2.573 20 10 CFCDHN CC(=O)N1CCC(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])CC1 ZINC000185377055 381618069 /nfs/dbraw/zinc/61/80/69/381618069.db2.gz OWRQMFLEYSSECD-ZDUSSCGKSA-N 0 3 290.407 2.610 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(c3cn[nH]c3)CC2)c1[O-] ZINC000371419797 381622989 /nfs/dbraw/zinc/62/29/89/381622989.db2.gz WSLXKQQJKCXPPT-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185466680 381642847 /nfs/dbraw/zinc/64/28/47/381642847.db2.gz RKLAXSJHUQSVMA-FGDXXIHYSA-N 0 3 287.334 2.840 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C[C@@H](C)O)c([O-])c1 ZINC000185521730 381656769 /nfs/dbraw/zinc/65/67/69/381656769.db2.gz PCEFRUCAGHUJDQ-JHJVBQTASA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1[O-] ZINC000292763015 381825698 /nfs/dbraw/zinc/82/56/98/381825698.db2.gz JQRBZKHHTTVVCH-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1[O-] ZINC000292763015 381825703 /nfs/dbraw/zinc/82/57/03/381825703.db2.gz JQRBZKHHTTVVCH-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c([O-])c1 ZINC000186115463 381826365 /nfs/dbraw/zinc/82/63/65/381826365.db2.gz VMTVZZIRJSAWII-DGCLKSJQSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCCCCO)c([O-])c1 ZINC000186231453 381859685 /nfs/dbraw/zinc/85/96/85/381859685.db2.gz LVGAZSWTRBETNG-CYBMUJFWSA-N 0 3 251.370 2.904 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000186444661 381913450 /nfs/dbraw/zinc/91/34/50/381913450.db2.gz LZTNXYFMIBJKJD-STQMWFEESA-N 0 3 292.379 2.582 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@H](C)c2cc(C)ccc2[O-])C1 ZINC000186457613 381916648 /nfs/dbraw/zinc/91/66/48/381916648.db2.gz PVNNIFNFQZTWRD-CHWSQXEVSA-N 0 3 292.379 2.582 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000373370703 381989011 /nfs/dbraw/zinc/98/90/11/381989011.db2.gz RGGQQJZIYIWASC-SJORKVTESA-N 0 3 291.391 2.696 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1[O-] ZINC000375805476 382103769 /nfs/dbraw/zinc/10/37/69/382103769.db2.gz MDRYQTKCEVSVIR-GXTWGEPZSA-N 0 3 289.354 2.853 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000375407445 382085386 /nfs/dbraw/zinc/08/53/86/382085386.db2.gz XAEPTACIDHMPEN-ZDUSSCGKSA-N 0 3 285.347 2.642 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000375407445 382085394 /nfs/dbraw/zinc/08/53/94/382085394.db2.gz XAEPTACIDHMPEN-ZDUSSCGKSA-N 0 3 285.347 2.642 20 10 CFCDHN COC1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CCCCC1 ZINC000187441472 382182713 /nfs/dbraw/zinc/18/27/13/382182713.db2.gz BTBKDILEVLXKQW-UHFFFAOYSA-N 0 3 293.363 2.560 20 10 CFCDHN CN(C)c1ccc(CN2CCC(c3c[nH]cn3)CC2)cc1 ZINC000376492102 382139062 /nfs/dbraw/zinc/13/90/62/382139062.db2.gz OPZOLNNEJWAZBP-UHFFFAOYSA-N 0 3 284.407 2.855 20 10 CFCDHN CCOCC(C)(C)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000293520589 382155979 /nfs/dbraw/zinc/15/59/79/382155979.db2.gz AYIMPUHZRXDBBF-UHFFFAOYSA-N 0 3 287.787 2.959 20 10 CFCDHN CC(C)Cn1cc(CNCc2ccc3c(c2)CCN3C)cn1 ZINC000376937975 382193423 /nfs/dbraw/zinc/19/34/23/382193423.db2.gz UCEIEKGIXTYWFZ-UHFFFAOYSA-N 0 3 298.434 2.821 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000377236944 382239818 /nfs/dbraw/zinc/23/98/18/382239818.db2.gz GWXLGRCVXJWKNJ-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000377236944 382239823 /nfs/dbraw/zinc/23/98/23/382239823.db2.gz GWXLGRCVXJWKNJ-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H]2COC)cc1 ZINC000293703874 382242378 /nfs/dbraw/zinc/24/23/78/382242378.db2.gz RTQLOXYHVYBDHS-MRXNPFEDSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@]3(C2)CCCN(C)C3)c1 ZINC000293748121 382260837 /nfs/dbraw/zinc/26/08/37/382260837.db2.gz WOWQXTIZLLFMQO-KRWDZBQOSA-N 0 3 274.408 2.618 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@]3(C2)CCCN(C)C3)c1 ZINC000293748121 382260841 /nfs/dbraw/zinc/26/08/41/382260841.db2.gz WOWQXTIZLLFMQO-KRWDZBQOSA-N 0 3 274.408 2.618 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)C(F)(F)F)c([O-])c1 ZINC000293771050 382272666 /nfs/dbraw/zinc/27/26/66/382272666.db2.gz PPGMNZILGAOVOJ-GXSJLCMTSA-N 0 3 277.286 2.583 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCN(C)C)c([O-])c1 ZINC000293773038 382274024 /nfs/dbraw/zinc/27/40/24/382274024.db2.gz PRJLDENOBMQTDZ-CYBMUJFWSA-N 0 3 250.386 2.611 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCOCC3(CCCC3)C2)c1 ZINC000364328336 382306973 /nfs/dbraw/zinc/30/69/73/382306973.db2.gz MRMPMDIVMHXMRZ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCOCC3(CCCC3)C2)c1 ZINC000364328336 382306978 /nfs/dbraw/zinc/30/69/78/382306978.db2.gz MRMPMDIVMHXMRZ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000377697454 382323689 /nfs/dbraw/zinc/32/36/89/382323689.db2.gz LLIJZZJGUWOHNA-ZFWWWQNUSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000377697448 382323952 /nfs/dbraw/zinc/32/39/52/382323952.db2.gz LLIJZZJGUWOHNA-DZGCQCFKSA-N 0 3 285.391 2.892 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000188036032 382331037 /nfs/dbraw/zinc/33/10/37/382331037.db2.gz BSQAYNASGPQHJT-GUTXKFCHSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000365330968 382378740 /nfs/dbraw/zinc/37/87/40/382378740.db2.gz NKSUUCNONCBPKB-NSHDSACASA-N 0 3 275.348 2.885 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000365330968 382378742 /nfs/dbraw/zinc/37/87/42/382378742.db2.gz NKSUUCNONCBPKB-NSHDSACASA-N 0 3 275.348 2.885 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])[C@@H]2CCC[C@H]2O1 ZINC000367251645 382561936 /nfs/dbraw/zinc/56/19/36/382561936.db2.gz OXTKPJUSRYSUML-UKRRQHHQSA-N 0 3 261.365 2.924 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])[C@@H]2CCC[C@H]2O1 ZINC000367251645 382561937 /nfs/dbraw/zinc/56/19/37/382561937.db2.gz OXTKPJUSRYSUML-UKRRQHHQSA-N 0 3 261.365 2.924 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C(=O)OC)C(C)(C)C1 ZINC000367316917 382563697 /nfs/dbraw/zinc/56/36/97/382563697.db2.gz FYVAPVCWOGAJTI-KBPBESRZSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1C[C@@H](C(=O)OC)C(C)(C)C1 ZINC000367316917 382563699 /nfs/dbraw/zinc/56/36/99/382563699.db2.gz FYVAPVCWOGAJTI-KBPBESRZSA-N 0 3 291.391 2.974 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCc2nccnc2C)c1 ZINC000295035019 382563733 /nfs/dbraw/zinc/56/37/33/382563733.db2.gz OYXIOMIZMLYNSM-LBPRGKRZSA-N 0 3 271.364 2.692 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH+]2CCC3(CCO3)CC2)c1 ZINC000367356070 382565836 /nfs/dbraw/zinc/56/58/36/382565836.db2.gz JLLGLNSJNOMBMP-LBPRGKRZSA-N 0 3 277.364 2.717 20 10 CFCDHN COC[C@@]1(C)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000295136122 382578349 /nfs/dbraw/zinc/57/83/49/382578349.db2.gz PFJKUEYQYWNABN-INIZCTEOSA-N 0 3 280.387 2.750 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000190211097 382657094 /nfs/dbraw/zinc/65/70/94/382657094.db2.gz LRXSCRHURXSIIK-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000190211097 382657095 /nfs/dbraw/zinc/65/70/95/382657095.db2.gz LRXSCRHURXSIIK-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)cc1C ZINC000190344582 382663340 /nfs/dbraw/zinc/66/33/40/382663340.db2.gz VRYBMHSKPORFLD-IIAWOOMASA-N 0 3 261.365 2.666 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000190683786 382677756 /nfs/dbraw/zinc/67/77/56/382677756.db2.gz QMXXGYBGMGHFEC-JTQLQIEISA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000190683786 382677758 /nfs/dbraw/zinc/67/77/58/382677758.db2.gz QMXXGYBGMGHFEC-JTQLQIEISA-N 0 3 255.358 2.859 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1ccccc1[O-] ZINC000248393513 383233697 /nfs/dbraw/zinc/23/36/97/383233697.db2.gz WWIQGAKHDRGSPO-QMGNLALYSA-N 0 3 261.365 2.856 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c([O-])c1 ZINC000249577694 383351721 /nfs/dbraw/zinc/35/17/21/383351721.db2.gz AKWQWURUGGNZMA-ZIEJDFEHSA-N 0 3 261.365 2.919 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@H]1CCOC1 ZINC000252805596 383436456 /nfs/dbraw/zinc/43/64/56/383436456.db2.gz GANQILYAQULYFL-VWYCJHECSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1cccc(F)c1 ZINC000267219156 384327634 /nfs/dbraw/zinc/32/76/34/384327634.db2.gz SJLJDHTUVANQNN-MEDUHNTESA-N 0 3 275.323 2.743 20 10 CFCDHN CCOc1ccc(O)c(CN[C@@H]2CCCc3c[nH]nc32)c1 ZINC000268830071 384670828 /nfs/dbraw/zinc/67/08/28/384670828.db2.gz KCSWCQZLVHQBQY-CQSZACIVSA-N 0 3 287.363 2.681 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCC[C@@H](C)CO)c([O-])c1 ZINC000270264100 385034958 /nfs/dbraw/zinc/03/49/58/385034958.db2.gz IXIVFLNDPZGLHC-CYBMUJFWSA-N 0 3 281.396 2.679 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)CC2CCC2)c1 ZINC000281186868 385186486 /nfs/dbraw/zinc/18/64/86/385186486.db2.gz QZONLSLGPXDLIP-OCCSQVGLSA-N 0 3 263.381 2.902 20 10 CFCDHN O[C@@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000270984796 385290793 /nfs/dbraw/zinc/29/07/93/385290793.db2.gz FOBWFIHSWSPERM-QGZVFWFLSA-N 0 3 274.408 2.634 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])CC(OC)OC ZINC000282556348 385340851 /nfs/dbraw/zinc/34/08/51/385340851.db2.gz XVPLAGKTJSOXDW-UHFFFAOYSA-N 0 3 267.369 2.613 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])CC(OC)OC ZINC000282556348 385340853 /nfs/dbraw/zinc/34/08/53/385340853.db2.gz XVPLAGKTJSOXDW-UHFFFAOYSA-N 0 3 267.369 2.613 20 10 CFCDHN COc1cccc(C[NH+]2CCC(c3ncc[nH]3)CC2)c1[O-] ZINC000271167972 385359561 /nfs/dbraw/zinc/35/95/61/385359561.db2.gz CJHYDQDATWYUTO-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC000271735318 385390314 /nfs/dbraw/zinc/39/03/14/385390314.db2.gz OKJSLUQPGFGAPK-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC000271735318 385390316 /nfs/dbraw/zinc/39/03/16/385390316.db2.gz OKJSLUQPGFGAPK-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000271218058 385377388 /nfs/dbraw/zinc/37/73/88/385377388.db2.gz FMBGMDXCJBUEJZ-GXTWGEPZSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c1[O-] ZINC000271504839 385384251 /nfs/dbraw/zinc/38/42/51/385384251.db2.gz LCXKZFPUCDSLFU-DZGCQCFKSA-N 0 3 279.380 2.694 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H]2CCO[C@@H](C)C2)c1 ZINC000271569583 385385470 /nfs/dbraw/zinc/38/54/70/385385470.db2.gz WXOFIGOLAFRWNZ-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](CO)Cc2ccc(F)cc2)c1[O-] ZINC000271778619 385391426 /nfs/dbraw/zinc/39/14/26/385391426.db2.gz DAOCRWJDVQOLNJ-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN CCCCN(Cc1cncnc1)Cc1ccccc1O ZINC000283120055 385438793 /nfs/dbraw/zinc/43/87/93/385438793.db2.gz VDTBHDDECZFJAE-UHFFFAOYSA-N 0 3 271.364 2.985 20 10 CFCDHN Cc1cc(C)cc([C@H](O)C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000283059361 385430222 /nfs/dbraw/zinc/43/02/22/385430222.db2.gz PNIOAEBXGVYJAC-QGZVFWFLSA-N 0 3 289.350 2.971 20 10 CFCDHN COC(=O)C(C)(C)CC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000284278431 385547361 /nfs/dbraw/zinc/54/73/61/385547361.db2.gz FHCNYKJUVRIQMW-LLVKDONJSA-N 0 3 295.379 2.641 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000272394943 385526485 /nfs/dbraw/zinc/52/64/85/385526485.db2.gz HXXIPKABSMAEBD-GJZGRUSLSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000272394943 385526489 /nfs/dbraw/zinc/52/64/89/385526489.db2.gz HXXIPKABSMAEBD-GJZGRUSLSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H](C)CC[S@@](C)=O)c([O-])c1 ZINC000285008384 385551127 /nfs/dbraw/zinc/55/11/27/385551127.db2.gz HBLVWTCXJQWMSG-QHRIQVFBSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)C(C)C)c([O-])c1 ZINC000285248825 385554140 /nfs/dbraw/zinc/55/41/40/385554140.db2.gz PWRVNIMNMIGZHI-GXTWGEPZSA-N 0 3 251.370 2.677 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCSCC2)c1[O-] ZINC000272878793 385638551 /nfs/dbraw/zinc/63/85/51/385638551.db2.gz XKSQPXNNVGWMCE-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCSCC2)c1[O-] ZINC000272878793 385638555 /nfs/dbraw/zinc/63/85/55/385638555.db2.gz XKSQPXNNVGWMCE-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN C[C@]1([NH2+]Cc2cc(F)ccc2[O-])CCO[C@@H]1C1CC1 ZINC000273241071 385675420 /nfs/dbraw/zinc/67/54/20/385675420.db2.gz YTARCRYOKVVFKE-CABCVRRESA-N 0 3 265.328 2.579 20 10 CFCDHN COC[C@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273304010 385676625 /nfs/dbraw/zinc/67/66/25/385676625.db2.gz CHNYEUNMTRXDSI-ZWNOBZJWSA-N 0 3 251.370 2.942 20 10 CFCDHN CN(C)c1ccc(CN(C)CCc2ccccn2)cc1F ZINC000273351862 385678835 /nfs/dbraw/zinc/67/88/35/385678835.db2.gz BESCVAXJDDFACP-UHFFFAOYSA-N 0 3 287.382 2.961 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CN2CCCC2=O)c([O-])c1C ZINC000273387183 385681029 /nfs/dbraw/zinc/68/10/29/385681029.db2.gz JXJSEVYBPMCAJS-TZMCWYRMSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1C ZINC000273403524 385681056 /nfs/dbraw/zinc/68/10/56/385681056.db2.gz NTCFXDAMIQTLHC-CYBMUJFWSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1noc(CCC[NH2+][C@H](C)c2ccc(C)cc2[O-])n1 ZINC000273472238 385685217 /nfs/dbraw/zinc/68/52/17/385685217.db2.gz KAHQESDTTLIRED-LLVKDONJSA-N 0 3 275.352 2.675 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000273548979 385687698 /nfs/dbraw/zinc/68/76/98/385687698.db2.gz FNPNKORZTVKXIS-MQIPJXDCSA-N 0 3 290.407 2.534 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCN2CCOC2=O)c([O-])c1C ZINC000273574627 385689363 /nfs/dbraw/zinc/68/93/63/385689363.db2.gz LLJBTXCFNCJIPL-CYBMUJFWSA-N 0 3 292.379 2.502 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(CCO)CCCC2)c1 ZINC000273591896 385689450 /nfs/dbraw/zinc/68/94/50/385689450.db2.gz PKQQQWYDRKQPKQ-ZDUSSCGKSA-N 0 3 293.407 2.994 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CCO)c([O-])c1C ZINC000273588486 385689610 /nfs/dbraw/zinc/68/96/10/385689610.db2.gz ONVWQFXOLNRVAJ-GXFFZTMASA-N 0 3 251.370 2.678 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000273583644 385690136 /nfs/dbraw/zinc/69/01/36/385690136.db2.gz NFOFTGLNFLWOCJ-GFCCVEGCSA-N 0 3 259.353 2.556 20 10 CFCDHN CCSCCNCc1ccc(N(C)C)c(F)c1 ZINC000273749615 385694564 /nfs/dbraw/zinc/69/45/64/385694564.db2.gz OUGZALJJTMPDAD-UHFFFAOYSA-N 0 3 256.390 2.734 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c1 ZINC000273167237 385671321 /nfs/dbraw/zinc/67/13/21/385671321.db2.gz LQOLSAHNUQAXPI-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCO2)[C@H](O)c1ccccc1 ZINC000288478206 197089054 /nfs/dbraw/zinc/08/90/54/197089054.db2.gz GGVTUFHZPFHZEQ-ACJLOTCBSA-N 0 3 283.371 2.833 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000289245652 285398581 /nfs/dbraw/zinc/39/85/81/285398581.db2.gz DXTAADAVKXCKOP-ZDUSSCGKSA-N 0 3 289.297 2.672 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000289245652 285398582 /nfs/dbraw/zinc/39/85/82/285398582.db2.gz DXTAADAVKXCKOP-ZDUSSCGKSA-N 0 3 289.297 2.672 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(OC2CCOCC2)CC1 ZINC000374257747 393491237 /nfs/dbraw/zinc/49/12/37/393491237.db2.gz FXZUQIBNUKNSEJ-UHFFFAOYSA-N 0 3 291.391 2.552 20 10 CFCDHN CCN(CC)c1ccc(CN2CCCOCC2)cc1 ZINC000374303528 393492446 /nfs/dbraw/zinc/49/24/46/393492446.db2.gz VJDPJABJLATQQP-UHFFFAOYSA-N 0 3 262.397 2.755 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC(=O)N2CCCC[C@H]12)c1ccccc1[O-] ZINC000374508099 393498308 /nfs/dbraw/zinc/49/83/08/393498308.db2.gz UFWHBEDPCIXKDO-SOUVJXGZSA-N 0 3 288.391 2.586 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@@H]2CCCOC2)cc1C ZINC000107671914 393870942 /nfs/dbraw/zinc/87/09/42/393870942.db2.gz VBLRTJLHOXQMMI-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@@H]2CCCOC2)cc1C ZINC000107671914 393870944 /nfs/dbraw/zinc/87/09/44/393870944.db2.gz VBLRTJLHOXQMMI-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN CCOCC[N@H+](CC)Cc1cc(C)c(C)cc1[O-] ZINC000107669016 393870956 /nfs/dbraw/zinc/87/09/56/393870956.db2.gz DUVYAJOVTXLLCX-UHFFFAOYSA-N 0 3 251.370 2.867 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1cc(C)c(C)cc1[O-] ZINC000107669016 393870959 /nfs/dbraw/zinc/87/09/59/393870959.db2.gz DUVYAJOVTXLLCX-UHFFFAOYSA-N 0 3 251.370 2.867 20 10 CFCDHN C[N@H+](CCC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000109770390 393879629 /nfs/dbraw/zinc/87/96/29/393879629.db2.gz QXIDAKANRJWJRU-UHFFFAOYSA-N 0 3 265.353 2.556 20 10 CFCDHN C[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000109770390 393879633 /nfs/dbraw/zinc/87/96/33/393879633.db2.gz QXIDAKANRJWJRU-UHFFFAOYSA-N 0 3 265.353 2.556 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1cccc(OC)c1[O-] ZINC000119708553 393923989 /nfs/dbraw/zinc/92/39/89/393923989.db2.gz NDMXAPFIVOVCLF-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCN3CCCC[C@H]23)c1 ZINC000036997082 292166179 /nfs/dbraw/zinc/16/61/79/292166179.db2.gz MAUUJODTONCJNA-NUEKZKHPSA-N 0 3 274.408 2.978 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000020146125 171031721 /nfs/dbraw/zinc/03/17/21/171031721.db2.gz BWEXIZHOPAYJDL-UHFFFAOYSA-N 0 3 285.347 2.951 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCOCC(C)C)c1 ZINC000020147389 171033975 /nfs/dbraw/zinc/03/39/75/171033975.db2.gz JWRYKIWKMLNIQG-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN COc1ccc(O)c(CNCc2cccc(F)c2)c1 ZINC000020473270 171216599 /nfs/dbraw/zinc/21/65/99/171216599.db2.gz IQPGVQASBOQDTA-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)N2CCCCC2)c1 ZINC000038028446 174017146 /nfs/dbraw/zinc/01/71/46/174017146.db2.gz MMTZDPRJZYZADQ-KBPBESRZSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[C@@H]2CCCO2)c1 ZINC000038095581 174109273 /nfs/dbraw/zinc/10/92/73/174109273.db2.gz JZOHKJGXGZVWBP-NEPJUHHUSA-N 0 3 265.353 2.621 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2ccc(O)cc2)c1[O-] ZINC000040735272 174389071 /nfs/dbraw/zinc/38/90/71/174389071.db2.gz SJPZEGRZXOHWPE-UHFFFAOYSA-N 0 3 287.359 2.829 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCN(c2ccccn2)CC1 ZINC000036932184 260052174 /nfs/dbraw/zinc/05/21/74/260052174.db2.gz OJLWQXWMAQPMCJ-UHFFFAOYSA-N 0 3 283.375 2.546 20 10 CFCDHN CN(C)c1ccc(C2=CCN(CCCn3ccnc3)C2)cc1 ZINC000368040583 267140164 /nfs/dbraw/zinc/14/01/64/267140164.db2.gz YZVZHRGIJIVLBK-UHFFFAOYSA-N 0 3 296.418 2.738 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2(c3ncccc3C)CC2)c1 ZINC000368258082 267156763 /nfs/dbraw/zinc/15/67/63/267156763.db2.gz FDFBBSZVRPZDAL-UHFFFAOYSA-N 0 3 298.386 2.926 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C2 ZINC000368315599 267161608 /nfs/dbraw/zinc/16/16/08/267161608.db2.gz LAHQRJZXUXKYND-KBPBESRZSA-N 0 3 285.391 2.871 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCO[C@H]2C2CC2)c([O-])c1 ZINC000371219342 267374683 /nfs/dbraw/zinc/37/46/83/267374683.db2.gz KVRGKQCQGLVCLD-WBVHZDCISA-N 0 3 291.391 2.838 20 10 CFCDHN CN1Cc2ccccc2[C@H](NCc2ccc3c(c2)CCO3)C1 ZINC000371324679 267389662 /nfs/dbraw/zinc/38/96/62/267389662.db2.gz ZMKVIGBJDHHGSV-GOSISDBHSA-N 0 3 294.398 2.898 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@]23C[C@H]2COC3(C)C)c1[O-] ZINC000529645659 270713675 /nfs/dbraw/zinc/71/36/75/270713675.db2.gz SZHWQEGPNKKPFC-ZUZCIYMTSA-N 0 3 297.782 2.711 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000297037238 276024007 /nfs/dbraw/zinc/02/40/07/276024007.db2.gz UZWWYWVAUJHSNF-CJNGLKHVSA-N 0 3 275.392 2.766 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185425006 276212359 /nfs/dbraw/zinc/21/23/59/276212359.db2.gz BYPIHYGMBHZUGK-BONVTDFDSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccccc1[O-] ZINC000377121141 278273036 /nfs/dbraw/zinc/27/30/36/278273036.db2.gz SNDFINURUGAIII-SMDDNHRTSA-N 0 3 271.364 2.854 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000245887702 279335885 /nfs/dbraw/zinc/33/58/85/279335885.db2.gz MKSNWQUOPSUOSJ-YPMHNXCESA-N 0 3 266.360 2.666 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCO[C@H](C3CC3)C1)CC2 ZINC000296247052 280454419 /nfs/dbraw/zinc/45/44/19/280454419.db2.gz BBBWXBFDKGGHAZ-FMKPAKJESA-N 0 3 273.376 2.927 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCOCC1(C)C)c1ccccc1[O-] ZINC000186169117 280938155 /nfs/dbraw/zinc/93/81/55/280938155.db2.gz BRPWXDQJYXTGFR-HNNXBMFYSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1ccc(O)c(CN2CCS[C@H](C)[C@@H]2C)c1 ZINC000180311522 295166168 /nfs/dbraw/zinc/16/61/68/295166168.db2.gz JPJANEHGGDQLAO-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@H](C)[C@@H]2C)c1 ZINC000180311522 295166170 /nfs/dbraw/zinc/16/61/70/295166170.db2.gz JPJANEHGGDQLAO-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@H](C)[C@@H]2C)c1 ZINC000180311522 295166172 /nfs/dbraw/zinc/16/61/72/295166172.db2.gz JPJANEHGGDQLAO-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN Cc1cccc(CN[C@H]2CN(C)Cc3ccccc32)c1O ZINC000359895596 329643083 /nfs/dbraw/zinc/64/30/83/329643083.db2.gz HKZYNUXRYLJAMR-KRWDZBQOSA-N 0 3 282.387 2.977 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2C[C@]2(C)OC(C)C)c1 ZINC000527800622 330284154 /nfs/dbraw/zinc/28/41/54/330284154.db2.gz QAVXXWXDILJXJG-CVEARBPZSA-N 0 3 279.380 2.837 20 10 CFCDHN CCOc1ccc(O)c(CN[C@@H]2C[C@]2(C)OC(C)C)c1 ZINC000527800622 330284155 /nfs/dbraw/zinc/28/41/55/330284155.db2.gz QAVXXWXDILJXJG-CVEARBPZSA-N 0 3 279.380 2.837 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1 ZINC000527803919 330284309 /nfs/dbraw/zinc/28/43/09/330284309.db2.gz LOUOATAXJUPAKT-YWDSYVAPSA-N 0 3 279.380 2.692 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@@H]1CCCOC1)CC2 ZINC000527927043 330296713 /nfs/dbraw/zinc/29/67/13/330296713.db2.gz QRNDUDIBORPFEP-JSGCOSHPSA-N 0 3 261.365 2.786 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[C@H]2CCCOC2)c1 ZINC000527928163 330296892 /nfs/dbraw/zinc/29/68/92/330296892.db2.gz NHIGYLDLTHOKRE-CHWSQXEVSA-N 0 3 279.380 2.868 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000527934410 330297772 /nfs/dbraw/zinc/29/77/72/330297772.db2.gz WSLFMUSRWQDRHJ-VXGBXAGGSA-N 0 3 267.344 2.999 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000527934405 330297819 /nfs/dbraw/zinc/29/78/19/330297819.db2.gz WSLFMUSRWQDRHJ-NEPJUHHUSA-N 0 3 267.344 2.999 20 10 CFCDHN COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)cc2[O-])cn1 ZINC000527988361 330299052 /nfs/dbraw/zinc/29/90/52/330299052.db2.gz DJVOBYNHUSHXSQ-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000528008951 330303717 /nfs/dbraw/zinc/30/37/17/330303717.db2.gz ULHZMZNGUZFTPN-GACTXADBSA-N 0 3 261.365 2.781 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@@H](O)C(F)(F)F)cc1 ZINC000219452717 333150154 /nfs/dbraw/zinc/15/01/54/333150154.db2.gz YOWFZHOIZMCYJC-CYBMUJFWSA-N 0 3 290.329 2.546 20 10 CFCDHN Oc1ccc(F)cc1CNc1ccc2c(c1)OCCNC2 ZINC000530182587 333527484 /nfs/dbraw/zinc/52/74/84/333527484.db2.gz VUKXDEVEZAAJSA-UHFFFAOYSA-N 0 3 288.322 2.625 20 10 CFCDHN CCN1CCC([NH2+][C@@H](C)c2cc(F)ccc2[O-])CC1 ZINC000094617795 521581322 /nfs/dbraw/zinc/58/13/22/521581322.db2.gz QUHBWZLCPVMLBQ-NSHDSACASA-N 0 3 266.360 2.666 20 10 CFCDHN COC1(C)CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000272326360 522568433 /nfs/dbraw/zinc/56/84/33/522568433.db2.gz CLMIPENGAUYPJW-UHFFFAOYSA-N 0 3 253.317 2.532 20 10 CFCDHN CC(C)(C)OC(=O)NCCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000226606685 518830627 /nfs/dbraw/zinc/83/06/27/518830627.db2.gz MYBTWMRFUJZXNU-UHFFFAOYSA-N 0 3 298.358 2.536 20 10 CFCDHN CC(=O)N1CCC[C@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000280981289 519553340 /nfs/dbraw/zinc/55/33/40/519553340.db2.gz MBTBQXRQWJVTTJ-DZGCQCFKSA-N 0 3 290.407 2.610 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCC2(C)OCCCO2)cc1 ZINC000190663826 520286639 /nfs/dbraw/zinc/28/66/39/520286639.db2.gz JCNWVGLATREWBB-AWEZNQCLSA-N 0 3 292.423 2.946 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC(C)(C)COC)c([O-])c1 ZINC000291782679 520364797 /nfs/dbraw/zinc/36/47/97/520364797.db2.gz VAYZFFXWGNGHAB-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H](OC)C2CC2)c([O-])c1 ZINC000292929994 520365538 /nfs/dbraw/zinc/36/55/38/520365538.db2.gz GWULKPBYYOFTMA-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H](CC)OC)c([O-])c1 ZINC000289684286 520367322 /nfs/dbraw/zinc/36/73/22/520367322.db2.gz CPGDNNNHBIYGNK-CYBMUJFWSA-N 0 3 267.369 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@]2(O)CCCC2(C)C)c1 ZINC000292925104 521149923 /nfs/dbraw/zinc/14/99/23/521149923.db2.gz INXIDNKXLRYDLL-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280247432 521153268 /nfs/dbraw/zinc/15/32/68/521153268.db2.gz WJFBDGMFBKWNBI-ZFWWWQNUSA-N 0 3 290.407 2.752 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000230661833 521295802 /nfs/dbraw/zinc/29/58/02/521295802.db2.gz NLQPDWVQBAQYAC-WFASDCNBSA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000289688280 521320429 /nfs/dbraw/zinc/32/04/29/521320429.db2.gz BLLWUZDJGLQMCD-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000289688280 521320438 /nfs/dbraw/zinc/32/04/38/521320438.db2.gz BLLWUZDJGLQMCD-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@](C)(OC)C2)c1[O-] ZINC000230300081 521338005 /nfs/dbraw/zinc/33/80/05/521338005.db2.gz DTPCUPWBYKSUJP-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@](C)(OC)C2)c1[O-] ZINC000230300081 521338018 /nfs/dbraw/zinc/33/80/18/521338018.db2.gz DTPCUPWBYKSUJP-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCCCOC)c1[O-] ZINC000227442563 521362574 /nfs/dbraw/zinc/36/25/74/521362574.db2.gz FKIFXNSMQODPSJ-UHFFFAOYSA-N 0 3 267.369 2.697 20 10 CFCDHN CCC[N@H+](CCC(=O)OCC)Cc1ccccc1[O-] ZINC000076074006 521630334 /nfs/dbraw/zinc/63/03/34/521630334.db2.gz PVAJPDUXXQGIKR-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCC[N@@H+](CCC(=O)OCC)Cc1ccccc1[O-] ZINC000076074006 521630337 /nfs/dbraw/zinc/63/03/37/521630337.db2.gz PVAJPDUXXQGIKR-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000278453270 521652939 /nfs/dbraw/zinc/65/29/39/521652939.db2.gz LRZKDZHMTKKPSG-TUBUQKNSSA-N 0 3 293.407 2.590 20 10 CFCDHN COCC[C@@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228672882 521796937 /nfs/dbraw/zinc/79/69/37/521796937.db2.gz KDNOSHBSMCESHY-SECBINFHSA-N 0 3 273.760 2.569 20 10 CFCDHN CN(C)C[C@H]([NH2+]Cc1ccccc1[O-])c1ccc(F)cc1 ZINC000290032067 521859248 /nfs/dbraw/zinc/85/92/48/521859248.db2.gz FBDVLVYOYKMXJO-INIZCTEOSA-N 0 3 288.366 2.924 20 10 CFCDHN CN(C)c1ccc(CN2CCCN(CC(F)F)CC2)cc1 ZINC000193459918 522177979 /nfs/dbraw/zinc/17/79/79/522177979.db2.gz JNPBRWFUQJXRAR-UHFFFAOYSA-N 0 3 297.393 2.525 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H]2C2CC2)c1[O-] ZINC000230935410 522540224 /nfs/dbraw/zinc/54/02/24/522540224.db2.gz PNXLCKAFBHZUFW-DOMZBBRYSA-N 0 3 297.782 2.711 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC(C)(C)CCO)c1[O-] ZINC000230934934 522540838 /nfs/dbraw/zinc/54/08/38/522540838.db2.gz BVPAEYSZYCJBJX-UHFFFAOYSA-N 0 3 287.787 2.552 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](C)N(C)C2CC2)c1[O-] ZINC000230934464 522541501 /nfs/dbraw/zinc/54/15/01/522541501.db2.gz SKGSLICAPHOOBL-JTQLQIEISA-N 0 3 298.814 2.627 20 10 CFCDHN CC[C@H]([NH2+]CCn1ccnc1)c1ccc(C)cc1[O-] ZINC000279947531 522607308 /nfs/dbraw/zinc/60/73/08/522607308.db2.gz BNIFYUQHZPLGNN-AWEZNQCLSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CC[C@@H](O)C1)c1ccc(C)cc1[O-] ZINC000280208120 522621483 /nfs/dbraw/zinc/62/14/83/522621483.db2.gz TYWOGKVMLDAIFH-NFAWXSAZSA-N 0 3 263.381 2.902 20 10 CFCDHN CN(CCC[N@H+](C)Cc1ccccc1[O-])Cc1ccco1 ZINC000289652485 522742396 /nfs/dbraw/zinc/74/23/96/522742396.db2.gz CHKWORXRISTUII-UHFFFAOYSA-N 0 3 288.391 2.939 20 10 CFCDHN CN(CCC[N@@H+](C)Cc1ccccc1[O-])Cc1ccco1 ZINC000289652485 522742402 /nfs/dbraw/zinc/74/24/02/522742402.db2.gz CHKWORXRISTUII-UHFFFAOYSA-N 0 3 288.391 2.939 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C(C)C)C2CC2)cc1OC ZINC000159755707 522768227 /nfs/dbraw/zinc/76/82/27/522768227.db2.gz PQTQZZDMHIPJIO-UHFFFAOYSA-N 0 3 265.353 2.782 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C(C)C)C2CC2)cc1OC ZINC000159755707 522768232 /nfs/dbraw/zinc/76/82/32/522768232.db2.gz PQTQZZDMHIPJIO-UHFFFAOYSA-N 0 3 265.353 2.782 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)cc1OC ZINC000160526911 522777360 /nfs/dbraw/zinc/77/73/60/522777360.db2.gz SFFUZNLEKOOGCV-RYUDHWBXSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@H](C)[C@@H](C)C2)cc1OC ZINC000160526911 522777374 /nfs/dbraw/zinc/77/73/74/522777374.db2.gz SFFUZNLEKOOGCV-RYUDHWBXSA-N 0 3 279.380 2.887 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)OCCO)c1ccc(C)cc1[O-] ZINC000287479769 522819307 /nfs/dbraw/zinc/81/93/07/522819307.db2.gz XAMJKWXUILFNTK-CQSZACIVSA-N 0 3 281.396 2.529 20 10 CFCDHN CC[C@@H]([NH2+]CCCn1ccnc1)c1ccccc1[O-] ZINC000020506194 522834754 /nfs/dbraw/zinc/83/47/54/522834754.db2.gz XZYGQUYSJNMKLO-CQSZACIVSA-N 0 3 259.353 2.720 20 10 CFCDHN CC[C@@H]([NH2+]CCS(=O)(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000290264496 522839440 /nfs/dbraw/zinc/83/94/40/522839440.db2.gz KZCDGHUKJAAFJD-CQSZACIVSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000155872716 522839590 /nfs/dbraw/zinc/83/95/90/522839590.db2.gz IEYBTBZQRHPJAL-YJYMSZOUSA-N 0 3 283.437 2.980 20 10 CFCDHN CN(Cc1ccc(N(C)C)cc1)C[C@H]1CCC=CO1 ZINC000191056877 523263815 /nfs/dbraw/zinc/26/38/15/523263815.db2.gz SAZKGMLWUKUYHV-MRXNPFEDSA-N 0 3 260.381 2.877 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)Cc1ccc(F)cc1 ZINC000292874391 523384695 /nfs/dbraw/zinc/38/46/95/523384695.db2.gz STDSNZCLDZMNRC-INIZCTEOSA-N 0 3 289.350 2.567 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)Cc1ccc(F)cc1 ZINC000292874391 523384700 /nfs/dbraw/zinc/38/47/00/523384700.db2.gz STDSNZCLDZMNRC-INIZCTEOSA-N 0 3 289.350 2.567 20 10 CFCDHN CN1CCN(Cc2ccccc2O)[C@@H](c2ccccc2)C1 ZINC000227301640 523911176 /nfs/dbraw/zinc/91/11/76/523911176.db2.gz HAVPGYQKGAMZTL-QGZVFWFLSA-N 0 3 282.387 2.881 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000193497940 523966236 /nfs/dbraw/zinc/96/62/36/523966236.db2.gz KCPHYQLOAPLYKG-GXFFZTMASA-N 0 3 297.782 2.785 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000279681301 524390985 /nfs/dbraw/zinc/39/09/85/524390985.db2.gz AJHRTNNWROGGDO-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000279681301 524390994 /nfs/dbraw/zinc/39/09/94/524390994.db2.gz AJHRTNNWROGGDO-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000279681312 524392974 /nfs/dbraw/zinc/39/29/74/524392974.db2.gz AJHRTNNWROGGDO-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000279681312 524392980 /nfs/dbraw/zinc/39/29/80/524392980.db2.gz AJHRTNNWROGGDO-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(CN2CCN(C3CCCC3)CC2)c1O ZINC000158025665 524400384 /nfs/dbraw/zinc/40/03/84/524400384.db2.gz UJOIJLGXDATWNB-UHFFFAOYSA-N 0 3 274.408 2.761 20 10 CFCDHN COc1ccc(N2CCCN(Cc3cccn3C)CC2)cc1 ZINC000193767787 524406369 /nfs/dbraw/zinc/40/63/69/524406369.db2.gz YJRZIBWIVPVOPV-UHFFFAOYSA-N 0 3 299.418 2.746 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](c2ccco2)N(C)C)c1[O-] ZINC000158073599 524432352 /nfs/dbraw/zinc/43/23/52/524432352.db2.gz HKZIBNBEGKFJHF-CQSZACIVSA-N 0 3 274.364 2.686 20 10 CFCDHN Cc1cccc(C[NH2+]CCCCOC(C)C)c1[O-] ZINC000228837611 524432475 /nfs/dbraw/zinc/43/24/75/524432475.db2.gz XMZZVASGSGEACD-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN C[C@@H](CCc1ccco1)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879515 524546951 /nfs/dbraw/zinc/54/69/51/524546951.db2.gz DHVFRAUGECYONT-NSHDSACASA-N 0 3 289.331 2.825 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290414404 524741929 /nfs/dbraw/zinc/74/19/29/524741929.db2.gz KGPKHZCOYITCKY-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290414404 524741941 /nfs/dbraw/zinc/74/19/41/524741941.db2.gz KGPKHZCOYITCKY-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(SC)CC2)c1 ZINC000193834179 524759423 /nfs/dbraw/zinc/75/94/23/524759423.db2.gz UFIOCMPOWHNQMC-SNVBAGLBSA-N 0 3 267.394 2.947 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C2CC(F)(F)C2)c1 ZINC000277000567 524761473 /nfs/dbraw/zinc/76/14/73/524761473.db2.gz AFWBABWKHGWOKA-MRVPVSSYSA-N 0 3 257.280 2.849 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCOCC2CC2)c1 ZINC000020190771 524764794 /nfs/dbraw/zinc/76/47/94/524764794.db2.gz GPTYGRQQERPGDE-GFCCVEGCSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](OC)C(C)C)c1 ZINC000273619290 524772416 /nfs/dbraw/zinc/77/24/16/524772416.db2.gz YNDVPUSGILEUFY-NHYWBVRUSA-N 0 3 267.369 2.722 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c1[O-] ZINC000276053730 524865394 /nfs/dbraw/zinc/86/53/94/524865394.db2.gz UQHZLMUCZQIKDX-ZDUSSCGKSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c1[O-] ZINC000276053730 524865405 /nfs/dbraw/zinc/86/54/05/524865405.db2.gz UQHZLMUCZQIKDX-ZDUSSCGKSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2=CCCOC2)c1[O-] ZINC000290125786 524870127 /nfs/dbraw/zinc/87/01/27/524870127.db2.gz JFGKFMLQRVTENN-UHFFFAOYSA-N 0 3 267.756 2.790 20 10 CFCDHN COc1ncccc1CN[C@H](C)c1ccc(C)cc1O ZINC000037650332 525064081 /nfs/dbraw/zinc/06/40/81/525064081.db2.gz ZAWWDHRZMRONKS-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN C[C@H]([NH2+]C1CCN(C2CC2)CC1)c1ccccc1[O-] ZINC000037141038 525296033 /nfs/dbraw/zinc/29/60/33/525296033.db2.gz RWJRWEPHKHVENT-LBPRGKRZSA-N 0 3 260.381 2.670 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)cc1C ZINC000172490321 525313409 /nfs/dbraw/zinc/31/34/09/525313409.db2.gz JNVZOHGFBNSPMU-CQSZACIVSA-N 0 3 291.391 2.594 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@@H](C3OCCO3)C2)cc1C ZINC000172490321 525313416 /nfs/dbraw/zinc/31/34/16/525313416.db2.gz JNVZOHGFBNSPMU-CQSZACIVSA-N 0 3 291.391 2.594 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(CCCO)CC2)c1 ZINC000272948853 525340288 /nfs/dbraw/zinc/34/02/88/525340288.db2.gz NNHYUJUAQHHIFK-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@H](C)O[C@H](C3CC3)C2)c1 ZINC000279773632 525346270 /nfs/dbraw/zinc/34/62/70/525346270.db2.gz ALORZYAJJPFSEF-WBMJQRKESA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](CC(C)C)CN(C)C)c1 ZINC000071407973 525352088 /nfs/dbraw/zinc/35/20/88/525352088.db2.gz QVTOTXVQRPWIRB-HNNXBMFYSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)CN(C)C(C)C)c1 ZINC000289950733 525352826 /nfs/dbraw/zinc/35/28/26/525352826.db2.gz XNQWQMLCJQVEKH-CYBMUJFWSA-N 0 3 250.386 2.519 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c1 ZINC000273043594 525354947 /nfs/dbraw/zinc/35/49/47/525354947.db2.gz BBTLLRFITZDTOK-JKSUJKDBSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CC=CCC2)c1 ZINC000280869354 525359683 /nfs/dbraw/zinc/35/96/83/525359683.db2.gz CSDDEOFNMSCVQO-CQSZACIVSA-N 0 3 260.381 2.613 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649179 525391390 /nfs/dbraw/zinc/39/13/90/525391390.db2.gz HLZGDGBDCXBCRA-STQMWFEESA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1[C@H]2COC[C@H]21)c1cc2c(cc1[O-])CCCC2 ZINC000367692561 525400972 /nfs/dbraw/zinc/40/09/72/525400972.db2.gz ZJVBWJPDGPRHRV-GNCDUGFZSA-N 0 3 287.403 2.814 20 10 CFCDHN C[C@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)c1ccccc1 ZINC000042879013 525433273 /nfs/dbraw/zinc/43/32/73/525433273.db2.gz AHCNDZYRWLLHJJ-NSHDSACASA-N 0 3 271.316 2.972 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCC1)c1cc(F)ccc1[O-] ZINC000094616882 525435183 /nfs/dbraw/zinc/43/51/83/525435183.db2.gz JBKFAMFGUBDRIT-GFCCVEGCSA-N 0 3 266.360 2.668 20 10 CFCDHN C[C@@H](NCCOCC1CC1)c1ccc(N(C)C)cc1 ZINC000223380694 525453458 /nfs/dbraw/zinc/45/34/58/525453458.db2.gz BJCQVEGDECTFLX-CYBMUJFWSA-N 0 3 262.397 2.830 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618033 525495999 /nfs/dbraw/zinc/49/59/99/525495999.db2.gz TUWXHDJJCYAICT-NSHDSACASA-N 0 3 277.343 2.846 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000094617612 525504500 /nfs/dbraw/zinc/50/45/00/525504500.db2.gz ABRPQGHDDUTMEP-VXGBXAGGSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])c1cnn(C)c1 ZINC000273370957 525528560 /nfs/dbraw/zinc/52/85/60/525528560.db2.gz CJQZOMYEBDBKQT-UWVGGRQHSA-N 0 3 263.316 2.677 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094618167 525595759 /nfs/dbraw/zinc/59/57/59/525595759.db2.gz CGEPSMVBKAWDKT-XHDPSFHLSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094618168 525667765 /nfs/dbraw/zinc/66/77/65/525667765.db2.gz CGEPSMVBKAWDKT-IAQYHMDHSA-N 0 3 275.323 2.916 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000289926608 525934380 /nfs/dbraw/zinc/93/43/80/525934380.db2.gz XSIRWFYHVBBRJF-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c1[O-] ZINC000289926608 525934387 /nfs/dbraw/zinc/93/43/87/525934387.db2.gz XSIRWFYHVBBRJF-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CCN(C)C)c([O-])c1 ZINC000049553638 525941716 /nfs/dbraw/zinc/94/17/16/525941716.db2.gz DIVKWVHBQWDJEY-OLZOCXBDSA-N 0 3 250.386 2.691 20 10 CFCDHN COc1cccc(C[N@@H+]2CCSCC[C@@H]2C)c1[O-] ZINC000191817898 525951547 /nfs/dbraw/zinc/95/15/47/525951547.db2.gz FPESYNKFZGVUEE-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCSCC[C@@H]2C)c1[O-] ZINC000191817898 525951561 /nfs/dbraw/zinc/95/15/61/525951561.db2.gz FPESYNKFZGVUEE-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c1[O-] ZINC000292731515 526033302 /nfs/dbraw/zinc/03/33/02/526033302.db2.gz GIDADUVCKYVXBU-MRXNPFEDSA-N 0 3 293.407 2.678 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c1[O-] ZINC000290613043 526035367 /nfs/dbraw/zinc/03/53/67/526035367.db2.gz WQMKXVZZXVMEMR-HYVNUMGLSA-N 0 3 281.355 2.829 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]3CCC[C@@H]31)OCO2 ZINC000156039688 526334527 /nfs/dbraw/zinc/33/45/27/526334527.db2.gz SZXMVIJEOGZEPP-YPMHNXCESA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]3CCC[C@@H]31)OCO2 ZINC000156039688 526334529 /nfs/dbraw/zinc/33/45/29/526334529.db2.gz SZXMVIJEOGZEPP-YPMHNXCESA-N 0 3 275.348 2.885 20 10 CFCDHN Oc1cc2c(cc1CNC1(c3ccccc3)CC1)OCO2 ZINC000264549434 526336964 /nfs/dbraw/zinc/33/69/64/526336964.db2.gz BFNKIRDWZWSAQX-UHFFFAOYSA-N 0 3 283.327 2.900 20 10 CFCDHN Oc1ccccc1CN(Cc1cccnc1)C1CC1 ZINC000290418118 526371812 /nfs/dbraw/zinc/37/18/12/526371812.db2.gz KNTQISWHYNFSQC-UHFFFAOYSA-N 0 3 254.333 2.952 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000287768520 526374224 /nfs/dbraw/zinc/37/42/24/526374224.db2.gz RJOGJBBMGPWDAF-CMPLNLGQSA-N 0 3 275.270 2.592 20 10 CFCDHN O[C@@H](CNCc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC000077326199 527653445 /nfs/dbraw/zinc/65/34/45/527653445.db2.gz ULNUXMJYNHGYJD-INIZCTEOSA-N 0 3 287.334 2.584 20 10 CFCDHN COc1ccc2ccc(O)c(CN3C[C@H]4CC[C@@H](C3)O4)c2c1 ZINC000744436289 574074475 /nfs/dbraw/zinc/07/44/75/574074475.db2.gz PCZSFPMAMWZFDX-GASCZTMLSA-N 0 3 299.370 2.917 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccco2)c([O-])c1C ZINC000756383306 574099232 /nfs/dbraw/zinc/09/92/32/574099232.db2.gz XKQMNOCLZLEBEZ-TZMCWYRMSA-N 0 3 275.348 2.986 20 10 CFCDHN CCOCc1cc(CNCCSC)ccc1OC ZINC000731448344 574120800 /nfs/dbraw/zinc/12/08/00/574120800.db2.gz MIIPDXKTQOVMLK-UHFFFAOYSA-N 0 3 269.410 2.684 20 10 CFCDHN Oc1cc2c(cc1CN1CCN(C3CCC3)CC1)CCC2 ZINC000733296638 574219051 /nfs/dbraw/zinc/21/90/51/574219051.db2.gz BAEQPTQFBBZLQT-UHFFFAOYSA-N 0 3 286.419 2.551 20 10 CFCDHN COc1ccc(CNCc2cnn3ccccc23)cc1C ZINC000729679472 574228021 /nfs/dbraw/zinc/22/80/21/574228021.db2.gz HNWNMKBADCZQNE-UHFFFAOYSA-N 0 3 281.359 2.941 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccco2)c([O-])c1C ZINC000756383302 574231688 /nfs/dbraw/zinc/23/16/88/574231688.db2.gz XKQMNOCLZLEBEZ-GXTWGEPZSA-N 0 3 275.348 2.986 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c1 ZINC000756431308 574236632 /nfs/dbraw/zinc/23/66/32/574236632.db2.gz BWZAHRLOAKEAPU-IUODEOHRSA-N 0 3 262.397 2.691 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c([O-])c1C ZINC000756433005 574236644 /nfs/dbraw/zinc/23/66/44/574236644.db2.gz MGDMNHPEGZSISU-BBRMVZONSA-N 0 3 276.424 3.000 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@@H]2CCCO2)c([O-])c1C ZINC000756582231 574250728 /nfs/dbraw/zinc/25/07/28/574250728.db2.gz HMGUIAFKKHGFML-CABCVRRESA-N 0 3 293.407 2.855 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756684502 574257660 /nfs/dbraw/zinc/25/76/60/574257660.db2.gz KJDCBOASZUKWIY-CMPLNLGQSA-N 0 3 275.327 2.566 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(CCO)CCC2)c1 ZINC000756763882 574260884 /nfs/dbraw/zinc/26/08/84/574260884.db2.gz AYGQVVHKEODOBY-LBPRGKRZSA-N 0 3 279.380 2.604 20 10 CFCDHN Cc1ccc(O)c([C@H](C)NCc2cc(C)ncn2)c1 ZINC000756775903 574261631 /nfs/dbraw/zinc/26/16/31/574261631.db2.gz MREODVQBVNPQIJ-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](O)CC2)c([O-])c1C ZINC000756771189 574261930 /nfs/dbraw/zinc/26/19/30/574261930.db2.gz SBOWJRSEQPVVBB-IHRRRGAJSA-N 0 3 263.381 2.963 20 10 CFCDHN COC[C@@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756778825 574262145 /nfs/dbraw/zinc/26/21/45/574262145.db2.gz FYMPKTKJFPFAGR-FXPVBKGRSA-N 0 3 253.317 2.704 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@H](CO)CC(F)(F)F)c(O)c1C ZINC000756777152 574262318 /nfs/dbraw/zinc/26/23/18/574262318.db2.gz VZXIMQXQKXMWIW-MNOVXSKESA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)CC(F)(F)F)c([O-])c1C ZINC000756777152 574262319 /nfs/dbraw/zinc/26/23/19/574262319.db2.gz VZXIMQXQKXMWIW-MNOVXSKESA-N 0 3 291.313 2.973 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2cnccn2)c2c1c(F)ccc2[O-] ZINC000756785977 574262838 /nfs/dbraw/zinc/26/28/38/574262838.db2.gz HKEQNTDVIOWRQO-GWCFXTLKSA-N 0 3 287.338 2.702 20 10 CFCDHN COc1ccc(O)c([C@H](C)NC[C@H](OC)C(F)(F)F)c1 ZINC000756835999 574266590 /nfs/dbraw/zinc/26/65/90/574266590.db2.gz RMWSBZFLYYJNFJ-UFBFGSQYSA-N 0 3 293.285 2.629 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+]Cc1cc(C)ccc1[O-] ZINC000743499677 574307343 /nfs/dbraw/zinc/30/73/43/574307343.db2.gz OHWIPFHDPWJLOU-TZMCWYRMSA-N 0 3 251.370 2.587 20 10 CFCDHN CCC1(O)CC[NH+](Cc2cc3c(cc2[O-])CCC3)CC1 ZINC000742175623 574317065 /nfs/dbraw/zinc/31/70/65/574317065.db2.gz JGGKIKHPAKVWNC-UHFFFAOYSA-N 0 3 275.392 2.618 20 10 CFCDHN CCOc1ccc(C[NH2+]CCOC(C)(C)C)c([O-])c1 ZINC000725850013 574330957 /nfs/dbraw/zinc/33/09/57/574330957.db2.gz CPYOQBCFZJUHKZ-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN COc1ccc(CN2CCS[C@H](C)[C@@H]2C)c(O)c1OC ZINC000892066209 617934353 /nfs/dbraw/zinc/93/43/53/617934353.db2.gz BSQRTEKCLPUGQR-WDEREUQCSA-N 0 3 297.420 2.735 20 10 CFCDHN CCC[N@H+](CC)Cc1ccc(OC)c(OC)c1[O-] ZINC000891399327 618186786 /nfs/dbraw/zinc/18/67/86/618186786.db2.gz LJXVWOCIMJVWBX-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCC[N@@H+](CC)Cc1ccc(OC)c(OC)c1[O-] ZINC000891399327 618186788 /nfs/dbraw/zinc/18/67/88/618186788.db2.gz LJXVWOCIMJVWBX-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCc2cncn2C)cc1 ZINC000289971269 618232205 /nfs/dbraw/zinc/23/22/05/618232205.db2.gz XKIMJRWKXPTBGH-CYBMUJFWSA-N 0 3 272.396 2.727 20 10 CFCDHN COc1ccc(C[N@H+](C)C(C)(C)C)c([O-])c1OC ZINC000895115726 618318177 /nfs/dbraw/zinc/31/81/77/618318177.db2.gz JSFOHJHVXCKLHN-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN COc1ccc(C[N@@H+](C)C(C)(C)C)c([O-])c1OC ZINC000895115726 618318180 /nfs/dbraw/zinc/31/81/80/618318180.db2.gz JSFOHJHVXCKLHN-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN CN(C)c1ccc(CNCc2cnn(C)c2C2CC2)cc1 ZINC000892475996 618337008 /nfs/dbraw/zinc/33/70/08/618337008.db2.gz OLYGXLBOCFXANU-UHFFFAOYSA-N 0 3 284.407 2.653 20 10 CFCDHN C[C@H]([NH2+]CC1CCC2(CC1)OCCO2)c1ccccc1[O-] ZINC000190321512 618366309 /nfs/dbraw/zinc/36/63/09/618366309.db2.gz SGTUSEBGHTVSMM-ZDUSSCGKSA-N 0 3 291.391 2.976 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@H](C)N(C)C[C@H]2C)c1O ZINC000775985513 618401622 /nfs/dbraw/zinc/40/16/22/618401622.db2.gz LZBWYEVTCWVRMP-WDEREUQCSA-N 0 3 298.814 2.579 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877605866 618443040 /nfs/dbraw/zinc/44/30/40/618443040.db2.gz KLPVHYILDKYWNS-WCQYABFASA-N 0 3 251.370 2.587 20 10 CFCDHN COc1ccc(CNCc2cccnc2C)cc1C ZINC000237249703 618454459 /nfs/dbraw/zinc/45/44/59/618454459.db2.gz LSPIYKRBTMPYBW-UHFFFAOYSA-N 0 3 256.349 2.997 20 10 CFCDHN C[C@@H](CC[NH2+]Cc1cc(Cl)c(F)cc1[O-])N(C)C ZINC000895294679 618514122 /nfs/dbraw/zinc/51/41/22/618514122.db2.gz ZXHZFFCPIKZVMH-VIFPVBQESA-N 0 3 274.767 2.615 20 10 CFCDHN Cc1nccn1CC[NH2+]Cc1c([O-])cc(C)cc1Cl ZINC000840886970 618688007 /nfs/dbraw/zinc/68/80/07/618688007.db2.gz PLCGJIOOVWBDOH-UHFFFAOYSA-N 0 3 279.771 2.649 20 10 CFCDHN C[C@@]1(Br)C[C@@H]1C[NH2+]Cc1ccccc1[O-] ZINC000892790587 618746473 /nfs/dbraw/zinc/74/64/73/618746473.db2.gz GAJYIAMXAXJLHZ-ZYHUDNBSSA-N 0 3 270.170 2.655 20 10 CFCDHN CCN(CC)c1ccc(CNCc2c[nH]cn2)cc1 ZINC000112341560 618779896 /nfs/dbraw/zinc/77/98/96/618779896.db2.gz AVRWJKONVUCCJB-UHFFFAOYSA-N 0 3 258.369 2.546 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnc[nH]2)cc1 ZINC000112341560 618779898 /nfs/dbraw/zinc/77/98/98/618779898.db2.gz AVRWJKONVUCCJB-UHFFFAOYSA-N 0 3 258.369 2.546 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CCC[C@@H](CO)C1)CC2 ZINC000312013519 618854508 /nfs/dbraw/zinc/85/45/08/618854508.db2.gz JJRXBEMAWFNASZ-XBFCOCLRSA-N 0 3 261.365 2.520 20 10 CFCDHN CC(C)[C@@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185434748 619070394 /nfs/dbraw/zinc/07/03/94/619070394.db2.gz HQBVTSFQHDDIEH-YGRLFVJLSA-N 0 3 255.333 2.589 20 10 CFCDHN CCCCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000005097659 619085580 /nfs/dbraw/zinc/08/55/80/619085580.db2.gz QSESATKMYMHENC-INIZCTEOSA-N 0 3 291.439 2.662 20 10 CFCDHN C[C@H]([NH2+]CC[C@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094617793 619132945 /nfs/dbraw/zinc/13/29/45/619132945.db2.gz BFQLZGXQAHJPHL-CMPLNLGQSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)[C@H]2C)c1[O-] ZINC000840980154 619209395 /nfs/dbraw/zinc/20/93/95/619209395.db2.gz WLKMYLOXGLBAGH-VXGBXAGGSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)[C@H]2C)c1[O-] ZINC000840980154 619209398 /nfs/dbraw/zinc/20/93/98/619209398.db2.gz WLKMYLOXGLBAGH-VXGBXAGGSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1ncccc1CNCc1ccc(N(C)C)c(F)c1 ZINC000237092742 619261191 /nfs/dbraw/zinc/26/11/91/619261191.db2.gz QXARFKJKQMABDV-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](CF)C1 ZINC000895545170 619552546 /nfs/dbraw/zinc/55/25/46/619552546.db2.gz CYIIJYJRSRIDRR-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](CF)C1 ZINC000895545170 619552549 /nfs/dbraw/zinc/55/25/49/619552549.db2.gz CYIIJYJRSRIDRR-LLVKDONJSA-N 0 3 253.317 2.582 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895845777 619621168 /nfs/dbraw/zinc/62/11/68/619621168.db2.gz IZXNGQJOKZODDL-NHYWBVRUSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895845777 619621169 /nfs/dbraw/zinc/62/11/69/619621169.db2.gz IZXNGQJOKZODDL-NHYWBVRUSA-N 0 3 265.328 2.532 20 10 CFCDHN COCCOc1ccc(CN[C@H](C)c2ccccc2O)o1 ZINC000895852233 619622914 /nfs/dbraw/zinc/62/29/14/619622914.db2.gz SAYBXYIUAXWZQT-GFCCVEGCSA-N 0 3 291.347 2.861 20 10 CFCDHN Cn1ccc([C@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n1 ZINC000896491823 619745037 /nfs/dbraw/zinc/74/50/37/619745037.db2.gz BMZHHCSIAYBIPK-ZDUSSCGKSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1ccc([C@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n1 ZINC000896491823 619745039 /nfs/dbraw/zinc/74/50/39/619745039.db2.gz BMZHHCSIAYBIPK-ZDUSSCGKSA-N 0 3 271.364 2.505 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897035256 619917202 /nfs/dbraw/zinc/91/72/02/619917202.db2.gz DURIUUGARBNQJW-UHFFFAOYSA-N 0 3 279.355 2.658 20 10 CFCDHN CCO[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000897069515 619925346 /nfs/dbraw/zinc/92/53/46/619925346.db2.gz WTBHRRBJQPRZBF-ZDUSSCGKSA-N 0 3 266.360 2.503 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1cc(F)ccc1[O-])c1cnn(C)c1 ZINC000897080835 619926026 /nfs/dbraw/zinc/92/60/26/619926026.db2.gz DGZSGSVCBXTXGC-HNNXBMFYSA-N 0 3 277.343 2.752 20 10 CFCDHN CS[C@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000226612661 620094268 /nfs/dbraw/zinc/09/42/68/620094268.db2.gz JIRMMMCNLQXZCQ-NEPJUHHUSA-N 0 3 255.358 2.905 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC000897505635 620195621 /nfs/dbraw/zinc/19/56/21/620195621.db2.gz MWBCJJLOEGLBSP-CZUORRHYSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(CN[C@H]2c3ccccc3OC[C@H]2CO)c(O)c1 ZINC000897948660 620309301 /nfs/dbraw/zinc/30/93/01/620309301.db2.gz PFVBHKNDQTWSBP-RDTXWAMCSA-N 0 3 299.370 2.532 20 10 CFCDHN Oc1ccc(F)cc1CN1CC(Cc2ccoc2)C1 ZINC000898160334 620340696 /nfs/dbraw/zinc/34/06/96/620340696.db2.gz AHNRKZJYNOBJNO-UHFFFAOYSA-N 0 3 261.296 2.799 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1COC[C@@H]1C1CC1)c1ccccc1[O-] ZINC000898380755 620379163 /nfs/dbraw/zinc/37/91/63/620379163.db2.gz UUQFMIRHGWAUDK-QLFBSQMISA-N 0 3 261.365 2.858 20 10 CFCDHN CC[C@](C)(C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000322752787 620390734 /nfs/dbraw/zinc/39/07/34/620390734.db2.gz CLHIXLSVXHARRS-CQSZACIVSA-N 0 3 287.787 2.959 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CCN1 ZINC000841062325 620424637 /nfs/dbraw/zinc/42/46/37/620424637.db2.gz VJJYREBVHWKIAG-KWQFWETISA-N 0 3 289.206 2.929 20 10 CFCDHN C[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[O-])CC[NH2+]1 ZINC000841062325 620424638 /nfs/dbraw/zinc/42/46/38/620424638.db2.gz VJJYREBVHWKIAG-KWQFWETISA-N 0 3 289.206 2.929 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+]Cc2c(C)cccc2[O-])C1 ZINC000898484247 620468924 /nfs/dbraw/zinc/46/89/24/620468924.db2.gz RPDVAVRUOAZSCL-OLZOCXBDSA-N 0 3 277.364 2.522 20 10 CFCDHN N[C@@H]1c2ccccc2C[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000902432400 621078477 /nfs/dbraw/zinc/07/84/77/621078477.db2.gz HLVLIZRFTHTDFI-HDMKZQKVSA-N 0 3 280.371 2.594 20 10 CFCDHN CCc1cc(CN2CC[C@@H]2CO)c(O)c(C(C)(C)C)c1 ZINC000902629997 621138703 /nfs/dbraw/zinc/13/87/03/621138703.db2.gz LXSXUJDSFROVNQ-CQSZACIVSA-N 0 3 277.408 2.819 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@H]1CCCC[C@H]1O)CC2 ZINC000903263123 621304182 /nfs/dbraw/zinc/30/41/82/621304182.db2.gz JJBHKGRGZMPQTF-VHDGCEQUSA-N 0 3 275.392 2.910 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCOC1 ZINC000903358378 621347725 /nfs/dbraw/zinc/34/77/25/621347725.db2.gz VJHCMZNKLSUZKQ-RHSMWYFYSA-N 0 3 291.391 2.553 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@]2(OC(C)C)CCOC2)c([O-])c1 ZINC000903358718 621348150 /nfs/dbraw/zinc/34/81/50/621348150.db2.gz YGFXQOAAVVSBSL-PBHICJAKSA-N 0 3 293.407 2.935 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2COC[C@H]2C)c2c1c(F)ccc2[O-] ZINC000903397773 621350630 /nfs/dbraw/zinc/35/06/30/621350630.db2.gz ZISCDPAQVKFXBA-PKZYVASSSA-N 0 3 265.328 2.704 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(CCO)cc1)c1ccccc1[O-] ZINC000903395173 621353772 /nfs/dbraw/zinc/35/37/72/621353772.db2.gz BHYJKYNWDRSBRQ-CYBMUJFWSA-N 0 3 271.360 2.778 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000903390501 621360461 /nfs/dbraw/zinc/36/04/61/621360461.db2.gz ARRSWYXKGIGVKN-QXEWZRGKSA-N 0 3 267.344 2.829 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2COC[C@@H]2C2CC2)c([O-])c1 ZINC000903436549 621374400 /nfs/dbraw/zinc/37/44/00/621374400.db2.gz JVESIZGRAGKEQF-NILFDRSVSA-N 0 3 261.365 2.776 20 10 CFCDHN CC(C)(C)[C@@H](Cn1ccnc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000226585824 623083922 /nfs/dbraw/zinc/08/39/22/623083922.db2.gz ZHZUSKYNQXWFRA-OAHLLOKOSA-N 0 3 291.370 2.932 20 10 CFCDHN CS[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000226612657 623084037 /nfs/dbraw/zinc/08/40/37/623084037.db2.gz JIRMMMCNLQXZCQ-VXGBXAGGSA-N 0 3 255.358 2.905 20 10 CFCDHN C[C@]1(C[NH2+]Cc2cc(F)ccc2[O-])CCCS1 ZINC000226615132 623085082 /nfs/dbraw/zinc/08/50/82/623085082.db2.gz KSJNADSRNFQOMI-CYBMUJFWSA-N 0 3 255.358 2.907 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](C)SC)c1[O-] ZINC000169092485 623112442 /nfs/dbraw/zinc/11/24/42/623112442.db2.gz GMVOMZPOXSRXKI-MRVPVSSYSA-N 0 3 275.801 2.895 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H]2CCOC2)c1[O-] ZINC000169090338 623113421 /nfs/dbraw/zinc/11/34/21/623113421.db2.gz CJRSURDUOQKFJZ-UWVGGRQHSA-N 0 3 285.771 2.569 20 10 CFCDHN CC[C@](C)(C(=O)OC)N(Cc1ccccc1O)CC1CC1 ZINC000822503359 623117349 /nfs/dbraw/zinc/11/73/49/623117349.db2.gz GUITYXDWMGQXLB-QGZVFWFLSA-N 0 3 291.391 2.946 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)C(C)(C)C2)c1O ZINC000229120830 623184213 /nfs/dbraw/zinc/18/42/13/623184213.db2.gz CKRAMJAEJKORHZ-UHFFFAOYSA-N 0 3 298.814 2.580 20 10 CFCDHN C[C@H]1CC[C@@H](C[NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000230402264 623275258 /nfs/dbraw/zinc/27/52/58/623275258.db2.gz NXLGGULLOGFHFM-WDEREUQCSA-N 0 3 263.337 2.647 20 10 CFCDHN C[C@H]1CCC[C@H]1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000230650199 623288528 /nfs/dbraw/zinc/28/85/28/623288528.db2.gz SBDWMNWQXHOPPF-QWRGUYRKSA-N 0 3 263.337 2.647 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000230672566 623290581 /nfs/dbraw/zinc/29/05/81/623290581.db2.gz CCJXEFSPNBDFJL-WDEREUQCSA-N 0 3 253.317 2.609 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@](C)(O)C(C)C)c1[O-] ZINC000184708379 625638105 /nfs/dbraw/zinc/63/81/05/625638105.db2.gz SBFHKDXZHGIKQQ-AWEZNQCLSA-N 0 3 287.787 2.551 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(OC)CCC2)c1[O-] ZINC000184744193 625642698 /nfs/dbraw/zinc/64/26/98/625642698.db2.gz IQJKPGUVCBMZLP-UHFFFAOYSA-N 0 3 285.771 2.713 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000311897204 623484256 /nfs/dbraw/zinc/48/42/56/623484256.db2.gz PTIXTDLMPJHAFL-RYUDHWBXSA-N 0 3 268.376 2.911 20 10 CFCDHN CCCN(Cc1cnc2n1CCC2)Cc1ccccc1O ZINC000824650784 623538515 /nfs/dbraw/zinc/53/85/15/623538515.db2.gz WTCRZASQDMWJRE-UHFFFAOYSA-N 0 3 285.391 2.947 20 10 CFCDHN COc1cccc(O)c1CN(C)[C@@H](CO)c1ccccc1 ZINC000824696294 623546806 /nfs/dbraw/zinc/54/68/06/623546806.db2.gz KKEARIXTXGXOTE-HNNXBMFYSA-N 0 3 287.359 2.566 20 10 CFCDHN Cc1cc([O-])c(CN2CC[N@@H+]3CCC[C@@H]3C2)cc1Cl ZINC000824761023 623559578 /nfs/dbraw/zinc/55/95/78/623559578.db2.gz CEGYWISFGKSCOR-CYBMUJFWSA-N 0 3 280.799 2.634 20 10 CFCDHN Cc1cc([O-])c(CN2CC[N@H+]3CCC[C@@H]3C2)cc1Cl ZINC000824761023 623559584 /nfs/dbraw/zinc/55/95/84/623559584.db2.gz CEGYWISFGKSCOR-CYBMUJFWSA-N 0 3 280.799 2.634 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCO[C@H](C(C)C)C1 ZINC000824799322 623567421 /nfs/dbraw/zinc/56/74/21/623567421.db2.gz MOGJRLOPMSKBGU-DYVFJYSZSA-N 0 3 293.407 2.942 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCC1(F)F ZINC000824799414 623567669 /nfs/dbraw/zinc/56/76/69/623567669.db2.gz NHVRBEZDKUIDLT-JTQLQIEISA-N 0 3 271.307 2.926 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H](CO)CC(C)(C)C ZINC000825040480 623613656 /nfs/dbraw/zinc/61/36/56/623613656.db2.gz LFLZVCOUQACCAW-CYBMUJFWSA-N 0 3 269.360 2.760 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H](CO)CC(C)(C)C ZINC000825040480 623613664 /nfs/dbraw/zinc/61/36/64/623613664.db2.gz LFLZVCOUQACCAW-CYBMUJFWSA-N 0 3 269.360 2.760 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)Cc2cnn(C)c2)c1[O-] ZINC000825045631 623616171 /nfs/dbraw/zinc/61/61/71/623616171.db2.gz IHCLVOIXOXJUFP-LLVKDONJSA-N 0 3 293.798 2.808 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1ccccc1[O-] ZINC000825067711 623622456 /nfs/dbraw/zinc/62/24/56/623622456.db2.gz DSVIBOAPIOQPGF-NWANDNLSSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC1(C[NH2+]Cc2cc(Cl)cc(C)c2[O-])COC1 ZINC000825072796 623623410 /nfs/dbraw/zinc/62/34/10/623623410.db2.gz LRBWODQJNKBQAO-UHFFFAOYSA-N 0 3 269.772 2.870 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)CCN(C)C)cc1Cl ZINC000825173846 623643932 /nfs/dbraw/zinc/64/39/32/623643932.db2.gz UWQJGAKYLRZNBF-LLVKDONJSA-N 0 3 270.804 2.784 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000184940844 625665210 /nfs/dbraw/zinc/66/52/10/625665210.db2.gz VYTDCRSHJRRNCH-LBPRGKRZSA-N 0 3 287.407 2.944 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000825320537 623669691 /nfs/dbraw/zinc/66/96/91/623669691.db2.gz KZZIVYROYNWMMA-AAEUAGOBSA-N 0 3 282.815 2.926 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](CCCO)C2)c1[O-] ZINC000825338828 623677138 /nfs/dbraw/zinc/67/71/38/623677138.db2.gz UYZWSVNEGGZZGQ-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](CCCO)C2)c1[O-] ZINC000825338828 623677142 /nfs/dbraw/zinc/67/71/42/623677142.db2.gz UYZWSVNEGGZZGQ-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN CCc1cccc(CN2CCO[C@@](C)(C3CC3)C2)c1O ZINC000826877898 623900921 /nfs/dbraw/zinc/90/09/21/623900921.db2.gz NHLWCCXRKHTYPR-QGZVFWFLSA-N 0 3 275.392 2.956 20 10 CFCDHN COCC1(C2CCC2)C[NH+](Cc2ccccc2[O-])C1 ZINC000827011751 623924793 /nfs/dbraw/zinc/92/47/93/623924793.db2.gz NQADZIIULKCGGL-UHFFFAOYSA-N 0 3 261.365 2.641 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC3(COC3)C2)cc1F ZINC000827643002 624050348 /nfs/dbraw/zinc/05/03/48/624050348.db2.gz DHXUBDBRPUHNCU-UHFFFAOYSA-N 0 3 292.398 2.894 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827699660 624069360 /nfs/dbraw/zinc/06/93/60/624069360.db2.gz KVXVAYSSJYEWNO-IAQYHMDHSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827699660 624069363 /nfs/dbraw/zinc/06/93/63/624069363.db2.gz KVXVAYSSJYEWNO-IAQYHMDHSA-N 0 3 283.799 2.804 20 10 CFCDHN CCCC[N@H+](CC[C@H](C)O)Cc1ccccc1[O-] ZINC000829516004 624450603 /nfs/dbraw/zinc/45/06/03/624450603.db2.gz MCCXVIUBTLQTHW-ZDUSSCGKSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@@H+](CC[C@H](C)O)Cc1ccccc1[O-] ZINC000829516004 624450606 /nfs/dbraw/zinc/45/06/06/624450606.db2.gz MCCXVIUBTLQTHW-ZDUSSCGKSA-N 0 3 251.370 2.765 20 10 CFCDHN COc1ccc(O)c(CN(C)Cc2ccc(C#N)cc2)c1 ZINC000179683020 624973769 /nfs/dbraw/zinc/97/37/69/624973769.db2.gz JVPCYZUGEJHIBJ-UHFFFAOYSA-N 0 3 282.343 2.904 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)C(C)C)c([O-])c1 ZINC000185434413 625725474 /nfs/dbraw/zinc/72/54/74/625725474.db2.gz TZPFRQIYVDUGLH-SWLSCSKDSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)C(C)C)c([O-])c1 ZINC000185434373 625726180 /nfs/dbraw/zinc/72/61/80/625726180.db2.gz TZPFRQIYVDUGLH-WFASDCNBSA-N 0 3 251.370 2.758 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCOCC1CCC1)CC2 ZINC000834766592 625840281 /nfs/dbraw/zinc/84/02/81/625840281.db2.gz UWSHEPORKCIQLK-CQSZACIVSA-N 0 3 261.365 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(CF)CCOCC1)CC2 ZINC000834882697 625908224 /nfs/dbraw/zinc/90/82/24/625908224.db2.gz CVIUZWWUQPWHHL-ZDUSSCGKSA-N 0 3 279.355 2.735 20 10 CFCDHN CCN1C[C@@H]([NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])CC1=O ZINC000834888826 625910247 /nfs/dbraw/zinc/91/02/47/625910247.db2.gz QHOZOOYIJGLPJI-PWSUYJOCSA-N 0 3 296.798 2.625 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)C1CCC1)c1ccc(C)cc1[O-] ZINC000834906970 625919329 /nfs/dbraw/zinc/91/93/29/625919329.db2.gz VGJINXQFYTWBSR-ZBFHGGJFSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834914561 625921404 /nfs/dbraw/zinc/92/14/04/625921404.db2.gz OBUFMYOSWUTKKO-JTLRNRKASA-N 0 3 265.328 2.583 20 10 CFCDHN Cc1cc(C(F)(F)F)nn1CC[NH2+]Cc1ccccc1[O-] ZINC000922431738 626288345 /nfs/dbraw/zinc/28/83/45/626288345.db2.gz ZXTZFHGZFFICEE-UHFFFAOYSA-N 0 3 299.296 2.706 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000922692932 626343421 /nfs/dbraw/zinc/34/34/21/626343421.db2.gz CHYUNKGYRMUEBH-AAEUAGOBSA-N 0 3 289.297 2.982 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCS[C@@H](C)C1 ZINC000922840843 626377743 /nfs/dbraw/zinc/37/77/43/626377743.db2.gz BNGRVIIJAXXFDU-WDEREUQCSA-N 0 3 267.394 2.775 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CC3(C2)CCOCC3)c1[O-] ZINC000839140600 626528529 /nfs/dbraw/zinc/52/85/29/626528529.db2.gz HKSSCZXUTSMVMW-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC3(C2)CCOCC3)c1O ZINC000839140600 626528530 /nfs/dbraw/zinc/52/85/30/626528530.db2.gz HKSSCZXUTSMVMW-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CC3(C2)CCOCC3)cc1 ZINC000839141075 626528607 /nfs/dbraw/zinc/52/86/07/626528607.db2.gz LQRLKBHTZFCIIK-ONEGZZNKSA-N 0 3 286.419 2.878 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2ccccc2NC1=O)c1ccccc1[O-] ZINC000839539224 626546489 /nfs/dbraw/zinc/54/64/89/626546489.db2.gz RQBNEJSTFWEHLR-LRDDRELGSA-N 0 3 296.370 2.996 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000757867811 626566251 /nfs/dbraw/zinc/56/62/51/626566251.db2.gz WFSSVNKTDRIAKK-UKRRQHHQSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000757867811 626566254 /nfs/dbraw/zinc/56/62/54/626566254.db2.gz WFSSVNKTDRIAKK-UKRRQHHQSA-N 0 3 293.407 2.630 20 10 CFCDHN CCN(CC)c1ccc(CNC2COC(C)(C)OC2)cc1 ZINC000758011042 626572639 /nfs/dbraw/zinc/57/26/39/626572639.db2.gz XHBVNXWKENQZGF-UHFFFAOYSA-N 0 3 292.423 2.774 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000761500614 626840984 /nfs/dbraw/zinc/84/09/84/626840984.db2.gz XPFLLMOPJGSIJY-HOCLYGCPSA-N 0 3 274.408 2.917 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000762142166 626896937 /nfs/dbraw/zinc/89/69/37/626896937.db2.gz KAKVXKDRGRSOFX-NHYWBVRUSA-N 0 3 289.375 2.583 20 10 CFCDHN C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000762142166 626896940 /nfs/dbraw/zinc/89/69/40/626896940.db2.gz KAKVXKDRGRSOFX-NHYWBVRUSA-N 0 3 289.375 2.583 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000762785666 626937126 /nfs/dbraw/zinc/93/71/26/626937126.db2.gz GDTKEMCCGZJZKT-GWCFXTLKSA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@@H]1N(Cc2cc3c(cc2O)CCC3)CCOC1(C)C ZINC000763214474 626970914 /nfs/dbraw/zinc/97/09/14/626970914.db2.gz YNMBUFNVRVGDQF-LBPRGKRZSA-N 0 3 275.392 2.880 20 10 CFCDHN COc1cccc(O)c1CN1CCN(c2ccccc2)CC1 ZINC000768140312 627320319 /nfs/dbraw/zinc/32/03/19/627320319.db2.gz YZXANKJYTSTNEX-UHFFFAOYSA-N 0 3 298.386 2.723 20 10 CFCDHN CCN(CC)c1ccc(CN2CCN(C3CC3)CC2)cc1 ZINC000768242653 627327674 /nfs/dbraw/zinc/32/76/74/627327674.db2.gz ABGFRDMGKITRIT-UHFFFAOYSA-N 0 3 287.451 2.813 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]1C1CCC1)[C@@H](O)CO2 ZINC000768448338 627344108 /nfs/dbraw/zinc/34/41/08/627344108.db2.gz BUAPTXTVJNDTSW-ZBFHGGJFSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCC1)[C@@H](O)CO2 ZINC000768448338 627344109 /nfs/dbraw/zinc/34/41/09/627344109.db2.gz BUAPTXTVJNDTSW-ZBFHGGJFSA-N 0 3 289.375 2.583 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(OCC)CC2)c([O-])c1 ZINC000768528799 627351264 /nfs/dbraw/zinc/35/12/64/627351264.db2.gz YVIRGZGAKRBPLT-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOCC[N@H+](CC)Cc1ccc(OCC)cc1[O-] ZINC000769138881 627406567 /nfs/dbraw/zinc/40/65/67/627406567.db2.gz BQTRMTYUJFVRQT-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1ccc(OCC)cc1[O-] ZINC000769138881 627406568 /nfs/dbraw/zinc/40/65/68/627406568.db2.gz BQTRMTYUJFVRQT-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000769451512 627440952 /nfs/dbraw/zinc/44/09/52/627440952.db2.gz MRKSRUGVXUZJNW-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000769451512 627440953 /nfs/dbraw/zinc/44/09/53/627440953.db2.gz MRKSRUGVXUZJNW-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CN(C)c1ccc(CN(C)CCOCC2CC2)cc1F ZINC000769523098 627451761 /nfs/dbraw/zinc/45/17/61/627451761.db2.gz AOTIGUBNVVOPQL-UHFFFAOYSA-N 0 3 280.387 2.750 20 10 CFCDHN Cc1cc(O)c(CN[C@@H](CO)c2ccsc2)cc1C ZINC000769936850 627489425 /nfs/dbraw/zinc/48/94/25/627489425.db2.gz YXZIIYPNEHTNNI-AWEZNQCLSA-N 0 3 277.389 2.894 20 10 CFCDHN C/C=C\C[C@H](CO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000769996219 627495377 /nfs/dbraw/zinc/49/53/77/627495377.db2.gz UGFJAYRBERVNFO-NDJUPMBRSA-N 0 3 279.355 2.996 20 10 CFCDHN CCOc1ccc(C[NH2+]CC(C)(C)CCCO)c([O-])c1 ZINC000771893904 627644788 /nfs/dbraw/zinc/64/47/88/627644788.db2.gz SCGODAOYJGXTMA-UHFFFAOYSA-N 0 3 281.396 2.679 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1ccnn1C ZINC000774362270 627919236 /nfs/dbraw/zinc/91/92/36/627919236.db2.gz JIDMFAYUBXJKJK-QWHCGFSZSA-N 0 3 272.396 2.898 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CC[C@@H](C)C1)c1ccccc1[O-] ZINC000775416708 628024009 /nfs/dbraw/zinc/02/40/09/628024009.db2.gz XPEFNCHDJHWSKN-UKRRQHHQSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1ccccc1[O-] ZINC000775511702 628032833 /nfs/dbraw/zinc/03/28/33/628032833.db2.gz IGYKISBJCVPDFM-GDBMZVCRSA-N 0 3 294.464 2.870 20 10 CFCDHN CCN1C[C@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000775713975 628058903 /nfs/dbraw/zinc/05/89/03/628058903.db2.gz XZUWOIZMWKVMOE-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN1C[C@H](C)[N@@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000775713975 628058906 /nfs/dbraw/zinc/05/89/06/628058906.db2.gz XZUWOIZMWKVMOE-NEPJUHHUSA-N 0 3 282.815 2.960 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCN(C)C2)c1[O-] ZINC000776042796 628097238 /nfs/dbraw/zinc/09/72/38/628097238.db2.gz VCMDAJUWMHTEKE-CYBMUJFWSA-N 0 3 268.788 2.538 20 10 CFCDHN Cn1cnc2cc(C[NH2+]Cc3ccccc3[O-])ccc21 ZINC000776151852 628107620 /nfs/dbraw/zinc/10/76/20/628107620.db2.gz WRZFSKIIJFWXTG-UHFFFAOYSA-N 0 3 267.332 2.569 20 10 CFCDHN CC[C@H]([NH2+]Cc1cccc(C)c1[O-])C1CCOCC1 ZINC000776230995 628120234 /nfs/dbraw/zinc/12/02/34/628120234.db2.gz DWAPXDLIWMYSLL-HNNXBMFYSA-N 0 3 263.381 2.995 20 10 CFCDHN C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000779000472 628344224 /nfs/dbraw/zinc/34/42/24/628344224.db2.gz XNSAXDSXGHNTDG-CQSZACIVSA-N 0 3 271.360 2.775 20 10 CFCDHN C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000779000472 628344226 /nfs/dbraw/zinc/34/42/26/628344226.db2.gz XNSAXDSXGHNTDG-CQSZACIVSA-N 0 3 271.360 2.775 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000779115134 628353303 /nfs/dbraw/zinc/35/33/03/628353303.db2.gz HVWSMELYTXZOKE-OAHLLOKOSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000779115134 628353307 /nfs/dbraw/zinc/35/33/07/628353307.db2.gz HVWSMELYTXZOKE-OAHLLOKOSA-N 0 3 279.355 2.922 20 10 CFCDHN CC(C)[C@H]1CN(C)CCN1Cc1ccc(N(C)C)c(F)c1 ZINC000780902674 628503667 /nfs/dbraw/zinc/50/36/67/628503667.db2.gz OKFVUWNOXKUCFC-QGZVFWFLSA-N 0 3 293.430 2.664 20 10 CFCDHN COc1cccc(CN2CCC[C@H](OC(F)F)C2)c1O ZINC000781533073 628557704 /nfs/dbraw/zinc/55/77/04/628557704.db2.gz YADGVCDYNJNPAD-NSHDSACASA-N 0 3 287.306 2.604 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1ccccc1[O-])C(C)C ZINC000783505200 628714108 /nfs/dbraw/zinc/71/41/08/628714108.db2.gz GAJFIFPHZXZCJX-CYBMUJFWSA-N 0 3 250.386 2.773 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)c1ccccc1[O-] ZINC000783508233 628714643 /nfs/dbraw/zinc/71/46/43/628714643.db2.gz HQIJGSCVBXMZLN-QWRGUYRKSA-N 0 3 288.313 2.679 20 10 CFCDHN C[C@H]([NH2+]CCc1cnc(C2CC2)nc1)c1ccccc1[O-] ZINC000783520231 628716298 /nfs/dbraw/zinc/71/62/98/628716298.db2.gz ZMWVVYANXTYXLN-LBPRGKRZSA-N 0 3 283.375 2.953 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000783596103 628725326 /nfs/dbraw/zinc/72/53/26/628725326.db2.gz BBJRAZMZHZEKDP-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000783596103 628725327 /nfs/dbraw/zinc/72/53/27/628725327.db2.gz BBJRAZMZHZEKDP-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN Cc1nc(F)ccc1CNCc1ccc2c(c1)CCO2 ZINC000785449587 628884091 /nfs/dbraw/zinc/88/40/91/628884091.db2.gz XHUKWYCCGGYIFH-UHFFFAOYSA-N 0 3 272.323 2.754 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2[C@H](C)O)c([O-])c1 ZINC000785989099 628928581 /nfs/dbraw/zinc/92/85/81/628928581.db2.gz QVTQLYYPYNJKIU-XEZPLFJOSA-N 0 3 293.407 2.772 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2[C@H](C)O)c([O-])c1 ZINC000785989099 628928582 /nfs/dbraw/zinc/92/85/82/628928582.db2.gz QVTQLYYPYNJKIU-XEZPLFJOSA-N 0 3 293.407 2.772 20 10 CFCDHN CCn1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])c1=O ZINC000788604838 629086053 /nfs/dbraw/zinc/08/60/53/629086053.db2.gz MDVVUJAYMNBLTR-NSHDSACASA-N 0 3 290.338 2.564 20 10 CFCDHN Cc1cc(CN[C@H](C)c2cn[nH]c2)ccc1N(C)C ZINC000788645247 629089086 /nfs/dbraw/zinc/08/90/86/629089086.db2.gz NXORYZDNVASCHP-GFCCVEGCSA-N 0 3 258.369 2.635 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CC[C@H](O)C2)c([O-])c1 ZINC000788775642 629099137 /nfs/dbraw/zinc/09/91/37/629099137.db2.gz IWZJVOOPSJBLCJ-MJBXVCDLSA-N 0 3 263.381 2.821 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@H](O)C(C)(C)C2)cc1F ZINC000790937150 629272942 /nfs/dbraw/zinc/27/29/42/629272942.db2.gz KJPSUOJOQKTQCV-INIZCTEOSA-N 0 3 294.414 2.875 20 10 CFCDHN C[C@@H]1COCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835024801 629321484 /nfs/dbraw/zinc/32/14/84/629321484.db2.gz BTPQSTMCJHBLIS-RGDDUWESSA-N 0 3 274.408 2.734 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CC([C@H]3CCOC3)C2)cc1 ZINC000835054396 629356170 /nfs/dbraw/zinc/35/61/70/629356170.db2.gz ORTOEZLKAHBWQA-QGZUEGPWSA-N 0 3 286.419 2.734 20 10 CFCDHN COc1ccc(N2CCCN(CC3(F)CC3)CC2)cc1 ZINC000792791780 629451857 /nfs/dbraw/zinc/45/18/57/629451857.db2.gz KXZIKTLVGPGKHA-UHFFFAOYSA-N 0 3 278.371 2.709 20 10 CFCDHN CC(C)C1CN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000793193147 629502765 /nfs/dbraw/zinc/50/27/65/629502765.db2.gz ROORJWPZKKJLTO-UHFFFAOYSA-N 0 3 250.361 2.980 20 10 CFCDHN COc1cccc(O)c1CN1CCC(F)(F)CC1 ZINC000793361776 629530786 /nfs/dbraw/zinc/53/07/86/629530786.db2.gz LBDJMJLWQAHVPR-UHFFFAOYSA-N 0 3 257.280 2.632 20 10 CFCDHN COc1cc(CN2CCC(F)(F)CC2)c(O)cc1C ZINC000794688836 629675317 /nfs/dbraw/zinc/67/53/17/629675317.db2.gz UFTPDDNANITBGS-UHFFFAOYSA-N 0 3 271.307 2.940 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)COCC(C)C)c1ccc(C)cc1[O-] ZINC000794801927 629687979 /nfs/dbraw/zinc/68/79/79/629687979.db2.gz LIKUFNDSBOYSIF-ZBFHGGJFSA-N 0 3 295.423 2.775 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000794812229 629689294 /nfs/dbraw/zinc/68/92/94/629689294.db2.gz VJZYWYLQHJUBSJ-TZMCWYRMSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@]1(OC)CCOC1)c1ccc(C)cc1[O-] ZINC000794813911 629689498 /nfs/dbraw/zinc/68/94/98/629689498.db2.gz KGIKGRSQTQPCJP-ZBFHGGJFSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCn2ccnc2C1)c1ccc(C)cc1[O-] ZINC000794812379 629689646 /nfs/dbraw/zinc/68/96/46/629689646.db2.gz CDUHLXBKNFFTBV-DZGCQCFKSA-N 0 3 285.391 2.953 20 10 CFCDHN CC[C@@H]([NH2+]C1CCC(C(N)=O)CC1)c1ccc(C)cc1[O-] ZINC000794812363 629689812 /nfs/dbraw/zinc/68/98/12/629689812.db2.gz WDAZCXVNMPVXLH-SSDMNJCBSA-N 0 3 290.407 2.785 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)CC1CC1)c1ccc(C)cc1[O-] ZINC000794818640 629690237 /nfs/dbraw/zinc/69/02/37/629690237.db2.gz UKKUPOQCEPOOES-HIFRSBDPSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCN2CC=CCC2)c2c1c(F)ccc2[O-] ZINC000794834427 629692554 /nfs/dbraw/zinc/69/25/54/629692554.db2.gz NJOMGQKOAYCRIB-TZMCWYRMSA-N 0 3 290.382 2.931 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(COC)CCC2)c([O-])c1 ZINC000800279075 630366194 /nfs/dbraw/zinc/36/61/94/630366194.db2.gz CZZBZHUBCBGKNZ-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCCCN(CC(=O)N(C)C1CC1)Cc1ccccc1O ZINC000801595651 630461232 /nfs/dbraw/zinc/46/12/32/630461232.db2.gz HJQDKAWFUMNZTI-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)c2cccnc2)c([O-])c1 ZINC000806178908 630780740 /nfs/dbraw/zinc/78/07/40/630780740.db2.gz LGOHWWAOTBARKU-UKRRQHHQSA-N 0 3 286.375 2.522 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC(=O)NC(C)C)c1[O-] ZINC000808675306 631026052 /nfs/dbraw/zinc/02/60/52/631026052.db2.gz CFESSHNTJZEGKR-LLVKDONJSA-N 0 3 298.814 2.919 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCCCNC2=O)c1[O-] ZINC000808675416 631026717 /nfs/dbraw/zinc/02/67/17/631026717.db2.gz GEPPQBBFZDPNLT-ZWNOBZJWSA-N 0 3 296.798 2.673 20 10 CFCDHN CCCNC(=O)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672678 631026951 /nfs/dbraw/zinc/02/69/51/631026951.db2.gz RERNZLHOQDUSEK-JTQLQIEISA-N 0 3 284.787 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)Cn2cncn2)c1[O-] ZINC000808683428 631028440 /nfs/dbraw/zinc/02/84/40/631028440.db2.gz FUDUXCSTHCDUEL-MNOVXSKESA-N 0 3 294.786 2.685 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2ccn(C)n2)c1[O-] ZINC000808714138 631033119 /nfs/dbraw/zinc/03/31/19/631033119.db2.gz NNDQJWQXBRZFLG-LLVKDONJSA-N 0 3 293.798 2.981 20 10 CFCDHN CO[C@@]1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000808712708 631033276 /nfs/dbraw/zinc/03/32/76/631033276.db2.gz AMGHSHOIFPOSLX-XHDPSFHLSA-N 0 3 299.798 2.810 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000809747038 631278680 /nfs/dbraw/zinc/27/86/80/631278680.db2.gz GZOUEFOMWQYVKQ-OAHLLOKOSA-N 0 3 287.359 2.614 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CS[C@H](C)C2)c([O-])c1 ZINC000840957471 631284167 /nfs/dbraw/zinc/28/41/67/631284167.db2.gz BURGQQBPKKSLOQ-PWSUYJOCSA-N 0 3 267.394 2.775 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@H](C)O[C@@H]2C)c([O-])c1 ZINC000840962648 631285932 /nfs/dbraw/zinc/28/59/32/631285932.db2.gz DXKVGNSZOZLMMG-SCRDCRAPSA-N 0 3 279.380 2.694 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)C2(OC)CCC2)c([O-])c1 ZINC000840969506 631289289 /nfs/dbraw/zinc/28/92/89/631289289.db2.gz GNIBMULLNLMXEI-GFCCVEGCSA-N 0 3 279.380 2.838 20 10 CFCDHN CCC([NH3+])(CC)CNCc1c([O-])ccc(Cl)c1F ZINC000841028928 631310956 /nfs/dbraw/zinc/31/09/56/631310956.db2.gz ILPUNJCNIYVSJE-UHFFFAOYSA-N 0 3 274.767 2.792 20 10 CFCDHN CC[C@@H]([NH3+])CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000841069657 631329670 /nfs/dbraw/zinc/32/96/70/631329670.db2.gz CIBWKNYRHVUPKG-SECBINFHSA-N 0 3 263.168 2.526 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2(N(C)C)CC2)c2c1c(F)ccc2[O-] ZINC000841764323 631469249 /nfs/dbraw/zinc/46/92/49/631469249.db2.gz WDHXZZRVVICIJU-ZYHUDNBSSA-N 0 3 278.371 2.763 20 10 CFCDHN COc1cccc(CN[C@H]2COCc3ccccc32)c1O ZINC000841892217 631489503 /nfs/dbraw/zinc/48/95/03/631489503.db2.gz ZFFKMBPUWXELKY-HNNXBMFYSA-N 0 3 285.343 2.762 20 10 CFCDHN CC[C@H](C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1)OC ZINC000842154147 631554405 /nfs/dbraw/zinc/55/44/05/631554405.db2.gz TYMGJGAGMRYARY-HZPDHXFCSA-N 0 3 293.407 2.798 20 10 CFCDHN CC[C@H](C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1)OC ZINC000842154147 631554408 /nfs/dbraw/zinc/55/44/08/631554408.db2.gz TYMGJGAGMRYARY-HZPDHXFCSA-N 0 3 293.407 2.798 20 10 CFCDHN CCCN(CC(=O)N[C@H](C)C(C)C)Cc1ccccc1O ZINC000104682367 631571391 /nfs/dbraw/zinc/57/13/91/631571391.db2.gz ITNSEGVUXORKJG-CQSZACIVSA-N 0 3 292.423 2.765 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC2(COC)CC2)c([O-])c1 ZINC000842728853 631719851 /nfs/dbraw/zinc/71/98/51/631719851.db2.gz JCGBFLZKFBIBMU-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCCC[C@@](C)(CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000842745757 631726409 /nfs/dbraw/zinc/72/64/09/631726409.db2.gz FYVSCVXLHLAVPM-INIZCTEOSA-N 0 3 281.396 2.822 20 10 CFCDHN CCC[C@@H]1C[NH2+]CCN1Cc1cc(Cl)ccc1[O-] ZINC000843057739 631820838 /nfs/dbraw/zinc/82/08/38/631820838.db2.gz HRPNCKIOKGHEMT-CYBMUJFWSA-N 0 3 268.788 2.620 20 10 CFCDHN CC[C@H]([NH2+]CCCOC[C@@H]1CCOC1)c1ccccc1[O-] ZINC000155966537 650038351 /nfs/dbraw/zinc/03/83/51/650038351.db2.gz AKTPSIXFZSQHST-HOCLYGCPSA-N 0 3 293.407 2.876 20 10 CFCDHN COc1ccc(O)c(CN2C[C@H](C)OC3(CCCC3)C2)c1 ZINC000843435616 631959759 /nfs/dbraw/zinc/95/97/59/631959759.db2.gz WMPYVNBZIINQGO-ZDUSSCGKSA-N 0 3 291.391 2.934 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cc(Cl)ccc1[O-] ZINC000813877318 631971525 /nfs/dbraw/zinc/97/15/25/631971525.db2.gz RPVITWCJTXQAFZ-WDEREUQCSA-N 0 3 270.804 2.894 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1ccccc1[O-])C1(CO)CCC1 ZINC000814169198 632021846 /nfs/dbraw/zinc/02/18/46/632021846.db2.gz FDZVYBYSVJTHOQ-HNNXBMFYSA-N 0 3 263.381 2.669 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000814169484 632022016 /nfs/dbraw/zinc/02/20/16/632022016.db2.gz IMJMTWKRSPMPNT-UONOGXRCSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000814169484 632022024 /nfs/dbraw/zinc/02/20/24/632022024.db2.gz IMJMTWKRSPMPNT-UONOGXRCSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2ccncc2)cc1 ZINC000844401831 632196327 /nfs/dbraw/zinc/19/63/27/632196327.db2.gz RZJIZBOZXZBPCO-UHFFFAOYSA-N 0 3 285.391 2.658 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@]2(O)CCCC2(C)C)c([O-])c1 ZINC000815147618 632217347 /nfs/dbraw/zinc/21/73/47/632217347.db2.gz SUBDQIFFVYBYJT-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN COCC1(CC[NH2+]Cc2c([O-])cccc2OC)CCC1 ZINC000815148461 632217855 /nfs/dbraw/zinc/21/78/55/632217855.db2.gz WPCUIUDTGOWKQD-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC[C@H](O)CC2)c([O-])c1 ZINC000815598347 632295386 /nfs/dbraw/zinc/29/53/86/632295386.db2.gz SDHYAPIVXWFAHO-IHRRRGAJSA-N 0 3 263.381 2.963 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2(CCO)CC2)c([O-])c1 ZINC000815618797 632298327 /nfs/dbraw/zinc/29/83/27/632298327.db2.gz UPPFJNVXVISCPO-ZDUSSCGKSA-N 0 3 263.381 2.822 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CNc2ccccc2C1 ZINC000844904669 632331739 /nfs/dbraw/zinc/33/17/39/632331739.db2.gz BMNIAHJLNXLWRT-CQSZACIVSA-N 0 3 254.333 2.519 20 10 CFCDHN CN1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816549393 632481747 /nfs/dbraw/zinc/48/17/47/632481747.db2.gz MPOZVGNJTKUYCJ-CQSZACIVSA-N 0 3 284.403 2.977 20 10 CFCDHN COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccc(OC)cc1[O-] ZINC000845965862 632606038 /nfs/dbraw/zinc/60/60/38/632606038.db2.gz BWVVGFZYRRAYIA-CYBMUJFWSA-N 0 3 281.396 2.942 20 10 CFCDHN CN(C)c1ccc(CN2CCC(C3(O)CC3)CC2)cc1F ZINC000846008450 632611937 /nfs/dbraw/zinc/61/19/37/632611937.db2.gz NXWPELGBJGXALN-UHFFFAOYSA-N 0 3 292.398 2.629 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C2CC2)C2CCOCC2)c1 ZINC000846043007 632622352 /nfs/dbraw/zinc/62/23/52/632622352.db2.gz RKVXGWPNHIBYRL-KRWDZBQOSA-N 0 3 275.392 2.995 20 10 CFCDHN CCCN1C[C@@H](C[NH2+][C@@H](CC)c2ccccc2[O-])CC1=O ZINC000817411723 632623722 /nfs/dbraw/zinc/62/37/22/632623722.db2.gz UOQXNGUMIYCFGR-HIFRSBDPSA-N 0 3 290.407 2.691 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)[C@@H]2CCCOC2)c([O-])c1 ZINC000846051417 632624433 /nfs/dbraw/zinc/62/44/33/632624433.db2.gz DZIMLJALCVBTLT-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)[C@@H]2CCCOC2)c([O-])c1 ZINC000846051417 632624439 /nfs/dbraw/zinc/62/44/39/632624439.db2.gz DZIMLJALCVBTLT-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc([C@@H](C)N[C@H]2CCCc3c[nH]nc32)c1O ZINC000846154731 632649256 /nfs/dbraw/zinc/64/92/56/632649256.db2.gz RQMUOCATXOIXAS-MFKMUULPSA-N 0 3 287.363 2.852 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000846182809 632655300 /nfs/dbraw/zinc/65/53/00/632655300.db2.gz DMUXBGKPXDGLEY-IACUBPJLSA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@H](COCC1CC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000846205002 632660166 /nfs/dbraw/zinc/66/01/66/632660166.db2.gz LYJNWLHVPVTMKI-BXUZGUMPSA-N 0 3 261.365 2.784 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CC(=O)N(CC)C1)c1ccc(C)cc1[O-] ZINC000846209707 632661056 /nfs/dbraw/zinc/66/10/56/632661056.db2.gz SLBXDASWNKGMDQ-UKRRQHHQSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@@H]([NH2+]CCCC1(O)CCC1)c1cc(F)ccc1[O-] ZINC000817585204 632671618 /nfs/dbraw/zinc/67/16/18/632671618.db2.gz CMCQLFGHNQPFGU-LLVKDONJSA-N 0 3 267.344 2.877 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])CCOCC1 ZINC000817589203 632672493 /nfs/dbraw/zinc/67/24/93/632672493.db2.gz VYSQRFFJMQKHCD-NWDGAFQWSA-N 0 3 297.370 2.766 20 10 CFCDHN CC[C@@H](N[C@@H]1CCC[NH2+]C1)c1cccc(Cl)c1[O-] ZINC000817940742 632743847 /nfs/dbraw/zinc/74/38/47/632743847.db2.gz KHOCFLAEJFIEOT-ZWNOBZJWSA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@H](NC[C@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817951332 632751913 /nfs/dbraw/zinc/75/19/13/632751913.db2.gz DXXMLFNAURYOHL-GXTWGEPZSA-N 0 3 270.376 2.948 20 10 CFCDHN CC[NH2+]CCN[C@@H](CC)c1cccc(Cl)c1[O-] ZINC000817951217 632752080 /nfs/dbraw/zinc/75/20/80/632752080.db2.gz BRIKYXTYGGUVLF-LBPRGKRZSA-N 0 3 256.777 2.696 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CN)CC(C)C)c1ccc(F)cc1[O-] ZINC000817957912 632756260 /nfs/dbraw/zinc/75/62/60/632756260.db2.gz GEAZUAJOXCJLMI-GXTWGEPZSA-N 0 3 268.376 2.945 20 10 CFCDHN Cc1nc([C@H](C)NCCc2ccc(N)cc2)cs1 ZINC000817958182 632756929 /nfs/dbraw/zinc/75/69/29/632756929.db2.gz SSFHKQCCQNYSQM-JTQLQIEISA-N 0 3 261.394 2.927 20 10 CFCDHN C[C@@H]([NH3+])CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817972084 632771944 /nfs/dbraw/zinc/77/19/44/632771944.db2.gz JOIHRAJBKMLCIW-RQJHMYQMSA-N 0 3 263.168 2.697 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1NCCc3ccccc31)CC2 ZINC000817975487 632773526 /nfs/dbraw/zinc/77/35/26/632773526.db2.gz VODOVTVJYIMDTB-DLBZAZTESA-N 0 3 294.398 2.856 20 10 CFCDHN CC[C@@H](N)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817979886 632776760 /nfs/dbraw/zinc/77/67/60/632776760.db2.gz PXROJGOKGBFWOE-RKDXNWHRSA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1ccc(F)cc1[O-] ZINC000817984887 632781361 /nfs/dbraw/zinc/78/13/61/632781361.db2.gz BNRCHWWYXCUVGT-AAEUAGOBSA-N 0 3 278.371 2.857 20 10 CFCDHN [NH3+][C@@H]1CCCC[C@H]1NCc1c([O-])ccc(Cl)c1F ZINC000818431717 632843600 /nfs/dbraw/zinc/84/36/00/632843600.db2.gz RLXCIFVFFSPGPG-GHMZBOCLSA-N 0 3 272.751 2.544 20 10 CFCDHN N[C@@H]1CCCC[C@H]1[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000818431717 632843606 /nfs/dbraw/zinc/84/36/06/632843606.db2.gz RLXCIFVFFSPGPG-GHMZBOCLSA-N 0 3 272.751 2.544 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cnc(Cl)n1C ZINC000848537652 633282041 /nfs/dbraw/zinc/28/20/41/633282041.db2.gz KSEAPMHXBVPINK-UHFFFAOYSA-N 0 3 292.814 2.738 20 10 CFCDHN C[C@H]([NH2+]C[C@H](C)N1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[O-] ZINC000848559458 633289108 /nfs/dbraw/zinc/28/91/08/633289108.db2.gz XAKXFLKDUUPIHG-XQLPTFJDSA-N 0 3 292.423 2.541 20 10 CFCDHN CCc1cccc(CN[C@@H](CO)c2ccc(F)cc2)c1O ZINC000848896744 633380851 /nfs/dbraw/zinc/38/08/51/633380851.db2.gz IIVWLIAQHWKEIJ-INIZCTEOSA-N 0 3 289.350 2.917 20 10 CFCDHN CCc1cccc(CN[C@@H](CO)c2cccc(F)c2)c1O ZINC000848896513 633381025 /nfs/dbraw/zinc/38/10/25/633381025.db2.gz BSXWPCXRKHAHCX-INIZCTEOSA-N 0 3 289.350 2.917 20 10 CFCDHN CC(C)OC(=O)C[C@H]([NH2+]Cc1ccccc1[O-])C(C)C ZINC000848926956 633409996 /nfs/dbraw/zinc/40/99/96/633409996.db2.gz LQJMVUQWWKEOFP-AWEZNQCLSA-N 0 3 279.380 2.848 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000848926530 633410219 /nfs/dbraw/zinc/41/02/19/633410219.db2.gz RQPMNPJXJRJFQX-SNVBAGLBSA-N 0 3 283.343 2.599 20 10 CFCDHN COc1ccc(CNC(=[NH2+])NC2CCCCCC2)c([O-])c1 ZINC000849024922 633466205 /nfs/dbraw/zinc/46/62/05/633466205.db2.gz GIOKNNHIVIYDSX-UHFFFAOYSA-N 0 3 291.395 2.738 20 10 CFCDHN Cc1cc([O-])c(CN(C)CC(C)(C)[NH3+])c(Cl)c1 ZINC000849350816 633625741 /nfs/dbraw/zinc/62/57/41/633625741.db2.gz XIGNODCEMLQKNB-UHFFFAOYSA-N 0 3 256.777 2.523 20 10 CFCDHN Oc1ccccc1CNc1ccc([C@H]2CNCCO2)cc1 ZINC000849351865 633626920 /nfs/dbraw/zinc/62/69/20/633626920.db2.gz DGYIXAKBHGKBDT-QGZVFWFLSA-N 0 3 284.359 2.665 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000850408880 633980721 /nfs/dbraw/zinc/98/07/21/633980721.db2.gz HPFLGVJFCMBVJU-JEBQAFNWSA-N 0 3 299.345 2.968 20 10 CFCDHN C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccccc1[O-] ZINC000850411894 633983617 /nfs/dbraw/zinc/98/36/17/633983617.db2.gz NNIHIJZREAOHGI-CXAGYDPISA-N 0 3 271.360 2.646 20 10 CFCDHN C[C@H](O)[C@@H](NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000850420435 633985590 /nfs/dbraw/zinc/98/55/90/633985590.db2.gz OUCCKFUXOWCWEH-SCLBCKFNSA-N 0 3 283.371 2.833 20 10 CFCDHN CCC[C@H](CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858171606 636147786 /nfs/dbraw/zinc/14/77/86/636147786.db2.gz ZLYKMEKXPBQVBA-GFCCVEGCSA-N 0 3 286.366 2.936 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2CC23CC3)cc1F ZINC000858182636 636149611 /nfs/dbraw/zinc/14/96/11/636149611.db2.gz AULDNSOPCZAIDT-CYBMUJFWSA-N 0 3 252.308 2.673 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@H](COC)OC)c1ccc(C)cc1[O-] ZINC000850487327 634014735 /nfs/dbraw/zinc/01/47/35/634014735.db2.gz ZCRIKYQOGSDJQH-UKRRQHHQSA-N 0 3 281.396 2.793 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2COC(C)(C)C2)cc1F ZINC000858186650 636150971 /nfs/dbraw/zinc/15/09/71/636150971.db2.gz BPKFHGKHNXKQIM-LLVKDONJSA-N 0 3 284.350 2.688 20 10 CFCDHN CO[C@@H]1CCC[C@H]([C@@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000850503828 634021294 /nfs/dbraw/zinc/02/12/94/634021294.db2.gz ZHJZNHSXCKTTEV-TTZDDIAXSA-N 0 3 293.407 2.609 20 10 CFCDHN Cc1ccncc1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000850508996 634024262 /nfs/dbraw/zinc/02/42/62/634024262.db2.gz WXOZXOUPFXMDMZ-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN C[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cc(F)ccc1[O-] ZINC000850534861 634041399 /nfs/dbraw/zinc/04/13/99/634041399.db2.gz OKHQIJXRSCTGAP-JTQLQIEISA-N 0 3 289.354 2.993 20 10 CFCDHN C[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccccc1[O-] ZINC000850535034 634041609 /nfs/dbraw/zinc/04/16/09/634041609.db2.gz PWHJMVRTWCDHDL-NSHDSACASA-N 0 3 271.364 2.854 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@@H](O)C12CCC2)c1ccccc1[O-] ZINC000850544874 634046680 /nfs/dbraw/zinc/04/66/80/634046680.db2.gz BSAXNXMYNOFKNP-AEGPPILISA-N 0 3 261.365 2.736 20 10 CFCDHN Cc1ccc(O)c(CNCc2cc(C(F)(F)F)nn2C)c1 ZINC000858240010 636161360 /nfs/dbraw/zinc/16/13/60/636161360.db2.gz YTCQWPXISZDNQF-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCOCCF)c1[O-] ZINC000853238484 634948544 /nfs/dbraw/zinc/94/85/44/634948544.db2.gz KCHYFYZXSDMNQA-JTQLQIEISA-N 0 3 275.751 2.991 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCOCCF)c1[O-] ZINC000853238485 634948720 /nfs/dbraw/zinc/94/87/20/634948720.db2.gz KCHYFYZXSDMNQA-SNVBAGLBSA-N 0 3 275.751 2.991 20 10 CFCDHN Nc1cccc(C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000854215150 635258373 /nfs/dbraw/zinc/25/83/73/635258373.db2.gz CHXUOFVOAKQFFR-AWEZNQCLSA-N 0 3 254.333 2.752 20 10 CFCDHN COC[C@H](NCc1cc(F)c(N(C)C)cc1F)C(C)C ZINC000858145515 636138984 /nfs/dbraw/zinc/13/89/84/636138984.db2.gz WVTBPJIRZVZSIV-AWEZNQCLSA-N 0 3 286.366 2.791 20 10 CFCDHN C[C@]1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)C[C@H]2C[C@H]2C1 ZINC000858291454 636178642 /nfs/dbraw/zinc/17/86/42/636178642.db2.gz ZKDGTJDYRSYRAP-CDMJZVDBSA-N 0 3 275.348 2.647 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN(C)CC(F)F)c([O-])c1 ZINC000858597771 636304619 /nfs/dbraw/zinc/30/46/19/636304619.db2.gz WUKVLSOHDUNEJJ-LLVKDONJSA-N 0 3 272.339 2.548 20 10 CFCDHN Cc1cc(Br)cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1[O-] ZINC000862443487 637383628 /nfs/dbraw/zinc/38/36/28/637383628.db2.gz PPFHATABBOFWSE-AOOOYVTPSA-N 0 3 282.181 2.915 20 10 CFCDHN Cc1cc(Br)cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1[O-] ZINC000862443487 637383629 /nfs/dbraw/zinc/38/36/29/637383629.db2.gz PPFHATABBOFWSE-AOOOYVTPSA-N 0 3 282.181 2.915 20 10 CFCDHN CC1(C)CCC[C@](CO)([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000862486324 637400375 /nfs/dbraw/zinc/40/03/75/637400375.db2.gz YAPSRTLARVNPKX-INIZCTEOSA-N 0 3 281.371 2.952 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2ccncc2OC)c1 ZINC000189009635 650356805 /nfs/dbraw/zinc/35/68/05/650356805.db2.gz KDQUOEIPCDGFGK-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnn2CC2CCC2)c1 ZINC000865640707 638481215 /nfs/dbraw/zinc/48/12/15/638481215.db2.gz NWUPACUEDVJPDK-UHFFFAOYSA-N 0 3 285.391 2.987 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CCCS1 ZINC000865725349 638538254 /nfs/dbraw/zinc/53/82/54/638538254.db2.gz XRHRROLGZZWYHZ-NSHDSACASA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@H](N[C@@H](C)[C@@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000866463605 638825896 /nfs/dbraw/zinc/82/58/96/638825896.db2.gz BZIBKTRIRKJFBQ-OUJBWJOFSA-N 0 3 290.329 2.715 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)CC(C)C)c1ccccc1[O-] ZINC000121084187 638831492 /nfs/dbraw/zinc/83/14/92/638831492.db2.gz YUKJGROIXSVPNU-GXTWGEPZSA-N 0 3 251.370 2.840 20 10 CFCDHN Cc1ccncc1CNCc1ccc(N(C)C)cc1 ZINC000123214472 639741828 /nfs/dbraw/zinc/74/18/28/639741828.db2.gz SHVZXVCDNNHLPA-UHFFFAOYSA-N 0 3 255.365 2.746 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@H]1CCOC1=O)c1ccccc1[O-] ZINC000872114891 641645542 /nfs/dbraw/zinc/64/55/42/641645542.db2.gz YPQYTBBJNXNOLV-GXTWGEPZSA-N 0 3 277.364 2.776 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@@H]1CCOC1=O)c1ccccc1[O-] ZINC000872114895 641645569 /nfs/dbraw/zinc/64/55/69/641645569.db2.gz YPQYTBBJNXNOLV-OCCSQVGLSA-N 0 3 277.364 2.776 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1ccccc1 ZINC000873193645 642058841 /nfs/dbraw/zinc/05/88/41/642058841.db2.gz NGJWJQJIRMOPHS-RDJZCZTQSA-N 0 3 271.360 2.994 20 10 CFCDHN Cc1noc([C@H]2CCC[N@H+](Cc3c(C)cccc3[O-])C2)n1 ZINC000876612426 642944767 /nfs/dbraw/zinc/94/47/67/642944767.db2.gz LJDPOZFIMSYIDV-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@H]2CCC[N@@H+](Cc3c(C)cccc3[O-])C2)n1 ZINC000876612426 642944769 /nfs/dbraw/zinc/94/47/69/642944769.db2.gz LJDPOZFIMSYIDV-ZDUSSCGKSA-N 0 3 287.363 2.772 20 10 CFCDHN CCCC(=O)NC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000876617929 642947878 /nfs/dbraw/zinc/94/78/78/642947878.db2.gz XHCJIUVIYWUYDK-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c([O-])c1 ZINC000876621131 642949446 /nfs/dbraw/zinc/94/94/46/642949446.db2.gz WBRUAIJLUYVUKQ-AWEZNQCLSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c([O-])c1 ZINC000876621131 642949449 /nfs/dbraw/zinc/94/94/49/642949449.db2.gz WBRUAIJLUYVUKQ-AWEZNQCLSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000876626634 642950061 /nfs/dbraw/zinc/95/00/61/642950061.db2.gz DSOYDQCQOSIKQT-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000876626634 642950064 /nfs/dbraw/zinc/95/00/64/642950064.db2.gz DSOYDQCQOSIKQT-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@H+](CCO)CC(C)(C)C)c([O-])c1 ZINC000876695784 642977742 /nfs/dbraw/zinc/97/77/42/642977742.db2.gz HLHBRHJZLRPTSF-UHFFFAOYSA-N 0 3 251.370 2.541 20 10 CFCDHN Cc1ccc(C[N@@H+](CCO)CC(C)(C)C)c([O-])c1 ZINC000876695784 642977745 /nfs/dbraw/zinc/97/77/45/642977745.db2.gz HLHBRHJZLRPTSF-UHFFFAOYSA-N 0 3 251.370 2.541 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCC2CCOCC2)c([O-])c1 ZINC000876760316 642998068 /nfs/dbraw/zinc/99/80/68/642998068.db2.gz QBBMCAFFDLKKGP-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCC2CCOCC2)c([O-])c1 ZINC000876760316 642998069 /nfs/dbraw/zinc/99/80/69/642998069.db2.gz QBBMCAFFDLKKGP-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN CN1CCCC[C@@H]1CC[N@H+](C)Cc1ccc(F)c(F)c1[O-] ZINC000876766273 643001425 /nfs/dbraw/zinc/00/14/25/643001425.db2.gz GVMCSPUNHIQEAF-CYBMUJFWSA-N 0 3 298.377 2.977 20 10 CFCDHN CN1CCCC[C@@H]1CC[N@@H+](C)Cc1ccc(F)c(F)c1[O-] ZINC000876766273 643001428 /nfs/dbraw/zinc/00/14/28/643001428.db2.gz GVMCSPUNHIQEAF-CYBMUJFWSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(F)c(F)c1[O-] ZINC000876766273 643001434 /nfs/dbraw/zinc/00/14/34/643001434.db2.gz GVMCSPUNHIQEAF-CYBMUJFWSA-N 0 3 298.377 2.977 20 10 CFCDHN CN(CC[C@H]1CCCC[N@H+]1C)Cc1ccc(F)c(F)c1[O-] ZINC000876766273 643001438 /nfs/dbraw/zinc/00/14/38/643001438.db2.gz GVMCSPUNHIQEAF-CYBMUJFWSA-N 0 3 298.377 2.977 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@H]32)c([O-])c1 ZINC000876804674 643016472 /nfs/dbraw/zinc/01/64/72/643016472.db2.gz RMQYYDZPEDGQOF-HUUCEWRRSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c([O-])c1 ZINC000876804674 643016475 /nfs/dbraw/zinc/01/64/75/643016475.db2.gz RMQYYDZPEDGQOF-HUUCEWRRSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C(=O)NCC[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876961828 643083545 /nfs/dbraw/zinc/08/35/45/643083545.db2.gz JSDMNCZSIAVTGS-UHFFFAOYSA-N 0 3 298.386 2.529 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)C1CCCCC1 ZINC000877003972 643100495 /nfs/dbraw/zinc/10/04/95/643100495.db2.gz DZVMIWOBJDPJKZ-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccccc1[C@@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877027538 643109800 /nfs/dbraw/zinc/10/98/00/643109800.db2.gz OFKCWLKDYFEYJY-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CCO)c1ccccc1 ZINC000877054693 643123614 /nfs/dbraw/zinc/12/36/14/643123614.db2.gz KFLJFVCVGKITGP-INIZCTEOSA-N 0 3 285.387 2.956 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)c([O-])c1 ZINC000877086060 643144787 /nfs/dbraw/zinc/14/47/87/643144787.db2.gz MFDRQUGINVFOOR-IIAWOOMASA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)[C@H](O)C(C)C)c([O-])c1 ZINC000877124229 643163229 /nfs/dbraw/zinc/16/32/29/643163229.db2.gz UKLHOQWULUAODX-OAHLLOKOSA-N 0 3 265.397 2.833 20 10 CFCDHN Cc1ccc(C[NH2+]CC2([C@H](C)CCO)CCC2)c([O-])c1 ZINC000877139009 643172938 /nfs/dbraw/zinc/17/29/38/643172938.db2.gz VSMCNFIHRWCWOZ-CQSZACIVSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)Cc2ccccc2C)c([O-])c1 ZINC000877463837 643284158 /nfs/dbraw/zinc/28/41/58/643284158.db2.gz DOMHXZOCTFVSDO-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]C(C)(C)C2CCOCC2)c([O-])c1 ZINC000877483276 643299410 /nfs/dbraw/zinc/29/94/10/643299410.db2.gz RPBRPMFFYKPJRS-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc(CC[NH2+]Cc2c(C)cccc2[O-])n1 ZINC000877486926 643302095 /nfs/dbraw/zinc/30/20/95/643302095.db2.gz OEKYSMLEUBTYLO-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2ccc(C)cc2[O-])CCCC1 ZINC000877487832 643303741 /nfs/dbraw/zinc/30/37/41/643303741.db2.gz WSGXFEOEIJHPAO-UHFFFAOYSA-N 0 3 277.364 2.666 20 10 CFCDHN CNC(=O)CC[C@H]1CCCC[N@@H+]1Cc1ccc(C)cc1[O-] ZINC000877521238 643325033 /nfs/dbraw/zinc/32/50/33/643325033.db2.gz TWAKJAJUSJICMX-OAHLLOKOSA-N 0 3 290.407 2.581 20 10 CFCDHN CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1ccc(C)cc1[O-] ZINC000877521238 643325037 /nfs/dbraw/zinc/32/50/37/643325037.db2.gz TWAKJAJUSJICMX-OAHLLOKOSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000877543455 643345510 /nfs/dbraw/zinc/34/55/10/643345510.db2.gz BFHYGFGQJMKNEL-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000877543455 643345515 /nfs/dbraw/zinc/34/55/15/643345515.db2.gz BFHYGFGQJMKNEL-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000877544258 643346651 /nfs/dbraw/zinc/34/66/51/643346651.db2.gz NITYZEKSBMWBIV-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000877544258 643346658 /nfs/dbraw/zinc/34/66/58/643346658.db2.gz NITYZEKSBMWBIV-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN CCc1noc(C)c1CNCc1c(C)cccc1O ZINC000877551362 643350492 /nfs/dbraw/zinc/35/04/92/643350492.db2.gz XDHOYIRBMCDEBD-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)Cc1cccc(F)c1 ZINC000877556875 643358714 /nfs/dbraw/zinc/35/87/14/643358714.db2.gz LNYQUBFPZCLUFB-OAHLLOKOSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCOC(C)(C)C2)c([O-])c1 ZINC000877577757 643375690 /nfs/dbraw/zinc/37/56/90/643375690.db2.gz ITOXGJHHQHSKII-CYBMUJFWSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCCc2c1ccc(=O)n2C ZINC000877617056 643403792 /nfs/dbraw/zinc/40/37/92/643403792.db2.gz RPQYJVPAJKYTKE-OAHLLOKOSA-N 0 3 298.386 2.567 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCCN3CCCC[C@@H]23)c([O-])c1 ZINC000877618877 643404634 /nfs/dbraw/zinc/40/46/34/643404634.db2.gz HSUBGGOHZRPJCB-CVEARBPZSA-N 0 3 274.408 2.807 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccns3)C2)cc1 ZINC000877620343 643406767 /nfs/dbraw/zinc/40/67/67/643406767.db2.gz HEWILEQPAZIXJZ-LBPRGKRZSA-N 0 3 289.404 2.520 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](OCc3ccccn3)C2)c([O-])c1 ZINC000877645275 643427928 /nfs/dbraw/zinc/42/79/28/643427928.db2.gz GZLMIUUESMZFRK-QGZVFWFLSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](OCc3ccccn3)C2)c([O-])c1 ZINC000877645275 643427934 /nfs/dbraw/zinc/42/79/34/643427934.db2.gz GZLMIUUESMZFRK-QGZVFWFLSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](OCc3ccccn3)C2)c([O-])c1 ZINC000877645274 643428478 /nfs/dbraw/zinc/42/84/78/643428478.db2.gz GZLMIUUESMZFRK-KRWDZBQOSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](OCc3ccccn3)C2)c([O-])c1 ZINC000877645274 643428480 /nfs/dbraw/zinc/42/84/80/643428480.db2.gz GZLMIUUESMZFRK-KRWDZBQOSA-N 0 3 298.386 2.887 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(CCF)CC1 ZINC000877673251 643448025 /nfs/dbraw/zinc/44/80/25/643448025.db2.gz DOASGMIDPXWASK-UHFFFAOYSA-N 0 3 267.344 2.972 20 10 CFCDHN O=[N+]([O-])c1ccc(CC[N@@H+]2Cc3cccc([O-])c3C2)cc1 ZINC000877702981 643469681 /nfs/dbraw/zinc/46/96/81/643469681.db2.gz MYXBPBUYZOCEGK-UHFFFAOYSA-N 0 3 284.315 2.859 20 10 CFCDHN O=[N+]([O-])c1ccc(CC[N@H+]2Cc3cccc([O-])c3C2)cc1 ZINC000877702981 643469685 /nfs/dbraw/zinc/46/96/85/643469685.db2.gz MYXBPBUYZOCEGK-UHFFFAOYSA-N 0 3 284.315 2.859 20 10 CFCDHN COC(=O)C[C@@](C)([NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877705247 643472485 /nfs/dbraw/zinc/47/24/85/643472485.db2.gz XPOZRYIJKYRVOL-MRXNPFEDSA-N 0 3 277.364 2.522 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)c([O-])c1 ZINC000877709675 643475722 /nfs/dbraw/zinc/47/57/22/643475722.db2.gz GDVXFOWBYHMHQJ-NVXWUHKLSA-N 0 3 275.392 2.995 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877739575 643505831 /nfs/dbraw/zinc/50/58/31/643505831.db2.gz OJYWMKYUUAODLO-RYUDHWBXSA-N 0 3 279.405 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877739575 643505833 /nfs/dbraw/zinc/50/58/33/643505833.db2.gz OJYWMKYUUAODLO-RYUDHWBXSA-N 0 3 279.405 2.586 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc(N2CCCC2)nc1)c1ccccc1[O-] ZINC000877756326 643537049 /nfs/dbraw/zinc/53/70/49/643537049.db2.gz HPAFARTWJAEABH-CYBMUJFWSA-N 0 3 298.390 2.633 20 10 CFCDHN C[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1[O-] ZINC000877757144 643537117 /nfs/dbraw/zinc/53/71/17/643537117.db2.gz JBLTZIMWXCFATR-JTQLQIEISA-N 0 3 287.315 2.677 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@@H]1SC ZINC000877758397 643538159 /nfs/dbraw/zinc/53/81/59/643538159.db2.gz YHMIDDJEMIHARF-FATJJJSSSA-N 0 3 281.421 2.952 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H](O)C1CCCC1 ZINC000877777441 643553249 /nfs/dbraw/zinc/55/32/49/643553249.db2.gz ANGHTBDNDPZUQO-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN COCC(C)(C)CC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877804077 643566073 /nfs/dbraw/zinc/56/60/73/643566073.db2.gz NKHIQUADKQBVPJ-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)c([O-])c1 ZINC000877807176 643569258 /nfs/dbraw/zinc/56/92/58/643569258.db2.gz VIHNVRDXKLIKNM-DUVNUKRYSA-N 0 3 261.365 2.748 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCC2(CCOCC2)O1)c1ccccc1[O-] ZINC000878355153 643857561 /nfs/dbraw/zinc/85/75/61/643857561.db2.gz UUIOHJJGKQCBLR-ZIAGYGMSSA-N 0 3 291.391 2.771 20 10 CFCDHN CCC(CC)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648721 644363130 /nfs/dbraw/zinc/36/31/30/644363130.db2.gz ASEGSISQJMQECV-NEPJUHHUSA-N 0 3 278.396 2.736 20 10 CFCDHN CCCCOC(=O)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879652327 644365910 /nfs/dbraw/zinc/36/59/10/644365910.db2.gz CFFRRQLUAYAPJX-LBPRGKRZSA-N 0 3 265.353 2.776 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1)c1ccccc1[O-] ZINC000879653284 644366660 /nfs/dbraw/zinc/36/66/60/644366660.db2.gz MODHKISOLJJKCH-MJBXVCDLSA-N 0 3 290.407 2.547 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cnoc2C)c1 ZINC000129843537 645419422 /nfs/dbraw/zinc/41/94/22/645419422.db2.gz XNQVBBHZADIXSO-VIFPVBQESA-N 0 3 262.309 2.548 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](C)[S@](C)=O)c1ccccc1[O-] ZINC000253024806 651033675 /nfs/dbraw/zinc/03/36/75/651033675.db2.gz MPOGSPFBJRPGKS-YNKQFZHNSA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)CCO1 ZINC000028754388 645955558 /nfs/dbraw/zinc/95/55/58/645955558.db2.gz IBCTWRNJDYLMOH-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)CCO1 ZINC000028754388 645955561 /nfs/dbraw/zinc/95/55/61/645955561.db2.gz IBCTWRNJDYLMOH-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@@H]1CN(Cc2c(O)ccc3ccccc32)CCO1 ZINC000028754388 645955563 /nfs/dbraw/zinc/95/55/63/645955563.db2.gz IBCTWRNJDYLMOH-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN CC(=O)Nc1ccccc1C[NH2+]Cc1ccccc1[O-] ZINC000135201117 646491803 /nfs/dbraw/zinc/49/18/03/646491803.db2.gz LCKFBOZHXCNSLK-UHFFFAOYSA-N 0 3 270.332 2.640 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@]12C[C@H]1COC2 ZINC000886201468 646917254 /nfs/dbraw/zinc/91/72/54/646917254.db2.gz FWGHEYDWQDCUCB-WMZOPIPTSA-N 0 3 281.355 2.938 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC000886282546 646951293 /nfs/dbraw/zinc/95/12/93/646951293.db2.gz MOCMJVDZTXRWAX-XQHKEYJVSA-N 0 3 261.365 2.783 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886522589 647027683 /nfs/dbraw/zinc/02/76/83/647027683.db2.gz MUIXNSGOMBASEI-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[NH+](CC)C[C@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886522589 647027687 /nfs/dbraw/zinc/02/76/87/647027687.db2.gz MUIXNSGOMBASEI-NWDGAFQWSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)Cc1ccccc1F)c1ccccc1[O-] ZINC000886673099 647103136 /nfs/dbraw/zinc/10/31/36/647103136.db2.gz ZZWZYCSNDIUJBC-JSGCOSHPSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CC[C@@]2(CO[C@H](C)C2)O1)c1ccccc1[O-] ZINC000886764408 647130103 /nfs/dbraw/zinc/13/01/03/647130103.db2.gz SFIYPRKSBBUJSF-UMPJEAMMSA-N 0 3 291.391 2.769 20 10 CFCDHN C[C@@H](NCCCSc1nccs1)c1cn(C)cn1 ZINC000925104500 648107094 /nfs/dbraw/zinc/10/70/94/648107094.db2.gz ZRKAGWNTOOZGQP-SNVBAGLBSA-N 0 3 282.438 2.710 20 10 CFCDHN CCC1([NH3+])CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])CC1 ZINC000925756945 648310274 /nfs/dbraw/zinc/31/02/74/648310274.db2.gz CGQPBKZLLOOSRA-NSHDSACASA-N 0 3 293.367 2.565 20 10 CFCDHN CC[C@@H](NCc1cc(N)ccn1)c1ccc(N(C)C)cc1 ZINC000925771584 648314752 /nfs/dbraw/zinc/31/47/52/648314752.db2.gz NAGSQIDBFUXFPD-QGZVFWFLSA-N 0 3 284.407 2.971 20 10 CFCDHN CCOCCOCC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000927086643 648704883 /nfs/dbraw/zinc/70/48/83/648704883.db2.gz HUMRJXZQRIWDDI-AAEUAGOBSA-N 0 3 297.370 2.722 20 10 CFCDHN CC[C@H]([NH2+]Cc1cnn(CCF)c1)c1ccccc1[O-] ZINC000930223878 649209494 /nfs/dbraw/zinc/20/94/94/649209494.db2.gz YBUNNLWMNLPXJH-AWEZNQCLSA-N 0 3 277.343 2.799 20 10 CFCDHN Cc1nnsc1[C@@H](C)N[C@H](C)c1ccccc1O ZINC000931555581 649453881 /nfs/dbraw/zinc/45/38/81/649453881.db2.gz YNMJWBNNBMPGKI-RKDXNWHRSA-N 0 3 263.366 2.964 20 10 CFCDHN CN(Cc1cc(Cl)c(C(C)(C)C)cc1[O-])C1C[NH2+]C1 ZINC001235924482 778611306 /nfs/dbraw/zinc/61/13/06/778611306.db2.gz RLKVOFCZDZXUSC-UHFFFAOYSA-N 0 3 282.815 2.747 20 10 CFCDHN C[C@@H]([NH2+][C@H](CCO)C1CCCC1)c1ccccc1[O-] ZINC000725105316 775273954 /nfs/dbraw/zinc/27/39/54/775273954.db2.gz UBIIWDIHWQUVSN-IUODEOHRSA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@@H]1CC([NH2+][C@@H]2CCc3cccc([O-])c32)C[C@@H](C)O1 ZINC000694800639 775579646 /nfs/dbraw/zinc/57/96/46/775579646.db2.gz MSCMZBDKGPDBHT-JTNHKYCSSA-N 0 3 261.365 2.925 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)c1[O-] ZINC000690800630 775674723 /nfs/dbraw/zinc/67/47/23/775674723.db2.gz ZWCJUEHJZBJMEY-PWSUYJOCSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1[O-] ZINC000690800630 775674727 /nfs/dbraw/zinc/67/47/27/775674727.db2.gz ZWCJUEHJZBJMEY-PWSUYJOCSA-N 0 3 297.782 2.523 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(F)ccc1[O-] ZINC000396560329 775942517 /nfs/dbraw/zinc/94/25/17/775942517.db2.gz WEXLXICLWLHQNX-ONGXEEELSA-N 0 3 253.317 2.749 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2ccoc2)c1[O-] ZINC000692739894 776100513 /nfs/dbraw/zinc/10/05/13/776100513.db2.gz PCVUBZBCOMNFNK-UHFFFAOYSA-N 0 3 281.739 2.980 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC000722320599 776466489 /nfs/dbraw/zinc/46/64/89/776466489.db2.gz GMASMRCXULKBMV-UKRRQHHQSA-N 0 3 265.328 2.579 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1SCCS1)CC2 ZINC000692902048 776580762 /nfs/dbraw/zinc/58/07/62/776580762.db2.gz HVVBSPHHTDKLGN-SNVBAGLBSA-N 0 3 267.419 2.775 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCC[C@H]1CO ZINC001231588138 777268694 /nfs/dbraw/zinc/26/86/94/777268694.db2.gz MUDNECDGXOQRRT-AWEZNQCLSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCC[C@H]1CO ZINC001231588138 777268700 /nfs/dbraw/zinc/26/87/00/777268700.db2.gz MUDNECDGXOQRRT-AWEZNQCLSA-N 0 3 271.360 2.892 20 10 CFCDHN CN(Cc1ccncn1)Cc1c(O)ccc2ccccc21 ZINC001231589047 777268925 /nfs/dbraw/zinc/26/89/25/777268925.db2.gz BFMMDUQNCUMMKA-UHFFFAOYSA-N 0 3 279.343 2.967 20 10 CFCDHN Cc1cccc(CN2CCC[C@H]2c2cnccn2)c1O ZINC001231592010 777272166 /nfs/dbraw/zinc/27/21/66/777272166.db2.gz FGCPYYXDOVEYIL-HNNXBMFYSA-N 0 3 269.348 2.828 20 10 CFCDHN Cc1cccc(CN2CCN(c3ncccc3C)CC2)c1O ZINC001231591015 777272309 /nfs/dbraw/zinc/27/23/09/777272309.db2.gz PFQQPIGVQOLZNW-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN Cc1cc(C)c(CN2CCCC(=O)[C@@H](C)C2)c(O)c1 ZINC001231842438 777345102 /nfs/dbraw/zinc/34/51/02/777345102.db2.gz LXQXVYBCSYAIHX-ZDUSSCGKSA-N 0 3 261.365 2.810 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@]12CCOC2 ZINC001231855334 777351960 /nfs/dbraw/zinc/35/19/60/777351960.db2.gz QRDBJGPAGIWLDO-QGZVFWFLSA-N 0 3 290.407 2.516 20 10 CFCDHN CC[NH+](CC)CCN(C)Cc1cc(Cl)c([O-])cc1O ZINC001232258544 777496169 /nfs/dbraw/zinc/49/61/69/777496169.db2.gz KBXIFZAHYHUIJG-UHFFFAOYSA-N 0 3 286.803 2.525 20 10 CFCDHN CC[NH+](CC)[C@H]1CCN(Cc2cc(Cl)c([O-])cc2O)C1 ZINC001232262176 777496713 /nfs/dbraw/zinc/49/67/13/777496713.db2.gz BLQWHVNQIMBGQF-LBPRGKRZSA-N 0 3 298.814 2.667 20 10 CFCDHN CN(Cc1ccc(C(C)(C)O)nc1)Cc1ccccc1O ZINC001232828692 777683927 /nfs/dbraw/zinc/68/39/27/777683927.db2.gz UMGJTLUJEZMOAD-UHFFFAOYSA-N 0 3 286.375 2.647 20 10 CFCDHN Oc1cc(CN2CCC3(CCCC3)C2)cc(O)c1O ZINC001233011994 777764912 /nfs/dbraw/zinc/76/49/12/777764912.db2.gz GDVJXNCKVMNGED-UHFFFAOYSA-N 0 3 263.337 2.570 20 10 CFCDHN CC(C)(C)c1ccc(O)c(CN2CC3(COC3)C2)c1 ZINC001233284213 777864788 /nfs/dbraw/zinc/86/47/88/777864788.db2.gz MINLBMNRCWOQGH-UHFFFAOYSA-N 0 3 261.365 2.522 20 10 CFCDHN CC[N@H+](Cc1c([O-])ccc(F)c1F)C1CCN(C)CC1 ZINC001233334448 777894702 /nfs/dbraw/zinc/89/47/02/777894702.db2.gz HOMUFIJHOMXRCY-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN CC[N@@H+](Cc1c([O-])ccc(F)c1F)C1CCN(C)CC1 ZINC001233334448 777894708 /nfs/dbraw/zinc/89/47/08/777894708.db2.gz HOMUFIJHOMXRCY-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN CCN(Cc1c([O-])ccc(F)c1F)C1CC[NH+](C)CC1 ZINC001233334448 777894715 /nfs/dbraw/zinc/89/47/15/777894715.db2.gz HOMUFIJHOMXRCY-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN C[C@@H]1c2ccccc2CCN1Cc1cc(O)c(O)cc1O ZINC001233482904 777961204 /nfs/dbraw/zinc/96/12/04/777961204.db2.gz GRUMWASBKBXDEM-LLVKDONJSA-N 0 3 285.343 2.923 20 10 CFCDHN CCOC[C@@H](C)Oc1ccc(N2CCN(CC)CC2)cc1 ZINC001234657752 778280106 /nfs/dbraw/zinc/28/01/06/778280106.db2.gz HIPNLIPDAOTZNX-OAHLLOKOSA-N 0 3 292.423 2.632 20 10 CFCDHN CCN1CCC([N@H+](C)Cc2cc(F)c(F)cc2[O-])CC1 ZINC001142525135 778400945 /nfs/dbraw/zinc/40/09/45/778400945.db2.gz YYGARHZPDAXPFK-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN CCN1CCC([N@@H+](C)Cc2cc(F)c(F)cc2[O-])CC1 ZINC001142525135 778400948 /nfs/dbraw/zinc/40/09/48/778400948.db2.gz YYGARHZPDAXPFK-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN CC[NH+]1CCC(N(C)Cc2cc(F)c(F)cc2[O-])CC1 ZINC001142525135 778400952 /nfs/dbraw/zinc/40/09/52/778400952.db2.gz YYGARHZPDAXPFK-UHFFFAOYSA-N 0 3 284.350 2.587 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH2+]C[C@H]2C(C)C)cc1Cl ZINC001235458277 778497603 /nfs/dbraw/zinc/49/76/03/778497603.db2.gz NWAXJEHTGLZKCP-AWEZNQCLSA-N 0 3 282.815 2.784 20 10 CFCDHN CO[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1OC ZINC001235676752 778532350 /nfs/dbraw/zinc/53/23/50/778532350.db2.gz SXMZLLUHJPZUMW-IYBDPMFKSA-N 0 3 293.407 2.535 20 10 CFCDHN CO[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1OC ZINC001235676752 778532351 /nfs/dbraw/zinc/53/23/51/778532351.db2.gz SXMZLLUHJPZUMW-IYBDPMFKSA-N 0 3 293.407 2.535 20 10 CFCDHN Cc1cc([O-])c(CN2[C@H](C)C[NH2+]C[C@H]2C)cc1Cl ZINC001236104413 778695988 /nfs/dbraw/zinc/69/59/88/778695988.db2.gz ZIQVSALCKLTNJP-GHMZBOCLSA-N 0 3 268.788 2.536 20 10 CFCDHN CN(Cc1ccc(Cl)cc1[O-])[C@]1(C)CCC[NH2+]C1 ZINC001236205956 778735035 /nfs/dbraw/zinc/73/50/35/778735035.db2.gz HPBXEFGRUUCMJG-CQSZACIVSA-N 0 3 268.788 2.620 20 10 CFCDHN [O-]c1cccc(Cl)c1CN(C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238339 778747809 /nfs/dbraw/zinc/74/78/09/778747809.db2.gz CLVKMVFUHHVFGP-GFCCVEGCSA-N 0 3 280.799 2.762 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[NH2+][C@H]3C2)cc1Cl ZINC001236286473 778762186 /nfs/dbraw/zinc/76/21/86/778762186.db2.gz NDQXLECPDLIPKE-RISCZKNCSA-N 0 3 294.826 2.747 20 10 CFCDHN CCO[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000226561140 778840196 /nfs/dbraw/zinc/84/01/96/778840196.db2.gz MWRNSIRIUGFUTP-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CCO[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000226561140 778840204 /nfs/dbraw/zinc/84/02/04/778840204.db2.gz MWRNSIRIUGFUTP-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H](C)[NH2+][C@H](C)C2)cc1Cl ZINC001236580402 778884163 /nfs/dbraw/zinc/88/41/63/778884163.db2.gz ZCJQFBOQVVKOLK-GHMZBOCLSA-N 0 3 268.788 2.536 20 10 CFCDHN [O-]c1c(O)cccc1C[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001168412635 778889664 /nfs/dbraw/zinc/88/96/64/778889664.db2.gz RWMMPZYZBVYOGJ-HNNXBMFYSA-N 0 3 287.334 2.884 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@](C)(O)C2)c([O-])c1 ZINC001236782353 778934066 /nfs/dbraw/zinc/93/40/66/778934066.db2.gz ASOQTPMJAVXMIQ-INIZCTEOSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@](C)(O)C2)c([O-])c1 ZINC001236782353 778934070 /nfs/dbraw/zinc/93/40/70/778934070.db2.gz ASOQTPMJAVXMIQ-INIZCTEOSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784236 778934873 /nfs/dbraw/zinc/93/48/73/778934873.db2.gz SCBCEAZAHDRGPO-WBMJQRKESA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784236 778934876 /nfs/dbraw/zinc/93/48/76/778934876.db2.gz SCBCEAZAHDRGPO-WBMJQRKESA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c([O-])c1 ZINC001236783325 778935294 /nfs/dbraw/zinc/93/52/94/778935294.db2.gz JZGCTGZCRZFHFF-SHTZXODSSA-N 0 3 263.381 2.690 20 10 CFCDHN CCc1ccc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c([O-])c1 ZINC001236783325 778935301 /nfs/dbraw/zinc/93/53/01/778935301.db2.gz JZGCTGZCRZFHFF-SHTZXODSSA-N 0 3 263.381 2.690 20 10 CFCDHN CCO[C@H]1CCC[N@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236785902 778935625 /nfs/dbraw/zinc/93/56/25/778935625.db2.gz AROAFSPJBUMPMF-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCO[C@H]1CCC[N@@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236785902 778935631 /nfs/dbraw/zinc/93/56/31/778935631.db2.gz AROAFSPJBUMPMF-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C(=O)OC)C2)c([O-])c1 ZINC001236787299 778937265 /nfs/dbraw/zinc/93/72/65/778937265.db2.gz ATLXCSFHZJPUMB-DOMZBBRYSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](C)C[C@H](C(=O)OC)C2)c([O-])c1 ZINC001236787299 778937272 /nfs/dbraw/zinc/93/72/72/778937272.db2.gz ATLXCSFHZJPUMB-DOMZBBRYSA-N 0 3 291.391 2.586 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236787440 778937352 /nfs/dbraw/zinc/93/73/52/778937352.db2.gz VGDOVUOHJIILBK-MRXNPFEDSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236787440 778937355 /nfs/dbraw/zinc/93/73/55/778937355.db2.gz VGDOVUOHJIILBK-MRXNPFEDSA-N 0 3 261.365 2.567 20 10 CFCDHN COC[C@H]1CCCC[N@@H+]1Cc1c(C)cc(OC)cc1[O-] ZINC001236808413 778948802 /nfs/dbraw/zinc/94/88/02/778948802.db2.gz PBFFSVCGJOURBZ-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COC[C@H]1CCCC[N@H+]1Cc1c(C)cc(OC)cc1[O-] ZINC001236808413 778948808 /nfs/dbraw/zinc/94/88/08/778948808.db2.gz PBFFSVCGJOURBZ-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[NH+]2C[C@@H]3CCC[C@H]3C2)c([O-])c1 ZINC001236818257 778952027 /nfs/dbraw/zinc/95/20/27/778952027.db2.gz JVCZTHZVDWITRG-STQMWFEESA-N 0 3 261.365 2.941 20 10 CFCDHN Cc1nc(CC[N@@H+](C)Cc2cc3ccccc3cc2[O-])no1 ZINC001236826052 778955076 /nfs/dbraw/zinc/95/50/76/778955076.db2.gz FRWUAOZYFQXYNV-UHFFFAOYSA-N 0 3 297.358 2.911 20 10 CFCDHN Cc1nc(CC[N@H+](C)Cc2cc3ccccc3cc2[O-])no1 ZINC001236826052 778955079 /nfs/dbraw/zinc/95/50/79/778955079.db2.gz FRWUAOZYFQXYNV-UHFFFAOYSA-N 0 3 297.358 2.911 20 10 CFCDHN C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827439 778957203 /nfs/dbraw/zinc/95/72/03/778957203.db2.gz RXWQHSOTBUNSMS-WBMJQRKESA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1CC[C@H](O)C[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827439 778957208 /nfs/dbraw/zinc/95/72/08/778957208.db2.gz RXWQHSOTBUNSMS-WBMJQRKESA-N 0 3 271.360 2.891 20 10 CFCDHN CC(=O)N[C@H]1CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236839003 778962010 /nfs/dbraw/zinc/96/20/10/778962010.db2.gz DHOGOQCDFBAQOL-KRWDZBQOSA-N 0 3 298.386 2.646 20 10 CFCDHN CC(=O)N[C@H]1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236839003 778962012 /nfs/dbraw/zinc/96/20/12/778962012.db2.gz DHOGOQCDFBAQOL-KRWDZBQOSA-N 0 3 298.386 2.646 20 10 CFCDHN CNC(=O)C1CC[NH+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236840930 778962044 /nfs/dbraw/zinc/96/20/44/778962044.db2.gz UEOXGTVGFVVOPQ-UHFFFAOYSA-N 0 3 298.386 2.503 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001237040456 778996396 /nfs/dbraw/zinc/99/63/96/778996396.db2.gz DFTRUCIEJLVISL-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001237040456 778996398 /nfs/dbraw/zinc/99/63/98/778996398.db2.gz DFTRUCIEJLVISL-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c([O-])c1 ZINC001237044593 778997127 /nfs/dbraw/zinc/99/71/27/778997127.db2.gz PVLJROMHKKIRAM-OBJOEFQTSA-N 0 3 265.328 2.723 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c([O-])c1 ZINC001237044593 778997128 /nfs/dbraw/zinc/99/71/28/778997128.db2.gz PVLJROMHKKIRAM-OBJOEFQTSA-N 0 3 265.328 2.723 20 10 CFCDHN CC(=O)NC1CC[NH+](Cc2ccc(C(C)C)cc2[O-])CC1 ZINC001237044174 778997885 /nfs/dbraw/zinc/99/78/85/778997885.db2.gz BDMVHPSKPIYEIM-UHFFFAOYSA-N 0 3 290.407 2.616 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c([O-])c1 ZINC001237046391 778998671 /nfs/dbraw/zinc/99/86/71/778998671.db2.gz AVNKEMLPHWNOIS-YPMHNXCESA-N 0 3 283.318 2.878 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c([O-])c1 ZINC001237046391 778998674 /nfs/dbraw/zinc/99/86/74/778998674.db2.gz AVNKEMLPHWNOIS-YPMHNXCESA-N 0 3 283.318 2.878 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCCC[C@H](O)C2)c([O-])c1 ZINC001237046981 778998746 /nfs/dbraw/zinc/99/87/46/778998746.db2.gz YCYSHGWBDAWKSJ-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCCC[C@H](O)C2)c([O-])c1 ZINC001237046981 778998751 /nfs/dbraw/zinc/99/87/51/778998751.db2.gz YCYSHGWBDAWKSJ-HNNXBMFYSA-N 0 3 263.381 2.862 20 10 CFCDHN Cc1nc(CC[N@@H+](C)Cc2ccc(C(C)C)cc2[O-])no1 ZINC001237046693 778998874 /nfs/dbraw/zinc/99/88/74/778998874.db2.gz VPRNVYSSVASAOA-UHFFFAOYSA-N 0 3 289.379 2.882 20 10 CFCDHN Cc1nc(CC[N@H+](C)Cc2ccc(C(C)C)cc2[O-])no1 ZINC001237046693 778998878 /nfs/dbraw/zinc/99/88/78/778998878.db2.gz VPRNVYSSVASAOA-UHFFFAOYSA-N 0 3 289.379 2.882 20 10 CFCDHN CC(C)c1ccc(C[N@H+](C)CCC2OCCO2)c([O-])c1 ZINC001237048513 778999205 /nfs/dbraw/zinc/99/92/05/778999205.db2.gz HDUKBECHXUXONO-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN CC(C)c1ccc(C[N@@H+](C)CCC2OCCO2)c([O-])c1 ZINC001237048513 778999208 /nfs/dbraw/zinc/99/92/08/778999208.db2.gz HDUKBECHXUXONO-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CCC(C)(C(N)=O)CC2)c([O-])c1 ZINC001237053398 778999983 /nfs/dbraw/zinc/99/99/83/778999983.db2.gz LEAPHTCTDBKBLT-UHFFFAOYSA-N 0 3 290.407 2.603 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237051777 779000269 /nfs/dbraw/zinc/00/02/69/779000269.db2.gz QLUZASBPZHZMPX-QGZVFWFLSA-N 0 3 291.391 2.901 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237051777 779000271 /nfs/dbraw/zinc/00/02/71/779000271.db2.gz QLUZASBPZHZMPX-QGZVFWFLSA-N 0 3 291.391 2.901 20 10 CFCDHN [O-]c1cc(OCC(F)(F)F)ccc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001237054208 779001820 /nfs/dbraw/zinc/00/18/20/779001820.db2.gz WROOAJDAJBZMKQ-PHIMTYICSA-N 0 3 287.281 2.785 20 10 CFCDHN [O-]c1cc(OCC(F)(F)F)ccc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001237054208 779001823 /nfs/dbraw/zinc/00/18/23/779001823.db2.gz WROOAJDAJBZMKQ-PHIMTYICSA-N 0 3 287.281 2.785 20 10 CFCDHN CC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056718 779002290 /nfs/dbraw/zinc/00/22/90/779002290.db2.gz ZGFKZFMMXRRCOT-AWEZNQCLSA-N 0 3 261.365 2.927 20 10 CFCDHN CC(=O)[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056718 779002295 /nfs/dbraw/zinc/00/22/95/779002295.db2.gz ZGFKZFMMXRRCOT-AWEZNQCLSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@]1(CO)CCN(Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237135669 779023541 /nfs/dbraw/zinc/02/35/41/779023541.db2.gz KLRNIOQCUGQBIB-ZDUSSCGKSA-N 0 3 289.297 2.615 20 10 CFCDHN C[C@]1(CO)CC[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237135669 779023550 /nfs/dbraw/zinc/02/35/50/779023550.db2.gz KLRNIOQCUGQBIB-ZDUSSCGKSA-N 0 3 289.297 2.615 20 10 CFCDHN C[C@]1(CO)CC[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237135669 779023558 /nfs/dbraw/zinc/02/35/58/779023558.db2.gz KLRNIOQCUGQBIB-ZDUSSCGKSA-N 0 3 289.297 2.615 20 10 CFCDHN OCC1CCN(Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237135946 779023877 /nfs/dbraw/zinc/02/38/77/779023877.db2.gz ODOMFUCAQSVRHQ-UHFFFAOYSA-N 0 3 289.297 2.615 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCSCC(F)(F)F ZINC000698983216 779118568 /nfs/dbraw/zinc/11/85/68/779118568.db2.gz CFNSGCDXDBKCGZ-UHFFFAOYSA-N 0 3 265.300 2.777 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCc3nccn3CC2)c1[O-] ZINC001237687165 779160967 /nfs/dbraw/zinc/16/09/67/779160967.db2.gz SCQUDIHJGBBJJM-UHFFFAOYSA-N 0 3 291.782 2.609 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCc3nccn3CC2)c1[O-] ZINC001237687165 779160968 /nfs/dbraw/zinc/16/09/68/779160968.db2.gz SCQUDIHJGBBJJM-UHFFFAOYSA-N 0 3 291.782 2.609 20 10 CFCDHN COC(=O)C[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237687459 779161190 /nfs/dbraw/zinc/16/11/90/779161190.db2.gz CCCHXOUNRKVSKD-LLVKDONJSA-N 0 3 297.782 2.739 20 10 CFCDHN COC(=O)C[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237687459 779161192 /nfs/dbraw/zinc/16/11/92/779161192.db2.gz CCCHXOUNRKVSKD-LLVKDONJSA-N 0 3 297.782 2.739 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2CO)c1[O-] ZINC001237685991 779161602 /nfs/dbraw/zinc/16/16/02/779161602.db2.gz SFYLSEGOEKNCSL-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2CO)c1[O-] ZINC001237685991 779161605 /nfs/dbraw/zinc/16/16/05/779161605.db2.gz SFYLSEGOEKNCSL-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC001238055778 779241518 /nfs/dbraw/zinc/24/15/18/779241518.db2.gz DFSPKWMXGHESPX-DOMZBBRYSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC001238055778 779241523 /nfs/dbraw/zinc/24/15/23/779241523.db2.gz DFSPKWMXGHESPX-DOMZBBRYSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c1[O-] ZINC001238063842 779242361 /nfs/dbraw/zinc/24/23/61/779242361.db2.gz MGGBGMIUNLIBEW-INIZCTEOSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@]3(CCOC3)C2)c1[O-] ZINC001238063842 779242363 /nfs/dbraw/zinc/24/23/63/779242363.db2.gz MGGBGMIUNLIBEW-INIZCTEOSA-N 0 3 279.355 2.842 20 10 CFCDHN COC(=O)[C@]1(C)CCC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238071132 779247166 /nfs/dbraw/zinc/24/71/66/779247166.db2.gz SOHJKGKKZRKQFT-MRXNPFEDSA-N 0 3 295.354 2.615 20 10 CFCDHN COC(=O)[C@]1(C)CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238071132 779247168 /nfs/dbraw/zinc/24/71/68/779247168.db2.gz SOHJKGKKZRKQFT-MRXNPFEDSA-N 0 3 295.354 2.615 20 10 CFCDHN C[C@@H](COc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000699375875 779252001 /nfs/dbraw/zinc/25/20/01/779252001.db2.gz KYPLFMMWNFKMRS-ZDUSSCGKSA-N 0 3 257.333 2.949 20 10 CFCDHN CC[C@H]1C[NH2+]CCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001235772880 779375410 /nfs/dbraw/zinc/37/54/10/779375410.db2.gz MFAHTQCKKMVMDG-LBPRGKRZSA-N 0 3 288.313 2.595 20 10 CFCDHN COC(=O)Cc1ccc(C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC001142910943 779917058 /nfs/dbraw/zinc/91/70/58/779917058.db2.gz UOFQPIFZBNYAOE-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN COC(=O)Cc1ccc(C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC001142910943 779917060 /nfs/dbraw/zinc/91/70/60/779917060.db2.gz UOFQPIFZBNYAOE-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CC)[C@H](O)C(F)F)c1ccccc1[O-] ZINC000295131855 199362466 /nfs/dbraw/zinc/36/24/66/199362466.db2.gz YDBVQLQAQDOMQQ-GVXVVHGQSA-N 0 3 273.323 2.838 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)CCCCO)c1[O-] ZINC000295137157 199365904 /nfs/dbraw/zinc/36/59/04/199365904.db2.gz YXRNADMJPXHBBY-SNVBAGLBSA-N 0 3 287.787 2.695 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)[C@H](O)c2ccccc2)c1[O-] ZINC000032131240 346300660 /nfs/dbraw/zinc/30/06/60/346300660.db2.gz QAQTZSBWVPRFJE-WBMJQRKESA-N 0 3 287.359 2.613 20 10 CFCDHN Cn1cc2c(n1)CCC[C@H]2NCc1ccc2c(c1)CCN2C ZINC000366436586 282696892 /nfs/dbraw/zinc/69/68/92/282696892.db2.gz ZFEXQUCGDQPJJJ-MRXNPFEDSA-N 0 3 296.418 2.580 20 10 CFCDHN CCC[N@H+](Cc1cccc(OCC)c1[O-])CC(C)(C)O ZINC000271164091 283295503 /nfs/dbraw/zinc/29/55/03/283295503.db2.gz MLYWEJCCVCXHDO-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CCC[N@@H+](Cc1cccc(OCC)c1[O-])CC(C)(C)O ZINC000271164091 283295505 /nfs/dbraw/zinc/29/55/05/283295505.db2.gz MLYWEJCCVCXHDO-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)CC2 ZINC000297531873 200220285 /nfs/dbraw/zinc/22/02/85/200220285.db2.gz DOQUMIRYMROTLD-GOEBONIOSA-N 0 3 275.392 2.910 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000297737724 200271305 /nfs/dbraw/zinc/27/13/05/200271305.db2.gz NVUZRNHCEPUBQC-WBVHZDCISA-N 0 3 299.370 2.711 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccnc1-n1ccnc1)c1ccccc1[O-] ZINC000183410110 296135887 /nfs/dbraw/zinc/13/58/87/296135887.db2.gz QCMJJAFGVRJJCM-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN CN(C)[C@@H](C[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000020093913 372230419 /nfs/dbraw/zinc/23/04/19/372230419.db2.gz QQLRFCOTLCSQTC-INIZCTEOSA-N 0 3 270.376 2.785 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2c(C)noc2C)c1 ZINC000092328723 375102357 /nfs/dbraw/zinc/10/23/57/375102357.db2.gz SAGKZOQIYKTKHD-VIFPVBQESA-N 0 3 276.336 2.856 20 10 CFCDHN CCN(Cc1ccccn1)Cc1cccc(OC)c1O ZINC000093338855 375218261 /nfs/dbraw/zinc/21/82/61/375218261.db2.gz KXLPNSRNHIBGDR-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN CCN1CC[C@@H]([N@H+](C)Cc2cccc(OC)c2[O-])[C@H](C)C1 ZINC000093639355 375276891 /nfs/dbraw/zinc/27/68/91/375276891.db2.gz KWTWKZRCDDELQE-UKRRQHHQSA-N 0 3 292.423 2.563 20 10 CFCDHN CCN1CC[C@@H]([N@@H+](C)Cc2cccc(OC)c2[O-])[C@H](C)C1 ZINC000093639355 375276893 /nfs/dbraw/zinc/27/68/93/375276893.db2.gz KWTWKZRCDDELQE-UKRRQHHQSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644847 375284820 /nfs/dbraw/zinc/28/48/20/375284820.db2.gz WLXODUYAJMGOHB-UKRRQHHQSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644847 375284826 /nfs/dbraw/zinc/28/48/26/375284826.db2.gz WLXODUYAJMGOHB-UKRRQHHQSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000093507131 375257477 /nfs/dbraw/zinc/25/74/77/375257477.db2.gz XBWKGILEVKXUTQ-CXAGYDPISA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000093507131 375257484 /nfs/dbraw/zinc/25/74/84/375257484.db2.gz XBWKGILEVKXUTQ-CXAGYDPISA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000093507133 375258842 /nfs/dbraw/zinc/25/88/42/375258842.db2.gz XBWKGILEVKXUTQ-DYVFJYSZSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC000093507133 375258846 /nfs/dbraw/zinc/25/88/46/375258846.db2.gz XBWKGILEVKXUTQ-DYVFJYSZSA-N 0 3 291.391 2.792 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)cc1 ZINC000111236230 375836526 /nfs/dbraw/zinc/83/65/26/375836526.db2.gz NUNVJUGNVWDWHD-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccc(F)cc1 ZINC000111236230 375836531 /nfs/dbraw/zinc/83/65/31/375836531.db2.gz NUNVJUGNVWDWHD-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C[C@H]2CCOC2)C2CC2)c1 ZINC000130028325 377503638 /nfs/dbraw/zinc/50/36/38/377503638.db2.gz YKUJMJMUYVUMHM-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C[C@H]2CCOC2)C2CC2)c1 ZINC000130028325 377503641 /nfs/dbraw/zinc/50/36/41/377503641.db2.gz YKUJMJMUYVUMHM-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H]2CCSC2)c1[O-] ZINC000130543596 377572851 /nfs/dbraw/zinc/57/28/51/377572851.db2.gz MGROGRJPYSUJCC-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H]2CCSC2)c1[O-] ZINC000130543596 377572857 /nfs/dbraw/zinc/57/28/57/377572857.db2.gz MGROGRJPYSUJCC-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@@H]1C[C@H](N(C)Cc2c([O-])cccc2Cl)CC[N@@H+]1C ZINC000130657301 377589236 /nfs/dbraw/zinc/58/92/36/377589236.db2.gz AUSXKDQBBUEAHV-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@H](N(C)Cc2c([O-])cccc2Cl)CC[N@H+]1C ZINC000130657301 377589245 /nfs/dbraw/zinc/58/92/45/377589245.db2.gz AUSXKDQBBUEAHV-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@H]([N@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657301 377589254 /nfs/dbraw/zinc/58/92/54/377589254.db2.gz AUSXKDQBBUEAHV-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@H]([N@@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657301 377589258 /nfs/dbraw/zinc/58/92/58/377589258.db2.gz AUSXKDQBBUEAHV-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@@H]3CCCC[C@@H]32)c1 ZINC000133465911 377931907 /nfs/dbraw/zinc/93/19/07/377931907.db2.gz DMNLGKQUXJUQGJ-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN CCOc1cccc(C[NH2+]C2CCSCC2)c1[O-] ZINC000134414071 378012329 /nfs/dbraw/zinc/01/23/29/378012329.db2.gz SYXFWCXXGPGGFZ-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC(C3OCCO3)CC2)cc1C ZINC000152277121 378406910 /nfs/dbraw/zinc/40/69/10/378406910.db2.gz IVDVJSYJZYKRAC-UHFFFAOYSA-N 0 3 291.391 2.594 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)[C@H](CO)SC)cc1 ZINC000152466451 378419099 /nfs/dbraw/zinc/41/90/99/378419099.db2.gz VFHFVVGVKBZHKC-CJNGLKHVSA-N 0 3 296.480 2.735 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1cccc(F)c1)c1ccccc1[O-] ZINC000154113343 378541721 /nfs/dbraw/zinc/54/17/21/378541721.db2.gz YCSABGWJOJRIMA-BDJLRTHQSA-N 0 3 275.323 2.916 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)C2CC(F)(F)C2)c1[O-] ZINC000529566819 383730532 /nfs/dbraw/zinc/73/05/32/383730532.db2.gz HDRSECZWQOFQBO-VIFPVBQESA-N 0 3 271.307 2.924 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)c1[O-] ZINC000529668257 383745302 /nfs/dbraw/zinc/74/53/02/383745302.db2.gz FJKXROFBJICCFH-INIZCTEOSA-N 0 3 274.408 2.807 20 10 CFCDHN C[C@@H]1CSCCN1Cc1ccc(N(C)C)cc1 ZINC000179660986 380568344 /nfs/dbraw/zinc/56/83/44/380568344.db2.gz CUISMPOEVHVMGD-GFCCVEGCSA-N 0 3 250.411 2.690 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC3(CC2)OCCO3)c1[O-] ZINC000179665794 380569044 /nfs/dbraw/zinc/56/90/44/380569044.db2.gz WAFRVTCVIHLHFX-UHFFFAOYSA-N 0 3 297.782 2.693 20 10 CFCDHN Cc1cccc(C[N@H+](C[C@@H]2CCOC2)C2CC2)c1[O-] ZINC000179678423 380570852 /nfs/dbraw/zinc/57/08/52/380570852.db2.gz XPHINFICBKRAQP-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c1[O-] ZINC000179678423 380570855 /nfs/dbraw/zinc/57/08/55/380570855.db2.gz XPHINFICBKRAQP-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN CCCC[N@H+](CCOC)Cc1cc(OC)ccc1[O-] ZINC000180189795 380630226 /nfs/dbraw/zinc/63/02/26/380630226.db2.gz DRENSFRHPVPAKW-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCC[N@@H+](CCOC)Cc1cc(OC)ccc1[O-] ZINC000180189795 380630233 /nfs/dbraw/zinc/63/02/33/380630233.db2.gz DRENSFRHPVPAKW-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CC(C)CO[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180273931 380642216 /nfs/dbraw/zinc/64/22/16/380642216.db2.gz BGVGYQUCDRCQHN-AWEZNQCLSA-N 0 3 267.344 2.778 20 10 CFCDHN CC(C)CO[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180273931 380642219 /nfs/dbraw/zinc/64/22/19/380642219.db2.gz BGVGYQUCDRCQHN-AWEZNQCLSA-N 0 3 267.344 2.778 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H]2CN2CCCC2)c1[O-] ZINC000179878157 380592364 /nfs/dbraw/zinc/59/23/64/380592364.db2.gz QIHNFNJZDVPQAU-INIZCTEOSA-N 0 3 274.408 2.761 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H]2CN2CCCC2)c1[O-] ZINC000179878157 380592368 /nfs/dbraw/zinc/59/23/68/380592368.db2.gz QIHNFNJZDVPQAU-INIZCTEOSA-N 0 3 274.408 2.761 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccccc1F)c1ccccc1[O-] ZINC000179890641 380593745 /nfs/dbraw/zinc/59/37/45/380593745.db2.gz CZVBXHWWIZCTQI-ZBEGNZNMSA-N 0 3 275.323 2.916 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000180172277 380627810 /nfs/dbraw/zinc/62/78/10/380627810.db2.gz LQCVIMUJMSQANP-GFCCVEGCSA-N 0 3 255.358 2.859 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2cc(F)ccc2[O-])CCS1 ZINC000180172277 380627817 /nfs/dbraw/zinc/62/78/17/380627817.db2.gz LQCVIMUJMSQANP-GFCCVEGCSA-N 0 3 255.358 2.859 20 10 CFCDHN COc1ccc(O)c(CN2CCc3c(cccc3OC)C2)c1 ZINC000180782381 380699868 /nfs/dbraw/zinc/69/98/68/380699868.db2.gz RWTOGWHWDMTBQX-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCCC[C@@H]2C[C@H](C)O)c1 ZINC000289270396 381027747 /nfs/dbraw/zinc/02/77/47/381027747.db2.gz GHWWIJRGMQDUOM-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c1 ZINC000289270396 381027755 /nfs/dbraw/zinc/02/77/55/381027755.db2.gz GHWWIJRGMQDUOM-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CN1[C@@H]2CC[C@H]1CC([N@H+](C)Cc1cc(F)ccc1[O-])C2 ZINC000289268669 381029474 /nfs/dbraw/zinc/02/94/74/381029474.db2.gz GDMXIGFPDPRBFW-YIONKMFJSA-N 0 3 278.371 2.588 20 10 CFCDHN CN1[C@@H]2CC[C@H]1CC([N@@H+](C)Cc1cc(F)ccc1[O-])C2 ZINC000289268669 381029481 /nfs/dbraw/zinc/02/94/81/381029481.db2.gz GDMXIGFPDPRBFW-YIONKMFJSA-N 0 3 278.371 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CC2CCC2)[C@@H](C)CO)c1 ZINC000289310048 381030881 /nfs/dbraw/zinc/03/08/81/381030881.db2.gz DPVRUYNYJQIRCZ-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CC2CCC2)[C@@H](C)CO)c1 ZINC000289310048 381030889 /nfs/dbraw/zinc/03/08/89/381030889.db2.gz DPVRUYNYJQIRCZ-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN CC[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000182440984 381089304 /nfs/dbraw/zinc/08/93/04/381089304.db2.gz RPJLCPIUMIMAFB-ZDUSSCGKSA-N 0 3 257.761 2.605 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+]Cc1cccc(C)c1[O-] ZINC000182461814 381093127 /nfs/dbraw/zinc/09/31/27/381093127.db2.gz UIFFGMCJPVTZQJ-GFCCVEGCSA-N 0 3 273.380 2.631 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@@H](O)c3ccccc3C2)c1 ZINC000368815833 381140976 /nfs/dbraw/zinc/14/09/76/381140976.db2.gz HNGGGQQLXAMVAS-GOSISDBHSA-N 0 3 299.370 2.840 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCN3CCCC[C@@H]13)CC2 ZINC000295967122 381186407 /nfs/dbraw/zinc/18/64/07/381186407.db2.gz MKGTZVNWKUWAAO-KFWWJZLASA-N 0 3 272.392 2.596 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)NC1CCCCC1)c1ccccc1[O-] ZINC000183434968 381270979 /nfs/dbraw/zinc/27/09/79/381270979.db2.gz OKENFFRTNMNBIZ-CYBMUJFWSA-N 0 3 290.407 2.882 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)cnn1C ZINC000296179854 381289574 /nfs/dbraw/zinc/28/95/74/381289574.db2.gz YALBKNTZGJIWEM-QMTHXVAHSA-N 0 3 271.364 2.772 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1[O-] ZINC000183544873 381286205 /nfs/dbraw/zinc/28/62/05/381286205.db2.gz NACKIHOXALDXRF-MJBXVCDLSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccccc1[O-] ZINC000183543822 381286366 /nfs/dbraw/zinc/28/63/66/381286366.db2.gz LDFBZFYDMKXVFI-VBNZEHGJSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CC(C)(C)O)c([O-])c1 ZINC000296281727 381331424 /nfs/dbraw/zinc/33/14/24/381331424.db2.gz FCHZQJUFUPGKHK-VXGBXAGGSA-N 0 3 251.370 2.901 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])C(C)C ZINC000296431239 381392541 /nfs/dbraw/zinc/39/25/41/381392541.db2.gz LVUBXORABNUUFE-BBRMVZONSA-N 0 3 292.423 2.854 20 10 CFCDHN Cc1ccc(O)c(CN(C)CCNC(=O)OC(C)(C)C)c1 ZINC000296438235 381395427 /nfs/dbraw/zinc/39/54/27/381395427.db2.gz FBMCFQIAECKAQJ-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@@H](OC)C2)c1O ZINC000184681155 381461261 /nfs/dbraw/zinc/46/12/61/381461261.db2.gz FURMOEOCMQTZGL-GFCCVEGCSA-N 0 3 285.771 2.665 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)CCCO)c1 ZINC000296662255 381497953 /nfs/dbraw/zinc/49/79/53/381497953.db2.gz ZXOVREROLOYBET-CHWSQXEVSA-N 0 3 251.370 2.760 20 10 CFCDHN CC1(C)[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)[C@@H]2CCO[C@H]21 ZINC000297965895 381576186 /nfs/dbraw/zinc/57/61/86/381576186.db2.gz ZPCGFIWRJNUONS-UAXWRAGISA-N 0 3 273.376 2.783 20 10 CFCDHN C[C@@H]([NH2+]CCNC(=O)OC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185267452 381582250 /nfs/dbraw/zinc/58/22/50/381582250.db2.gz PULLHKYCHQZWIH-SNVBAGLBSA-N 0 3 298.358 2.707 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCCCC[C@H]1O)CC2 ZINC000297236272 381555278 /nfs/dbraw/zinc/55/52/78/381555278.db2.gz IEJYGKISPRQHNR-HZSPNIEDSA-N 0 3 261.365 2.663 20 10 CFCDHN COCCC1(C)CN(Cc2cc(C)c(C)cc2O)C1 ZINC000297362319 381558581 /nfs/dbraw/zinc/55/85/81/381558581.db2.gz HOZCBXBLNKRJLK-UHFFFAOYSA-N 0 3 263.381 2.867 20 10 CFCDHN COCCC1(C)C[NH+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000297362319 381558584 /nfs/dbraw/zinc/55/85/84/381558584.db2.gz HOZCBXBLNKRJLK-UHFFFAOYSA-N 0 3 263.381 2.867 20 10 CFCDHN C[C@H](COCC(F)(F)F)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297710078 381569690 /nfs/dbraw/zinc/56/96/90/381569690.db2.gz MRWHBDKGNWFPRM-KOLCDFICSA-N 0 3 289.297 2.937 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)C2CCCCC2)c1 ZINC000185328026 381599400 /nfs/dbraw/zinc/59/94/00/381599400.db2.gz BCYDEWAGAJVANW-YVEFUNNKSA-N 0 3 293.407 2.993 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000185370883 381614980 /nfs/dbraw/zinc/61/49/80/381614980.db2.gz WMWFEDBGFNUVNH-DOMZBBRYSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccc(CO)c1)c1cc(F)ccc1[O-] ZINC000185373556 381615551 /nfs/dbraw/zinc/61/55/51/381615551.db2.gz XCAUPILGLTYAJM-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN CC(=O)N1CCC(C[NH2+][C@H](C)c2cc(C)ccc2[O-])CC1 ZINC000185377032 381617135 /nfs/dbraw/zinc/61/71/35/381617135.db2.gz OWRQMFLEYSSECD-CYBMUJFWSA-N 0 3 290.407 2.610 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185424602 381627471 /nfs/dbraw/zinc/62/74/71/381627471.db2.gz KSVNCHFEKGEDLZ-BZNIZROVSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[C@@H](C)O)c([O-])c1 ZINC000185521694 381656864 /nfs/dbraw/zinc/65/68/64/381656864.db2.gz PCEFRUCAGHUJDQ-YNEHKIRRSA-N 0 3 251.370 2.758 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000359897675 381665182 /nfs/dbraw/zinc/66/51/82/381665182.db2.gz KRDWTMWPMBPFGJ-CYBMUJFWSA-N 0 3 269.348 2.562 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000359897675 381665190 /nfs/dbraw/zinc/66/51/90/381665190.db2.gz KRDWTMWPMBPFGJ-CYBMUJFWSA-N 0 3 269.348 2.562 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000185653727 381693798 /nfs/dbraw/zinc/69/37/98/381693798.db2.gz CWFYVPFQJJGCJT-GXTWGEPZSA-N 0 3 289.350 2.958 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185656936 381695286 /nfs/dbraw/zinc/69/52/86/381695286.db2.gz RXVGGHWLHBYJCG-BLLLJJGKSA-N 0 3 277.408 2.939 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CC(=O)N(C(C)(C)C)C2)c([O-])c1 ZINC000186086269 381821052 /nfs/dbraw/zinc/82/10/52/381821052.db2.gz QOKMWOYDTCQNOU-CHWSQXEVSA-N 0 3 290.407 2.751 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cccc(C(N)=O)c1)c1ccccc1[O-] ZINC000186264630 381867288 /nfs/dbraw/zinc/86/72/88/381867288.db2.gz OVOOZCIFBDBHCD-MRXNPFEDSA-N 0 3 298.386 2.775 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)c1[O-] ZINC000372996343 381906534 /nfs/dbraw/zinc/90/65/34/381906534.db2.gz HYOZQTVYFHRPHY-OAHLLOKOSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](c3nccn3C)C2)c1[O-] ZINC000372996343 381906537 /nfs/dbraw/zinc/90/65/37/381906537.db2.gz HYOZQTVYFHRPHY-OAHLLOKOSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)cc1C ZINC000373244911 381960254 /nfs/dbraw/zinc/96/02/54/381960254.db2.gz LYOHSNCAJMAWDC-XJKSGUPXSA-N 0 3 261.365 2.620 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H]3OCC[C@H]3C2)cc1C ZINC000373244911 381960260 /nfs/dbraw/zinc/96/02/60/381960260.db2.gz LYOHSNCAJMAWDC-XJKSGUPXSA-N 0 3 261.365 2.620 20 10 CFCDHN CC[C@H]([NH2+]C1(CO)Cc2ccccc2C1)c1ccccc1[O-] ZINC000373454714 382007574 /nfs/dbraw/zinc/00/75/74/382007574.db2.gz SGMZLACSEYJJTB-KRWDZBQOSA-N 0 3 297.398 2.963 20 10 CFCDHN CSCCN1CC=C(c2ccc(N(C)C)cc2)C1 ZINC000374781870 382056384 /nfs/dbraw/zinc/05/63/84/382056384.db2.gz OKSKTLVMAKVYIN-UHFFFAOYSA-N 0 3 262.422 2.815 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCCCS(C)(=O)=O)c([O-])c1 ZINC000186852878 382030555 /nfs/dbraw/zinc/03/05/55/382030555.db2.gz XFDHBJCLTFSTJI-ZDUSSCGKSA-N 0 3 299.436 2.566 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@H+](Cc3cccc(C)c3[O-])C2)no1 ZINC000375841778 382105810 /nfs/dbraw/zinc/10/58/10/382105810.db2.gz OSVJATXLIPXOBU-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@@H+](Cc3cccc(C)c3[O-])C2)no1 ZINC000375841778 382105815 /nfs/dbraw/zinc/10/58/15/382105815.db2.gz OSVJATXLIPXOBU-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000375825887 382106599 /nfs/dbraw/zinc/10/65/99/382106599.db2.gz SYEFOOJLGQFIAK-ZBFHGGJFSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1 ZINC000375825887 382106604 /nfs/dbraw/zinc/10/66/04/382106604.db2.gz SYEFOOJLGQFIAK-ZBFHGGJFSA-N 0 3 277.364 2.544 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)c1[O-] ZINC000376043682 382117030 /nfs/dbraw/zinc/11/70/30/382117030.db2.gz QWBKMGBJMZUTGK-HNNXBMFYSA-N 0 3 281.783 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c1[O-] ZINC000376043682 382117035 /nfs/dbraw/zinc/11/70/35/382117035.db2.gz QWBKMGBJMZUTGK-HNNXBMFYSA-N 0 3 281.783 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@](O)(C3CC3)C2)c1[O-] ZINC000376043684 382117415 /nfs/dbraw/zinc/11/74/15/382117415.db2.gz QWBKMGBJMZUTGK-OAHLLOKOSA-N 0 3 281.783 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@](O)(C3CC3)C2)c1[O-] ZINC000376043684 382117422 /nfs/dbraw/zinc/11/74/22/382117422.db2.gz QWBKMGBJMZUTGK-OAHLLOKOSA-N 0 3 281.783 2.701 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c1 ZINC000187306258 382151823 /nfs/dbraw/zinc/15/18/23/382151823.db2.gz JENGNLPZQBTFGD-UOJODKQESA-N 0 3 277.364 2.619 20 10 CFCDHN CCC[C@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])OC ZINC000293622447 382201111 /nfs/dbraw/zinc/20/11/11/382201111.db2.gz IKURDQNCONDWDZ-ZYHUDNBSSA-N 0 3 255.333 2.997 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccccc1[O-] ZINC000377121139 382219402 /nfs/dbraw/zinc/21/94/02/382219402.db2.gz SNDFINURUGAIII-FZMZJTMJSA-N 0 3 271.364 2.854 20 10 CFCDHN COCC(C)(C)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000293672861 382225858 /nfs/dbraw/zinc/22/58/58/382225858.db2.gz MTTABUXBCMUBJP-LLVKDONJSA-N 0 3 267.369 2.724 20 10 CFCDHN COCC1(C[NH2+][C@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000293782581 382277563 /nfs/dbraw/zinc/27/75/63/382277563.db2.gz TYAPJSVRARNZGT-CQSZACIVSA-N 0 3 293.407 2.794 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C2(C(C)C)CC2)cc1OC ZINC000293791646 382281676 /nfs/dbraw/zinc/28/16/76/382281676.db2.gz ZWQFTXMSKXSFTF-UHFFFAOYSA-N 0 3 265.353 2.688 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCN2CCSCC2)c([O-])c1 ZINC000293809909 382288181 /nfs/dbraw/zinc/28/81/81/382288181.db2.gz RONNREMPSNQERX-CQSZACIVSA-N 0 3 294.464 2.708 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCC(=O)N(C)C)c([O-])c1 ZINC000293716113 382248154 /nfs/dbraw/zinc/24/81/54/382248154.db2.gz MFLPBILEBAARNZ-CYBMUJFWSA-N 0 3 278.396 2.528 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H](CO)C2CCCCC2)c1 ZINC000293734450 382256307 /nfs/dbraw/zinc/25/63/07/382256307.db2.gz VBZDFNXTELBEEQ-OAHLLOKOSA-N 0 3 293.407 2.679 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(Nc2cccnc2)CC1 ZINC000377621147 382303595 /nfs/dbraw/zinc/30/35/95/382303595.db2.gz AYCHYKNLJVTVBZ-UHFFFAOYSA-N 0 3 283.375 2.864 20 10 CFCDHN COc1ccncc1CN[C@@H](C)c1ccc(C)cc1O ZINC000293967804 382358396 /nfs/dbraw/zinc/35/83/96/382358396.db2.gz AOBJGAHNFONPOG-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](O)C23CCCC3)c1[O-] ZINC000293989699 382367523 /nfs/dbraw/zinc/36/75/23/382367523.db2.gz RYWOZUWIMBGFBA-CQSZACIVSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c1[O-] ZINC000293989699 382367525 /nfs/dbraw/zinc/36/75/25/382367525.db2.gz RYWOZUWIMBGFBA-CQSZACIVSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c1[O-] ZINC000294105923 382418419 /nfs/dbraw/zinc/41/84/19/382418419.db2.gz SJZOCHLLACXIBQ-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)c1[O-] ZINC000294105923 382418420 /nfs/dbraw/zinc/41/84/20/382418420.db2.gz SJZOCHLLACXIBQ-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(Oc3cnccn3)CC2)c1[O-] ZINC000365941432 382460067 /nfs/dbraw/zinc/46/00/67/382460067.db2.gz NZTAAIUXFBWUCK-UHFFFAOYSA-N 0 3 299.374 2.534 20 10 CFCDHN Cc1cccc(CN2CCC(Oc3cnccn3)CC2)c1O ZINC000365941432 382460071 /nfs/dbraw/zinc/46/00/71/382460071.db2.gz NZTAAIUXFBWUCK-UHFFFAOYSA-N 0 3 299.374 2.534 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C[C@H]21 ZINC000378472364 382467386 /nfs/dbraw/zinc/46/73/86/382467386.db2.gz IMPCXJHQZOXQMZ-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3cccc(Cl)c3[O-])C[C@H]21 ZINC000378472364 382467390 /nfs/dbraw/zinc/46/73/90/382467390.db2.gz IMPCXJHQZOXQMZ-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CCOC(=O)C1(C)CC[NH+](Cc2cccc(C)c2[O-])CC1 ZINC000378538959 382479699 /nfs/dbraw/zinc/47/96/99/382479699.db2.gz IBADRBNFAXHAFN-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN COc1ccncc1CN[C@H](C)c1cc(C)ccc1O ZINC000294432016 382512881 /nfs/dbraw/zinc/51/28/81/382512881.db2.gz UUZZSDZSYKFMOM-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](c3nccn3C)C2)cc1C ZINC000366814189 382551315 /nfs/dbraw/zinc/55/13/15/382551315.db2.gz KNDWESMHQULQGT-CQSZACIVSA-N 0 3 285.391 2.732 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](c3nccn3C)C2)cc1C ZINC000366814189 382551318 /nfs/dbraw/zinc/55/13/18/382551318.db2.gz KNDWESMHQULQGT-CQSZACIVSA-N 0 3 285.391 2.732 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@](C)(COC)C2)c1 ZINC000295186324 382579773 /nfs/dbraw/zinc/57/97/73/382579773.db2.gz WQSDAHYEFBVLKT-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@](C)(COC)C2)c1 ZINC000295186324 382579775 /nfs/dbraw/zinc/57/97/75/382579775.db2.gz WQSDAHYEFBVLKT-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2C[C@@H](O)C2(C)C)c1[O-] ZINC000189966061 382647743 /nfs/dbraw/zinc/64/77/43/382647743.db2.gz WKAMKWXIFMKFML-NWDGAFQWSA-N 0 3 269.772 2.603 20 10 CFCDHN CC[C@@H]([NH2+]CC1(C)OCCCO1)c1ccccc1[O-] ZINC000190639853 382676089 /nfs/dbraw/zinc/67/60/89/382676089.db2.gz VWIDWNRKYHOUNM-CYBMUJFWSA-N 0 3 265.353 2.586 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCSC[C@@H](C)C2)c1 ZINC000190850092 382682766 /nfs/dbraw/zinc/68/27/66/382682766.db2.gz JUYJBYXXYNKTGM-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCSC[C@@H](C)C2)c1 ZINC000190850092 382682768 /nfs/dbraw/zinc/68/27/68/382682768.db2.gz JUYJBYXXYNKTGM-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)C1CCCCC1 ZINC000190861042 382682994 /nfs/dbraw/zinc/68/29/94/382682994.db2.gz YLVALZCIWOJMBE-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)C1CCCCC1 ZINC000190861042 382682995 /nfs/dbraw/zinc/68/29/95/382682995.db2.gz YLVALZCIWOJMBE-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN COCCC1CC[NH+](Cc2cc(OC)c(C)cc2[O-])CC1 ZINC000530095127 383764600 /nfs/dbraw/zinc/76/46/00/383764600.db2.gz LWQXNSWBDFPJST-UHFFFAOYSA-N 0 3 293.407 2.958 20 10 CFCDHN Cc1cc(Cl)cc(CN[C@@H]2CC[NH2+]C23CCC3)c1[O-] ZINC000530179457 383767714 /nfs/dbraw/zinc/76/77/14/383767714.db2.gz YDLWDBWBNRDJBY-CYBMUJFWSA-N 0 3 280.799 2.728 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@@H]2CC[NH2+]C23CCC3)c([O-])c1 ZINC000530217051 383768666 /nfs/dbraw/zinc/76/86/66/383768666.db2.gz SBESJRYVFALFCG-IUODEOHRSA-N 0 3 260.381 2.636 20 10 CFCDHN CCCOc1ccc(C[NH2+]Cc2ccn(C)c2)c([O-])c1 ZINC000267147481 384308395 /nfs/dbraw/zinc/30/83/95/384308395.db2.gz ZDMSDWIPBSBESX-UHFFFAOYSA-N 0 3 274.364 2.809 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)CC2CCC2)c1 ZINC000281186858 385186185 /nfs/dbraw/zinc/18/61/85/385186185.db2.gz QZONLSLGPXDLIP-GXTWGEPZSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCCSC)c1 ZINC000281188313 385187145 /nfs/dbraw/zinc/18/71/45/385187145.db2.gz IFBSYFFNNDRTJH-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCCSC)c1 ZINC000281188313 385187149 /nfs/dbraw/zinc/18/71/49/385187149.db2.gz IFBSYFFNNDRTJH-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)CC2CCC2)c1 ZINC000281186875 385187247 /nfs/dbraw/zinc/18/72/47/385187247.db2.gz QZONLSLGPXDLIP-TZMCWYRMSA-N 0 3 263.381 2.902 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H]1CCCCNC1=O ZINC000282564317 385343273 /nfs/dbraw/zinc/34/32/73/385343273.db2.gz YWVIQSBXECFVQE-HNNXBMFYSA-N 0 3 290.407 2.663 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H]1CCCCNC1=O ZINC000282564317 385343275 /nfs/dbraw/zinc/34/32/75/385343275.db2.gz YWVIQSBXECFVQE-HNNXBMFYSA-N 0 3 290.407 2.663 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000271197283 385371813 /nfs/dbraw/zinc/37/18/13/385371813.db2.gz RUOFBPVMMQQVRG-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000271197283 385371815 /nfs/dbraw/zinc/37/18/15/385371815.db2.gz RUOFBPVMMQQVRG-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000271197284 385371891 /nfs/dbraw/zinc/37/18/91/385371891.db2.gz RUOFBPVMMQQVRG-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000271197284 385371895 /nfs/dbraw/zinc/37/18/95/385371895.db2.gz RUOFBPVMMQQVRG-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000271218060 385377836 /nfs/dbraw/zinc/37/78/36/385377836.db2.gz FMBGMDXCJBUEJZ-OCCSQVGLSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H]2COC3(CCCC3)O2)cc1C ZINC000271473693 385384570 /nfs/dbraw/zinc/38/45/70/385384570.db2.gz WDZJKYBMTJMHJX-OAHLLOKOSA-N 0 3 291.391 2.784 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H]2CSC2(C)C)c1[O-] ZINC000282843910 385399350 /nfs/dbraw/zinc/39/93/50/385399350.db2.gz PBAYKNXEESTSNY-LBPRGKRZSA-N 0 3 267.394 2.775 20 10 CFCDHN CC(C)[C@H](O)C1(CNCc2ccc(N(C)C)c(F)c2)CC1 ZINC000271955043 385410316 /nfs/dbraw/zinc/41/03/16/385410316.db2.gz DYXRUHRBZVIDHH-INIZCTEOSA-N 0 3 294.414 2.778 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CSC2(C)C)c1 ZINC000282970453 385417767 /nfs/dbraw/zinc/41/77/67/385417767.db2.gz DCZSNCLVSLORBD-RNCFNFMXSA-N 0 3 267.394 2.945 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC2(O)CCC2)c([O-])c1 ZINC000283866851 385509486 /nfs/dbraw/zinc/50/94/86/385509486.db2.gz DZNWHAXZSJSGCH-ZDUSSCGKSA-N 0 3 263.381 2.965 20 10 CFCDHN CC(C)[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000272682446 385588358 /nfs/dbraw/zinc/58/83/58/385588358.db2.gz VQJSZNZGMXNJIY-DZGCQCFKSA-N 0 3 267.344 2.825 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(CCCO)CC1 ZINC000272828421 385626431 /nfs/dbraw/zinc/62/64/31/385626431.db2.gz DXTRJCFOWCPPBG-UHFFFAOYSA-N 0 3 267.344 2.516 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](O)CCc2ccccc2)c1[O-] ZINC000273245722 385675773 /nfs/dbraw/zinc/67/57/73/385675773.db2.gz ZMRQCRQZRXNOJJ-KRWDZBQOSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1ccc([C@@H](C)NCc2ccnn2C)c(O)c1C ZINC000273440118 385682357 /nfs/dbraw/zinc/68/23/57/385682357.db2.gz YCGJXGWBGNJOMI-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)c2cnn(C)c2)c([O-])c1 ZINC000273462955 385684490 /nfs/dbraw/zinc/68/44/90/385684490.db2.gz DCUMPTLFJAZLMG-NEPJUHHUSA-N 0 3 259.353 2.846 20 10 CFCDHN CCn1cc(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])cn1 ZINC000273456518 385684540 /nfs/dbraw/zinc/68/45/40/385684540.db2.gz HCBWYRPIBJJZGU-JTQLQIEISA-N 0 3 263.316 2.599 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOc2ncccc2F)c([O-])c1 ZINC000273477779 385685176 /nfs/dbraw/zinc/68/51/76/385685176.db2.gz LDJNNYTTYHLFQF-GFCCVEGCSA-N 0 3 290.338 2.964 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273513131 385686341 /nfs/dbraw/zinc/68/63/41/385686341.db2.gz SDMYCKUDGIHIQY-CYBMUJFWSA-N 0 3 292.423 2.822 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@]2(N(C)C)CCSC2)c1 ZINC000273585273 385689527 /nfs/dbraw/zinc/68/95/27/385689527.db2.gz NSLMSSMIUBFAOH-CJNGLKHVSA-N 0 3 294.464 2.789 20 10 CFCDHN CN1C(=O)CCc2cc(C[NH2+]Cc3ccccc3[O-])ccc21 ZINC000274620498 385835759 /nfs/dbraw/zinc/83/57/59/385835759.db2.gz RPFKJOPRNUJGJW-UHFFFAOYSA-N 0 3 296.370 2.591 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CO)C1CCCC1)CC2 ZINC000297183882 285270693 /nfs/dbraw/zinc/27/06/93/285270693.db2.gz DZYSETMLEJXKQK-ZIAGYGMSSA-N 0 3 261.365 2.520 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@]2(CCCCO2)C1 ZINC000364804006 285398457 /nfs/dbraw/zinc/39/84/57/285398457.db2.gz CTQAVHPLIPTTQU-INIZCTEOSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@]2(CCCCO2)C1 ZINC000364804006 285398460 /nfs/dbraw/zinc/39/84/60/285398460.db2.gz CTQAVHPLIPTTQU-INIZCTEOSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000282734140 285398514 /nfs/dbraw/zinc/39/85/14/285398514.db2.gz RCZRLZMOKIAHJV-HNNXBMFYSA-N 0 3 261.365 2.831 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245584747 285398647 /nfs/dbraw/zinc/39/86/47/285398647.db2.gz DCSMWMGYDVSDDP-YOEHRIQHSA-N 0 3 286.419 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245584747 285398649 /nfs/dbraw/zinc/39/86/49/285398649.db2.gz DCSMWMGYDVSDDP-YOEHRIQHSA-N 0 3 286.419 2.841 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000296596608 533524357 /nfs/dbraw/zinc/52/43/57/533524357.db2.gz VIZXAYSMSMYBNT-NOZJJQNGSA-N 0 3 253.317 2.749 20 10 CFCDHN CCn1cc([C@@H](C)NCc2ccc3c(c2)CCN3C)cn1 ZINC000372422324 393448685 /nfs/dbraw/zinc/44/86/85/393448685.db2.gz PIRICEWBHRFGGG-CYBMUJFWSA-N 0 3 284.407 2.746 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@H](n2cncn2)C1 ZINC000372479975 393449854 /nfs/dbraw/zinc/44/98/54/393449854.db2.gz CWNMADKDTYATTB-CQSZACIVSA-N 0 3 294.358 2.584 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@H](n2cncn2)C1 ZINC000372479975 393449863 /nfs/dbraw/zinc/44/98/63/393449863.db2.gz CWNMADKDTYATTB-CQSZACIVSA-N 0 3 294.358 2.584 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2ccccc2OC)c1 ZINC000224496300 393766580 /nfs/dbraw/zinc/76/65/80/393766580.db2.gz BLUAOWUCFMTBEH-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN C[N@H+](CCc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000120798870 393940815 /nfs/dbraw/zinc/94/08/15/393940815.db2.gz UCIQTNVTTOIVPP-UHFFFAOYSA-N 0 3 260.312 2.601 20 10 CFCDHN C[N@@H+](CCc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000120798870 393940817 /nfs/dbraw/zinc/94/08/17/393940817.db2.gz UCIQTNVTTOIVPP-UHFFFAOYSA-N 0 3 260.312 2.601 20 10 CFCDHN CC[C@@H]([NH2+]CCCN(C)C)c1ccc(F)cc1[O-] ZINC000285748860 394146371 /nfs/dbraw/zinc/14/63/71/394146371.db2.gz RMAZJTUPJMMWNY-CYBMUJFWSA-N 0 3 254.349 2.524 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@]23CCOC3)cc1F ZINC000367047695 394250631 /nfs/dbraw/zinc/25/06/31/394250631.db2.gz LSTIVWOXJRCTRW-MRXNPFEDSA-N 0 3 278.371 2.647 20 10 CFCDHN CCn1cc([C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000295879848 394304450 /nfs/dbraw/zinc/30/44/50/394304450.db2.gz GXWAHYREPQDZMN-SMDDNHRTSA-N 0 3 271.364 2.947 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(CO)CC3(CCC3)C1)CC2 ZINC000296339973 394307877 /nfs/dbraw/zinc/30/78/77/394307877.db2.gz GXCRUDPNYOSDGK-CQSZACIVSA-N 0 3 287.403 2.912 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](c2ccco2)N(C)C)c1[O-] ZINC000158073454 394354075 /nfs/dbraw/zinc/35/40/75/394354075.db2.gz HKZIBNBEGKFJHF-AWEZNQCLSA-N 0 3 274.364 2.686 20 10 CFCDHN CCOc1cccc(C[NH2+]CC[C@@H]2CCCOC2)c1[O-] ZINC000527740762 394402740 /nfs/dbraw/zinc/40/27/40/394402740.db2.gz VCRKAYUCIBPSDV-ZDUSSCGKSA-N 0 3 279.380 2.697 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1[O-] ZINC000529668162 394418686 /nfs/dbraw/zinc/41/86/86/394418686.db2.gz DMBRFBAPABTOOP-RBQUTUCGSA-N 0 3 299.798 2.956 20 10 CFCDHN COc1cc(O)c(CN2CCS[C@@H](C)[C@@H]2C)cc1OC ZINC000160217744 286239011 /nfs/dbraw/zinc/23/90/11/286239011.db2.gz AJMGIBMFMAUNIC-QWRGUYRKSA-N 0 3 297.420 2.735 20 10 CFCDHN CN(C)c1ccc(CNC[C@H](c2ccco2)N(C)C)cc1 ZINC000020122048 171002012 /nfs/dbraw/zinc/00/20/12/171002012.db2.gz IOWDXEIYYBAPJF-MRXNPFEDSA-N 0 3 287.407 2.738 20 10 CFCDHN COc1cccc(C[NH2+]Cc2cccc(C)c2)c1[O-] ZINC000020134051 171021720 /nfs/dbraw/zinc/02/17/20/171021720.db2.gz MDBPORAKSYUSSD-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1c([C@H](C)NCc2ccc(N(C)C)cc2)cnn1C ZINC000020351426 171156104 /nfs/dbraw/zinc/15/61/04/171156104.db2.gz MDWSTASHDDJZIL-LBPRGKRZSA-N 0 3 272.396 2.645 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2cnn(C)c2C)cc1C ZINC000035274591 172095821 /nfs/dbraw/zinc/09/58/21/172095821.db2.gz XNMHZUAYUGYGBG-LBPRGKRZSA-N 0 3 273.380 2.896 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCO[C@@H]2CCC[C@H]21 ZINC000371527822 261295184 /nfs/dbraw/zinc/29/51/84/261295184.db2.gz JDBIWHSUVXRTCF-UKRRQHHQSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCO[C@@H]2CCC[C@H]21 ZINC000371527822 261295186 /nfs/dbraw/zinc/29/51/86/261295186.db2.gz JDBIWHSUVXRTCF-UKRRQHHQSA-N 0 3 265.328 2.675 20 10 CFCDHN C[C@H]([NH2+]Cc1cccc(-n2cncn2)c1)c1ccccc1[O-] ZINC000367783371 267117239 /nfs/dbraw/zinc/11/72/39/267117239.db2.gz LNLWBJPFGABBOE-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]1C(=O)NC1CC1 ZINC000368021527 267136500 /nfs/dbraw/zinc/13/65/00/267136500.db2.gz ZFAXRJIBHNAAJN-HUUCEWRRSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]1C(=O)NC1CC1 ZINC000368021527 267136504 /nfs/dbraw/zinc/13/65/04/267136504.db2.gz ZFAXRJIBHNAAJN-HUUCEWRRSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@](O)(C2CC2)C1 ZINC000368035886 267138688 /nfs/dbraw/zinc/13/86/88/267138688.db2.gz HEOGJLIIEAJLIT-GOEBONIOSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@](O)(C2CC2)C1 ZINC000368035886 267138692 /nfs/dbraw/zinc/13/86/92/267138692.db2.gz HEOGJLIIEAJLIT-GOEBONIOSA-N 0 3 261.365 2.690 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134236 267147521 /nfs/dbraw/zinc/14/75/21/267147521.db2.gz LLPMLSGQUXHGMR-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134236 267147523 /nfs/dbraw/zinc/14/75/23/267147523.db2.gz LLPMLSGQUXHGMR-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN Cc1c([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[O-])cnn1C ZINC000368461256 267173867 /nfs/dbraw/zinc/17/38/67/267173867.db2.gz HSJPZZPSVQKNER-HNNXBMFYSA-N 0 3 289.354 2.910 20 10 CFCDHN Cc1c([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[O-])cnn1C ZINC000368461256 267173870 /nfs/dbraw/zinc/17/38/70/267173870.db2.gz HSJPZZPSVQKNER-HNNXBMFYSA-N 0 3 289.354 2.910 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[NH+]1CCC(n2cncn2)CC1 ZINC000369594947 267253176 /nfs/dbraw/zinc/25/31/76/267253176.db2.gz AOUVWHBMOOQLID-HNNXBMFYSA-N 0 3 286.379 2.772 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1C[C@@H](CO)c2ccccc21 ZINC000370392374 267315684 /nfs/dbraw/zinc/31/56/84/267315684.db2.gz YLKJCOMWIKQZKE-BLLLJJGKSA-N 0 3 287.334 2.842 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1C[C@H](CO)c2ccccc21 ZINC000370392376 267315874 /nfs/dbraw/zinc/31/58/74/267315874.db2.gz YLKJCOMWIKQZKE-MLGOLLRUSA-N 0 3 287.334 2.842 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c([O-])c1 ZINC000370394568 267315939 /nfs/dbraw/zinc/31/59/39/267315939.db2.gz FRPBQFCZYBQJPT-AAEUAGOBSA-N 0 3 271.364 2.632 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000370723367 267342023 /nfs/dbraw/zinc/34/20/23/267342023.db2.gz VLOLMGFUNLOHKF-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000370723367 267342025 /nfs/dbraw/zinc/34/20/25/267342025.db2.gz VLOLMGFUNLOHKF-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC(c3cn[nH]c3)CC2)c1 ZINC000371420200 267402548 /nfs/dbraw/zinc/40/25/48/267402548.db2.gz ZBAWCWJUJLCIMM-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1 ZINC000374158016 267755899 /nfs/dbraw/zinc/75/58/99/267755899.db2.gz JPLNKTYVIMNFTI-FVQBIDKESA-N 0 3 275.392 2.994 20 10 CFCDHN COCCOCCC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293278748 277536182 /nfs/dbraw/zinc/53/61/82/277536182.db2.gz CRAAYSIWNPSKOH-CQSZACIVSA-N 0 3 281.396 2.713 20 10 CFCDHN COc1cc(C[NH2+][C@H]2CCc3cccc([O-])c32)ccn1 ZINC000296066644 277819969 /nfs/dbraw/zinc/81/99/69/277819969.db2.gz RXQKJXZAXLZKQU-ZDUSSCGKSA-N 0 3 270.332 2.573 20 10 CFCDHN COc1ccncc1CN[C@H]1CCc2cccc(O)c21 ZINC000297311617 278069432 /nfs/dbraw/zinc/06/94/32/278069432.db2.gz MWMGPEPKYVFBRB-ZDUSSCGKSA-N 0 3 270.332 2.573 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296634882 279372610 /nfs/dbraw/zinc/37/26/10/279372610.db2.gz BPQOUEJUTGRXLU-TZMCWYRMSA-N 0 3 262.397 2.698 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1c3ccccc3C[C@@H]1O)CC2 ZINC000295771426 280454578 /nfs/dbraw/zinc/45/45/78/280454578.db2.gz AHEAWXPBPQQZEN-QILLFSRXSA-N 0 3 281.355 2.627 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496058 290014066 /nfs/dbraw/zinc/01/40/66/290014066.db2.gz PBLFQZZTJISEJK-TVQRCGJNSA-N 0 3 275.327 2.983 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2cccc(OC)c2[O-])C1 ZINC000375096188 329000314 /nfs/dbraw/zinc/00/03/14/329000314.db2.gz CNZXYUPDFXTYSB-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2cccc(OC)c2[O-])C1 ZINC000375096188 329000315 /nfs/dbraw/zinc/00/03/15/329000315.db2.gz CNZXYUPDFXTYSB-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1ccc(CC[NH2+]Cc2cc(C)c(C)cc2[O-])cn1 ZINC000527793399 330283655 /nfs/dbraw/zinc/28/36/55/330283655.db2.gz KAJILHVXGLUHSU-UHFFFAOYSA-N 0 3 286.375 2.745 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1 ZINC000527803918 330284253 /nfs/dbraw/zinc/28/42/53/330284253.db2.gz LOUOATAXJUPAKT-YRORDHRNSA-N 0 3 279.380 2.692 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1 ZINC000527803917 330284285 /nfs/dbraw/zinc/28/42/85/330284285.db2.gz LOUOATAXJUPAKT-YMEQNVIZSA-N 0 3 279.380 2.692 20 10 CFCDHN C[C@H]([NH2+]CC[C@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000527934407 330297831 /nfs/dbraw/zinc/29/78/31/330297831.db2.gz WSLFMUSRWQDRHJ-NWDGAFQWSA-N 0 3 267.344 2.999 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)CC2 ZINC000527998415 330299720 /nfs/dbraw/zinc/29/97/20/330299720.db2.gz CTUIXGQTCZGIKZ-CVEARBPZSA-N 0 3 286.419 2.986 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000527976801 330302129 /nfs/dbraw/zinc/30/21/29/330302129.db2.gz GBBHJOZQFKRIGR-VQISRLSMSA-N 0 3 265.353 2.619 20 10 CFCDHN C[C@H]([NH2+]CC1COC1)c1cc2c(cc1[O-])CCCC2 ZINC000528024166 330304877 /nfs/dbraw/zinc/30/48/77/330304877.db2.gz HNVQWBZJBJJJBZ-NSHDSACASA-N 0 3 261.365 2.568 20 10 CFCDHN COc1ccc(CNC[C@H](O)c2ccsc2)cc1C ZINC000219101789 333141590 /nfs/dbraw/zinc/14/15/90/333141590.db2.gz LXHMONSVDVVADE-AWEZNQCLSA-N 0 3 277.389 2.888 20 10 CFCDHN CCCN(CC)C[C@@H](C)[NH2+]Cc1ccccc1[O-] ZINC000289728118 521612075 /nfs/dbraw/zinc/61/20/75/521612075.db2.gz VDMDSAOAIYJLJD-CYBMUJFWSA-N 0 3 250.386 2.602 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)C2)c1[O-] ZINC000228631131 522536674 /nfs/dbraw/zinc/53/66/74/522536674.db2.gz BKHMYFSKILIIRF-SECBINFHSA-N 0 3 255.745 2.896 20 10 CFCDHN CCOCC[N@H+](CC)Cc1cccc(OCC)c1[O-] ZINC000156022941 519909171 /nfs/dbraw/zinc/90/91/71/519909171.db2.gz OIFIGGSMUMRCIE-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1cccc(OCC)c1[O-] ZINC000156022941 519909175 /nfs/dbraw/zinc/90/91/75/519909175.db2.gz OIFIGGSMUMRCIE-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H](C)CCCO)c([O-])c1 ZINC000294668607 520367000 /nfs/dbraw/zinc/36/70/00/520367000.db2.gz APVBZUHRVCQORP-CYBMUJFWSA-N 0 3 281.396 2.679 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](CO)C2CCCC2)c([O-])c1 ZINC000289481935 520375776 /nfs/dbraw/zinc/37/57/76/520375776.db2.gz FLLHESUYIFZRLU-MRXNPFEDSA-N 0 3 293.407 2.822 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2[O-])[C@]12CCCO2 ZINC000274251220 520437304 /nfs/dbraw/zinc/43/73/04/520437304.db2.gz SHWAVSXJTPZENF-VJUNAUMWSA-N 0 3 291.391 2.769 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000279994240 520858424 /nfs/dbraw/zinc/85/84/24/520858424.db2.gz FNHCVLOXAONZDY-OLZOCXBDSA-N 0 3 250.386 2.773 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cn(C)nc2C)cc1 ZINC000157697409 520908043 /nfs/dbraw/zinc/90/80/43/520908043.db2.gz QKZBXSKOMCBDFD-UHFFFAOYSA-N 0 3 286.423 2.865 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000230661838 520938803 /nfs/dbraw/zinc/93/88/03/520938803.db2.gz NLQPDWVQBAQYAC-IUODEOHRSA-N 0 3 251.370 2.902 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(O)CCCCC2)c1[O-] ZINC000060366862 521362924 /nfs/dbraw/zinc/36/29/24/521362924.db2.gz KLGSDKKXIBDICQ-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2cccnc2)c1[O-] ZINC000037717728 521364325 /nfs/dbraw/zinc/36/43/25/521364325.db2.gz HFKRSDRFYCPKGE-UHFFFAOYSA-N 0 3 272.348 2.518 20 10 CFCDHN CCCN(CC(=O)N[C@H](C)CC)Cc1ccccc1O ZINC000170779349 521548290 /nfs/dbraw/zinc/54/82/90/521548290.db2.gz MYZOAFOBHBHVMN-CYBMUJFWSA-N 0 3 278.396 2.519 20 10 CFCDHN CCN1CCC([NH2+]Cc2cc(Cl)cc(OC)c2[O-])CC1 ZINC000228669352 521581525 /nfs/dbraw/zinc/58/15/25/521581525.db2.gz PPFUGWHKFFDFHL-UHFFFAOYSA-N 0 3 298.814 2.628 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N(CC)CC ZINC000174373504 521690797 /nfs/dbraw/zinc/69/07/97/521690797.db2.gz HSKGBIYZJSFXJI-CQSZACIVSA-N 0 3 292.423 2.861 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N(CC)CC ZINC000174373504 521690799 /nfs/dbraw/zinc/69/07/99/521690799.db2.gz HSKGBIYZJSFXJI-CQSZACIVSA-N 0 3 292.423 2.861 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCO[C@H]2C2CC2)cc1F ZINC000371206326 522212057 /nfs/dbraw/zinc/21/20/57/522212057.db2.gz FTMYNHGYNAPRBM-ZBFHGGJFSA-N 0 3 278.371 2.549 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)C2)c1[O-] ZINC000228631131 522536667 /nfs/dbraw/zinc/53/66/67/522536667.db2.gz BKHMYFSKILIIRF-SECBINFHSA-N 0 3 255.745 2.896 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCSC2)c1[O-] ZINC000228551565 522540141 /nfs/dbraw/zinc/54/01/41/522540141.db2.gz GBCXHZAHHXYYLQ-VIFPVBQESA-N 0 3 287.812 2.897 20 10 CFCDHN CC[C@H]([NH2+]CC1(C(N)=O)CCCC1)c1ccc(C)cc1[O-] ZINC000280270980 522569308 /nfs/dbraw/zinc/56/93/08/522569308.db2.gz XXTWSFVCYOYHCF-AWEZNQCLSA-N 0 3 290.407 2.787 20 10 CFCDHN CC[C@H]([NH2+]CCCN(C)C)c1ccc(C)cc1[O-] ZINC000279975626 522580191 /nfs/dbraw/zinc/58/01/91/522580191.db2.gz DFXASEJZPDJRMV-AWEZNQCLSA-N 0 3 250.386 2.693 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000293269754 522607564 /nfs/dbraw/zinc/60/75/64/522607564.db2.gz CIWDGTPCUYYRDA-HIFRSBDPSA-N 0 3 264.413 2.939 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CC[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000280134084 522732787 /nfs/dbraw/zinc/73/27/87/522732787.db2.gz PDGLRMXBUBLSEQ-SPKLELGKSA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@H](CO)SC)c1ccc(C)cc1[O-] ZINC000280206005 522736886 /nfs/dbraw/zinc/73/68/86/522736886.db2.gz TVYNXYUDDBYSMP-ZLDLUXBVSA-N 0 3 283.437 2.854 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@@H](O)C1(C)C)c1ccc(C)cc1[O-] ZINC000280009237 522761381 /nfs/dbraw/zinc/76/13/81/522761381.db2.gz GOOWJROULRDSLB-AEGPPILISA-N 0 3 263.381 2.901 20 10 CFCDHN COc1cc(O)c(CN2CCC(CF)CC2)cc1OC ZINC000295062705 522774196 /nfs/dbraw/zinc/77/41/96/522774196.db2.gz OLLWRKXOZRRFNZ-UHFFFAOYSA-N 0 3 283.343 2.591 20 10 CFCDHN COc1cc([O-])c(C[NH+]2CCC(CF)CC2)cc1OC ZINC000295062705 522774207 /nfs/dbraw/zinc/77/42/07/522774207.db2.gz OLLWRKXOZRRFNZ-UHFFFAOYSA-N 0 3 283.343 2.591 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)n(C)c1=O)c1ccccc1[O-] ZINC000279412855 522873901 /nfs/dbraw/zinc/87/39/01/522873901.db2.gz DZFLXOSRXLACRX-OAHLLOKOSA-N 0 3 286.375 2.640 20 10 CFCDHN COCc1ccccc1C[NH2+]Cc1cc(OC)ccc1[O-] ZINC000037762751 523104528 /nfs/dbraw/zinc/10/45/28/523104528.db2.gz LFHMENUHLRNDLB-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COCc1ccccc1CNCc1cc(OC)ccc1O ZINC000037762751 523104537 /nfs/dbraw/zinc/10/45/37/523104537.db2.gz LFHMENUHLRNDLB-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN CCn1cc([C@@H](C)[NH2+]Cc2cc(F)ccc2[O-])cn1 ZINC000294792472 523456226 /nfs/dbraw/zinc/45/62/26/523456226.db2.gz HRLJMBXLYALPRL-SNVBAGLBSA-N 0 3 263.316 2.599 20 10 CFCDHN CO[C@@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000280368739 523808283 /nfs/dbraw/zinc/80/82/83/523808283.db2.gz VANKYDIRNFQNCC-INIZCTEOSA-N 0 3 293.363 2.512 20 10 CFCDHN CO[C@@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000280368739 523808290 /nfs/dbraw/zinc/80/82/90/523808290.db2.gz VANKYDIRNFQNCC-INIZCTEOSA-N 0 3 293.363 2.512 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000228183467 523857280 /nfs/dbraw/zinc/85/72/80/523857280.db2.gz CHXVLGSODXCNKG-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000228183467 523857282 /nfs/dbraw/zinc/85/72/82/523857282.db2.gz CHXVLGSODXCNKG-SWLSCSKDSA-N 0 3 294.826 2.962 20 10 CFCDHN COc1ccc(CC[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000226582782 523975552 /nfs/dbraw/zinc/97/55/52/523975552.db2.gz VNULQSSTNAKLBP-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN CO[C@](C)(C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000291358754 524027529 /nfs/dbraw/zinc/02/75/29/524027529.db2.gz XVOKPWVPLDWTFB-ZUZCIYMTSA-N 0 3 267.344 2.997 20 10 CFCDHN C[C@H]1CCC[C@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000044418162 524208580 /nfs/dbraw/zinc/20/85/80/524208580.db2.gz DZTPNOBOHRGNRR-JQWIXIFHSA-N 0 3 263.337 2.789 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C)c1[O-] ZINC000227685537 524434435 /nfs/dbraw/zinc/43/44/35/524434435.db2.gz IFYGIQQJNXYEMG-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C)CNC(=O)OC(C)(C)C)c1[O-] ZINC000227685542 524438059 /nfs/dbraw/zinc/43/80/59/524438059.db2.gz IFYGIQQJNXYEMG-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1nccs1 ZINC000230693708 524487077 /nfs/dbraw/zinc/48/70/77/524487077.db2.gz OITINHSCJUQQPC-SECBINFHSA-N 0 3 266.341 2.881 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1ccccc1[O-])CN1CCCC1 ZINC000062077560 524500273 /nfs/dbraw/zinc/50/02/73/524500273.db2.gz DOPAMAJBKGHAMK-ZIAGYGMSSA-N 0 3 262.397 2.775 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+][C@@H](C)c2ccccc2[O-])n1 ZINC000167431915 524524562 /nfs/dbraw/zinc/52/45/62/524524562.db2.gz JPXPZJLWWGHFPP-AWEZNQCLSA-N 0 3 273.380 2.946 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c1 ZINC000290059490 524752059 /nfs/dbraw/zinc/75/20/59/524752059.db2.gz FDAHPQKNUTXBHD-YVEFUNNKSA-N 0 3 287.359 2.613 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc3c(n2)CCCC3)c1 ZINC000278779803 524753884 /nfs/dbraw/zinc/75/38/84/524753884.db2.gz VMUAXAAISJIOGF-UHFFFAOYSA-N 0 3 298.386 2.964 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@H](OC)CC2)c1 ZINC000364986506 524760026 /nfs/dbraw/zinc/76/00/26/524760026.db2.gz SVZVQMSLIXEZLI-OLZOCXBDSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@H](OC)CC2)c1 ZINC000364986506 524760034 /nfs/dbraw/zinc/76/00/34/524760034.db2.gz SVZVQMSLIXEZLI-OLZOCXBDSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(N(C)C)CCCC2)c1 ZINC000160672240 524760393 /nfs/dbraw/zinc/76/03/93/524760393.db2.gz VTYXOTCZMBZKHH-CYBMUJFWSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@](C)(OC)C2CC2)c1 ZINC000291370594 524762501 /nfs/dbraw/zinc/76/25/01/524762501.db2.gz YSJLZXSXDMGNNU-BZNIZROVSA-N 0 3 279.380 2.867 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C(C)C)C(C)(C)O)c1 ZINC000276610805 524765389 /nfs/dbraw/zinc/76/53/89/524765389.db2.gz CJPCGEHBGRYDPP-ABAIWWIYSA-N 0 3 281.396 2.847 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)C(C)(C)C)c1[O-] ZINC000194632092 524874893 /nfs/dbraw/zinc/87/48/93/524874893.db2.gz MRZXDZHPDJDHQL-GFCCVEGCSA-N 0 3 271.788 2.851 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H](O)Cc2ccccc2)cc1C ZINC000290160577 525322143 /nfs/dbraw/zinc/32/21/43/525322143.db2.gz PZPQHTRJLAMZJV-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@H]3CCCC[C@H]32)c1 ZINC000228155591 525342223 /nfs/dbraw/zinc/34/22/23/525342223.db2.gz DMNLGKQUXJUQGJ-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCC[C@H](C)CO)c1 ZINC000230669689 525359100 /nfs/dbraw/zinc/35/91/00/525359100.db2.gz UXZAJFGWFSURGK-QWHCGFSZSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2([S@](C)=O)CCC2)c1 ZINC000281067636 525361787 /nfs/dbraw/zinc/36/17/87/525361787.db2.gz NWHPFXFGRXRAQK-BUXKBTBVSA-N 0 3 281.421 2.652 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccsc1)c1cc(F)ccc1[O-] ZINC000185514014 525380492 /nfs/dbraw/zinc/38/04/92/525380492.db2.gz XUZLNUDEYYMRRJ-LKFCYVNXSA-N 0 3 281.352 2.977 20 10 CFCDHN C[C@H](NCc1ccn(C)c1)c1ccc(N(C)C)cc1 ZINC000158484493 525467283 /nfs/dbraw/zinc/46/72/83/525467283.db2.gz FDSHMBJDJLZRMO-ZDUSSCGKSA-N 0 3 257.381 2.942 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cc(F)ccc1[O-] ZINC000094617932 525479477 /nfs/dbraw/zinc/47/94/77/525479477.db2.gz DKNLKIIHQDKCBT-PWSUYJOCSA-N 0 3 253.317 2.751 20 10 CFCDHN C[C@@H]1[N@H+](Cc2cc(F)ccc2[O-])CCC12CCOCC2 ZINC000364942430 525546234 /nfs/dbraw/zinc/54/62/34/525546234.db2.gz MVGUJHOQMDIWFK-LBPRGKRZSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@@H]1[N@@H+](Cc2cc(F)ccc2[O-])CCC12CCOCC2 ZINC000364942430 525546246 /nfs/dbraw/zinc/54/62/46/525546246.db2.gz MVGUJHOQMDIWFK-LBPRGKRZSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000062999530 525626141 /nfs/dbraw/zinc/62/61/41/525626141.db2.gz XNEKQJUDDODELO-DOMZBBRYSA-N 0 3 257.333 2.776 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCc2cnn(C)c2)c([O-])c1 ZINC000185313308 525724692 /nfs/dbraw/zinc/72/46/92/525724692.db2.gz NBEPCMLREKOZOA-CYBMUJFWSA-N 0 3 273.380 2.718 20 10 CFCDHN Cc1c([C@@H](C)NCc2cc(C)ccc2O)cnn1C ZINC000071407980 525897155 /nfs/dbraw/zinc/89/71/55/525897155.db2.gz RBAQJFCWPKEPHO-LLVKDONJSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@@H](C)O)c([O-])c1C ZINC000278895028 525921063 /nfs/dbraw/zinc/92/10/63/525921063.db2.gz UIIRHONUOPFMLU-YPMHNXCESA-N 0 3 251.370 2.821 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290296577 525939001 /nfs/dbraw/zinc/93/90/01/525939001.db2.gz AWRHFWIPWMVZTM-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290296577 525939009 /nfs/dbraw/zinc/93/90/09/525939009.db2.gz AWRHFWIPWMVZTM-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2ccccc2[O-])cc1 ZINC000237791480 525976388 /nfs/dbraw/zinc/97/63/88/525976388.db2.gz OGRVVUOYSUDLEQ-MRXNPFEDSA-N 0 3 257.333 2.524 20 10 CFCDHN COc1cccc(CNCc2cn(C(C)C)nc2C)c1O ZINC000289550812 526026734 /nfs/dbraw/zinc/02/67/34/526026734.db2.gz XPUDHUWMYBWHOB-UHFFFAOYSA-N 0 3 289.379 2.776 20 10 CFCDHN COc1cccc(CN[C@H](C)c2cc(C)ccn2)c1O ZINC000289565922 526037531 /nfs/dbraw/zinc/03/75/31/526037531.db2.gz ZFZXYINKAYGAHD-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC3(CCC3)[C@H]1C1CC1)OCO2 ZINC000291616583 526334564 /nfs/dbraw/zinc/33/45/64/526334564.db2.gz RJUPMWJIMLGQCC-MRXNPFEDSA-N 0 3 287.359 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC3(CCC3)[C@H]1C1CC1)OCO2 ZINC000291616583 526334569 /nfs/dbraw/zinc/33/45/69/526334569.db2.gz RJUPMWJIMLGQCC-MRXNPFEDSA-N 0 3 287.359 2.885 20 10 CFCDHN Oc1cc2c(cc1CN1CC3(CCC3)[C@H]1C1CC1)OCO2 ZINC000291616583 526334575 /nfs/dbraw/zinc/33/45/75/526334575.db2.gz RJUPMWJIMLGQCC-MRXNPFEDSA-N 0 3 287.359 2.885 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000292881599 526349810 /nfs/dbraw/zinc/34/98/10/526349810.db2.gz XSMBXLCHWZYWEF-AWEZNQCLSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000292881599 526349816 /nfs/dbraw/zinc/34/98/16/526349816.db2.gz XSMBXLCHWZYWEF-AWEZNQCLSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCCSC1 ZINC000290062565 526350143 /nfs/dbraw/zinc/35/01/43/526350143.db2.gz FHUQYTUFLKZTLF-JTQLQIEISA-N 0 3 255.358 2.764 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000290828441 526372150 /nfs/dbraw/zinc/37/21/50/526372150.db2.gz HIKWKMOFTDTTPQ-CVEARBPZSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000290828441 526372154 /nfs/dbraw/zinc/37/21/54/526372154.db2.gz HIKWKMOFTDTTPQ-CVEARBPZSA-N 0 3 273.376 2.926 20 10 CFCDHN Cc1nnsc1CN[C@H](C)c1cc(C)ccc1O ZINC000293285382 526449049 /nfs/dbraw/zinc/44/90/49/526449049.db2.gz DAUKAQOYIAEIJB-SECBINFHSA-N 0 3 263.366 2.711 20 10 CFCDHN CCN(CC)c1ccc(CNCCOCC(F)F)cc1 ZINC000190897597 528307933 /nfs/dbraw/zinc/30/79/33/528307933.db2.gz UXJSXGKRPCKZGE-UHFFFAOYSA-N 0 3 286.366 2.904 20 10 CFCDHN COc1ccc(N2CCN(CCC3CC3)CC2)cc1F ZINC000753857112 574051763 /nfs/dbraw/zinc/05/17/63/574051763.db2.gz KKHOFIVQHVZPGV-UHFFFAOYSA-N 0 3 278.371 2.756 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](OC)C(C)C)c([O-])c1 ZINC000744448349 574075288 /nfs/dbraw/zinc/07/52/88/574075288.db2.gz IIYDTSGWXSUUOO-OAHLLOKOSA-N 0 3 267.369 2.552 20 10 CFCDHN CC[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H](C)O1 ZINC000732185174 574145537 /nfs/dbraw/zinc/14/55/37/574145537.db2.gz LSAPXOGHYBHKFY-BLLLJJGKSA-N 0 3 275.392 2.880 20 10 CFCDHN C[C@@H]1CCC[C@](CNC(=O)c2cc([O-])cs2)([NH+](C)C)C1 ZINC000732276435 574149599 /nfs/dbraw/zinc/14/95/99/574149599.db2.gz KBWVQWUTNBBCBD-ABAIWWIYSA-N 0 3 296.436 2.694 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCN(C)C[C@H]2C(C)C)cc1C ZINC000738284627 574163047 /nfs/dbraw/zinc/16/30/47/574163047.db2.gz BFZDPRQXZRNMDJ-INIZCTEOSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCN(C)C[C@H]2C(C)C)cc1C ZINC000738284627 574163049 /nfs/dbraw/zinc/16/30/49/574163049.db2.gz BFZDPRQXZRNMDJ-INIZCTEOSA-N 0 3 276.424 2.781 20 10 CFCDHN CN(C)c1ccc(CNCCOC(C)(C)C)cc1F ZINC000733326163 574221862 /nfs/dbraw/zinc/22/18/62/574221862.db2.gz LSFPGFBACHHTAS-UHFFFAOYSA-N 0 3 268.376 2.796 20 10 CFCDHN COC[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756339752 574226461 /nfs/dbraw/zinc/22/64/61/574226461.db2.gz FYMPKTKJFPFAGR-ATZCPNFKSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCCN(C)C)c2c1c(F)ccc2[O-] ZINC000756342550 574227276 /nfs/dbraw/zinc/22/72/76/574227276.db2.gz KOXPZVASGJFXGB-ZYHUDNBSSA-N 0 3 266.360 2.621 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C2CCN(C)CC2)c2c1c(F)ccc2[O-] ZINC000756364599 574229717 /nfs/dbraw/zinc/22/97/17/574229717.db2.gz VEYUKARVBMBWQR-MFKMUULPSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H]([NH2+]C[C@H](C1CC1)N(C)C)c1cc(F)ccc1[O-] ZINC000756433955 574236460 /nfs/dbraw/zinc/23/64/60/574236460.db2.gz ROUPDHJHWGTGFB-IINYFYTJSA-N 0 3 266.360 2.522 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCN2CCCCC2=O)c1 ZINC000756555702 574246855 /nfs/dbraw/zinc/24/68/55/574246855.db2.gz LSWBPZFFSDUYLT-CQSZACIVSA-N 0 3 290.407 2.754 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOc2cccnc2)c([O-])c1 ZINC000756572292 574249152 /nfs/dbraw/zinc/24/91/52/574249152.db2.gz MLZPJSULHYFLFN-ZDUSSCGKSA-N 0 3 272.348 2.825 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@@H]2CCCO2)c([O-])c1C ZINC000756582242 574250517 /nfs/dbraw/zinc/25/05/17/574250517.db2.gz HMGUIAFKKHGFML-GJZGRUSLSA-N 0 3 293.407 2.855 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756603634 574251872 /nfs/dbraw/zinc/25/18/72/574251872.db2.gz JESAZDZQPOHDHH-SCVCMEIPSA-N 0 3 299.411 2.783 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)C[C@H]2CCOC2)c1 ZINC000756644960 574255454 /nfs/dbraw/zinc/25/54/54/574255454.db2.gz DJNCGFTTWAZOOC-FRRDWIJNSA-N 0 3 279.380 2.867 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2cnccn2)c2c1c(F)ccc2[O-] ZINC000756785978 574262728 /nfs/dbraw/zinc/26/27/28/574262728.db2.gz HKEQNTDVIOWRQO-GXFFZTMASA-N 0 3 287.338 2.702 20 10 CFCDHN C[C@H]([NH2+]CC1=CCN(C)CC1)c1cc(F)cc(F)c1[O-] ZINC000756790752 574263471 /nfs/dbraw/zinc/26/34/71/574263471.db2.gz OZFQBSHOHYBIKO-JTQLQIEISA-N 0 3 282.334 2.583 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)C(C)(C)O)c([O-])c1C ZINC000756819126 574265215 /nfs/dbraw/zinc/26/52/15/574265215.db2.gz QLCLAUMTAAWHRP-VXGBXAGGSA-N 0 3 251.370 2.819 20 10 CFCDHN COCC1([NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)CC1 ZINC000756852142 574268635 /nfs/dbraw/zinc/26/86/35/574268635.db2.gz YMRAHCCZVSLHRL-KOLCDFICSA-N 0 3 265.328 2.848 20 10 CFCDHN CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1cc(C)ccc1[O-] ZINC000743499676 574307349 /nfs/dbraw/zinc/30/73/49/574307349.db2.gz OHWIPFHDPWJLOU-OCCSQVGLSA-N 0 3 251.370 2.587 20 10 CFCDHN COc1ccc(CNC(C)(C)c2cnn(C)c2)cc1C ZINC000742374441 574325546 /nfs/dbraw/zinc/32/55/46/574325546.db2.gz YDJNDLLWPFDBOE-UHFFFAOYSA-N 0 3 273.380 2.762 20 10 CFCDHN CN(C)c1ccc(CNCCOC2CCC2)cc1F ZINC000742385454 574326804 /nfs/dbraw/zinc/32/68/04/574326804.db2.gz CZAAYBNLONSSML-UHFFFAOYSA-N 0 3 266.360 2.550 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000725845113 574327489 /nfs/dbraw/zinc/32/74/89/574327489.db2.gz LQAVESZNPSGVNV-UHFFFAOYSA-N 0 3 293.370 2.927 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1COCCO1 ZINC000725846636 574327973 /nfs/dbraw/zinc/32/79/73/574327973.db2.gz JYMQEUBUHBEWON-KRWDZBQOSA-N 0 3 299.370 2.564 20 10 CFCDHN CCOc1cccc(CNCc2ccoc2C)c1O ZINC000725848847 574329088 /nfs/dbraw/zinc/32/90/88/574329088.db2.gz LQYDLODIKVQSNO-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN COc1ccc(C[N@H+](C(C)C)C2CC2)c([O-])c1OC ZINC000891663422 617700674 /nfs/dbraw/zinc/70/06/74/617700674.db2.gz YUCXFKWYZDAGRH-UHFFFAOYSA-N 0 3 265.353 2.782 20 10 CFCDHN COc1ccc(C[N@@H+](C(C)C)C2CC2)c([O-])c1OC ZINC000891663422 617700677 /nfs/dbraw/zinc/70/06/77/617700677.db2.gz YUCXFKWYZDAGRH-UHFFFAOYSA-N 0 3 265.353 2.782 20 10 CFCDHN COc1ccc(C[N@H+](C)CC(C)(C)C)c([O-])c1OC ZINC000891749464 617738707 /nfs/dbraw/zinc/73/87/07/617738707.db2.gz YOXITYBSLWNXSE-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN COc1ccc(C[N@@H+](C)CC(C)(C)C)c([O-])c1OC ZINC000891749464 617738708 /nfs/dbraw/zinc/73/87/08/617738708.db2.gz YOXITYBSLWNXSE-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN COc1cc(O)c(CN2C[C@@H](C)S[C@H](C)C2)cc1OC ZINC000160301478 617965017 /nfs/dbraw/zinc/96/50/17/617965017.db2.gz DOWFYRMGQBGPCF-GHMZBOCLSA-N 0 3 297.420 2.735 20 10 CFCDHN COC(OC)[C@@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC000079584947 617999318 /nfs/dbraw/zinc/99/93/18/617999318.db2.gz CGRRNHOANSDEFB-CQSZACIVSA-N 0 3 292.423 2.774 20 10 CFCDHN CCn1cc([C@H](C)NCc2ccc(N(C)C)cc2)cn1 ZINC000044495345 618027958 /nfs/dbraw/zinc/02/79/58/618027958.db2.gz YXTAOPRKOJPLEM-ZDUSSCGKSA-N 0 3 272.396 2.820 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(C)(C)S(C)(=O)=O)c([O-])c1 ZINC000840877009 618223770 /nfs/dbraw/zinc/22/37/70/618223770.db2.gz RBFIOCIZZOJYTM-LBPRGKRZSA-N 0 3 299.436 2.565 20 10 CFCDHN Cc1ccc(CN2CCc3nc[nH]c3C23CCC3)c(O)c1 ZINC000895068573 618254473 /nfs/dbraw/zinc/25/44/73/618254473.db2.gz GHXDPKHAMBCYPK-UHFFFAOYSA-N 0 3 283.375 2.861 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCO)CSC)c1ccc(C)cc1[O-] ZINC000794802381 618456542 /nfs/dbraw/zinc/45/65/42/618456542.db2.gz NMPVZABVRSKVQU-OCCSQVGLSA-N 0 3 283.437 2.855 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@H]2CC(C)=NO2)cc1F ZINC000895307555 618527706 /nfs/dbraw/zinc/52/77/06/618527706.db2.gz BKWNPUBRVKEYEJ-CQSZACIVSA-N 0 3 293.386 2.926 20 10 CFCDHN COC1([C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)CCC1 ZINC000840883927 618646660 /nfs/dbraw/zinc/64/66/60/618646660.db2.gz HKIJJXRAXYOCQI-AAEUAGOBSA-N 0 3 261.365 2.927 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)CCC1 ZINC000840883934 618647668 /nfs/dbraw/zinc/64/76/68/618647668.db2.gz HKIJJXRAXYOCQI-YPMHNXCESA-N 0 3 261.365 2.927 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccc(OC)n2)c1 ZINC000182325467 625285360 /nfs/dbraw/zinc/28/53/60/625285360.db2.gz TVHJJDUVDOEHSC-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1Cc3ccccc3O1)CC2 ZINC000314577978 618849845 /nfs/dbraw/zinc/84/98/45/618849845.db2.gz RIHHFIIQKGHENG-GJZGRUSLSA-N 0 3 281.355 2.973 20 10 CFCDHN C[C@@H](NCCCSc1nccs1)c1nccn1C ZINC000182993049 618902496 /nfs/dbraw/zinc/90/24/96/618902496.db2.gz PJKVFYJHUILHND-SNVBAGLBSA-N 0 3 282.438 2.710 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOCC1CCCC1 ZINC000313259114 618978157 /nfs/dbraw/zinc/97/81/57/618978157.db2.gz YNCBVZBQVSSCQH-UHFFFAOYSA-N 0 3 267.344 2.828 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(CO)CCCC2)c1[O-] ZINC000185207409 619069324 /nfs/dbraw/zinc/06/93/24/619069324.db2.gz IPCWBIMEYKWRTD-UHFFFAOYSA-N 0 3 299.798 2.697 20 10 CFCDHN C[C@@H](C[N@H+](C)Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000223832701 619133705 /nfs/dbraw/zinc/13/37/05/619133705.db2.gz VTAZLMORMYMPST-LBPRGKRZSA-N 0 3 294.395 2.737 20 10 CFCDHN C[C@@H](C[N@@H+](C)Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000223832701 619133706 /nfs/dbraw/zinc/13/37/06/619133706.db2.gz VTAZLMORMYMPST-LBPRGKRZSA-N 0 3 294.395 2.737 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)NCc1ccn(C)n1 ZINC000840975230 619200443 /nfs/dbraw/zinc/20/04/43/619200443.db2.gz DYFCDSHTMPCPQN-AWEZNQCLSA-N 0 3 286.423 2.515 20 10 CFCDHN Cc1noc2ncc(CNCc3ccc4c(c3)CCO4)cc12 ZINC000894212493 619264657 /nfs/dbraw/zinc/26/46/57/619264657.db2.gz CQRHVYRKAYWWLS-UHFFFAOYSA-N 0 3 295.342 2.756 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895845779 619621012 /nfs/dbraw/zinc/62/10/12/619621012.db2.gz IZXNGQJOKZODDL-XHDPSFHLSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895845779 619621016 /nfs/dbraw/zinc/62/10/16/619621016.db2.gz IZXNGQJOKZODDL-XHDPSFHLSA-N 0 3 265.328 2.532 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H](OC)CC[C@H]2C)c([O-])c1 ZINC000895947002 619639088 /nfs/dbraw/zinc/63/90/88/619639088.db2.gz ZWDDRORHNMOYRF-DOMZBBRYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H](OC)CC[C@H]2C)c([O-])c1 ZINC000895947002 619639090 /nfs/dbraw/zinc/63/90/90/619639090.db2.gz ZWDDRORHNMOYRF-DOMZBBRYSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(c3ccccc3)C[C@@H](O)C2)c([O-])c1 ZINC000896450481 619737000 /nfs/dbraw/zinc/73/70/00/619737000.db2.gz PRTDFCNLLXRIJL-UAPYVXQJSA-N 0 3 297.398 2.883 20 10 CFCDHN Cc1ccc(NCC[NH2+]Cc2ccc(C)cc2[O-])nc1 ZINC000897179473 619945224 /nfs/dbraw/zinc/94/52/24/619945224.db2.gz JITFEWGODLVISM-UHFFFAOYSA-N 0 3 271.364 2.606 20 10 CFCDHN COC[C@H]([NH2+]Cc1cc(Cl)cc(OC)c1[O-])C(C)C ZINC000228674579 620072763 /nfs/dbraw/zinc/07/27/63/620072763.db2.gz LCKDZFCXCZGJPD-LBPRGKRZSA-N 0 3 287.787 2.815 20 10 CFCDHN Cc1ccc(C[NH2+][C@]23C[C@H]2COC32CCC2)c([O-])c1 ZINC000897388108 620090377 /nfs/dbraw/zinc/09/03/77/620090377.db2.gz ULVBYOLXKCGEIG-XJKSGUPXSA-N 0 3 259.349 2.502 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)Cc2cccnc2)c([O-])c1 ZINC000897970214 620305836 /nfs/dbraw/zinc/30/58/36/620305836.db2.gz QRDUTWOITYIXGI-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000311028073 620345306 /nfs/dbraw/zinc/34/53/06/620345306.db2.gz DMOGAWGCYGAQJL-STQMWFEESA-N 0 3 250.386 2.772 20 10 CFCDHN CC[C@@](C)(C[NH2+][C@H](C)c1cc(F)ccc1[O-])OC ZINC000322839719 620392686 /nfs/dbraw/zinc/39/26/86/620392686.db2.gz FJSMNRIESZWDLX-YGRLFVJLSA-N 0 3 255.333 2.997 20 10 CFCDHN COC(=O)C1CCC([NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000898610529 620483521 /nfs/dbraw/zinc/48/35/21/620483521.db2.gz LEDSYWZKSOBMOT-UHFFFAOYSA-N 0 3 277.364 2.522 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1NCCc2ccccc21 ZINC000841069467 620495301 /nfs/dbraw/zinc/49/53/01/620495301.db2.gz XAZUXNPOHNXWAE-MRXNPFEDSA-N 0 3 286.350 2.508 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N)CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC000902406097 621055057 /nfs/dbraw/zinc/05/50/57/621055057.db2.gz LJRMDWXAZOZBFN-LLVKDONJSA-N 0 3 288.313 2.943 20 10 CFCDHN CC[C@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cccc(Cl)c1[O-] ZINC000902464010 621097757 /nfs/dbraw/zinc/09/77/57/621097757.db2.gz CENQQXRZQLGOPF-OLRMPSLUSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1N2)c1cccc(Cl)c1[O-] ZINC000902464010 621097760 /nfs/dbraw/zinc/09/77/60/621097760.db2.gz CENQQXRZQLGOPF-OLRMPSLUSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1COCC[C@H]1OC)c1ccc(C)cc1[O-] ZINC000903300167 621314573 /nfs/dbraw/zinc/31/45/73/621314573.db2.gz WHULBALTCZJOSS-IIAWOOMASA-N 0 3 279.380 2.545 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCN(C)[C@H]2C)c2c1c(F)ccc2[O-] ZINC000903301580 621315570 /nfs/dbraw/zinc/31/55/70/621315570.db2.gz SBFDROLFZXWHSR-URBCHYCLSA-N 0 3 278.371 2.762 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CO)CCc1ccccc1)CC2 ZINC000903287077 621318324 /nfs/dbraw/zinc/31/83/24/621318324.db2.gz BFDAYESCLCEZMJ-DLBZAZTESA-N 0 3 297.398 2.963 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C2CC(CCO)C2)c2c1c(F)ccc2[O-] ZINC000903328730 621340050 /nfs/dbraw/zinc/34/00/50/621340050.db2.gz FCVXEVOMXFVOLH-HHISKICNSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1ncccc1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000903415893 621366176 /nfs/dbraw/zinc/36/61/76/621366176.db2.gz NNORFTMOPHCYOP-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2COC[C@@H]2C2CC2)c([O-])c1 ZINC000903436548 621374140 /nfs/dbraw/zinc/37/41/40/621374140.db2.gz JVESIZGRAGKEQF-GLQYFDAESA-N 0 3 261.365 2.776 20 10 CFCDHN CN(C)c1ccc(CNCc2cnn3ccccc23)cc1 ZINC000071372740 625506448 /nfs/dbraw/zinc/50/64/48/625506448.db2.gz IUJWTDXRJDKPRV-UHFFFAOYSA-N 0 3 280.375 2.690 20 10 CFCDHN C[C@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1cc([O-])cs1 ZINC000912808438 622778459 /nfs/dbraw/zinc/77/84/59/622778459.db2.gz YRRHPBMDCACRJF-YPMHNXCESA-N 0 3 296.436 2.646 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000044685415 622939845 /nfs/dbraw/zinc/93/98/45/622939845.db2.gz RPKRBMKUHODIJN-QWHCGFSZSA-N 0 3 260.381 2.588 20 10 CFCDHN C[C@@H]([NH2+]CCCCn1ccnc1)c1ccccc1[O-] ZINC000045105517 622965318 /nfs/dbraw/zinc/96/53/18/622965318.db2.gz YVEVFZNBQKBBQX-CYBMUJFWSA-N 0 3 259.353 2.720 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000045691067 623012748 /nfs/dbraw/zinc/01/27/48/623012748.db2.gz LSBLTJCQVIXVFD-CHWSQXEVSA-N 0 3 250.386 2.773 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1Cc2ccccc2O1 ZINC000226583860 623083542 /nfs/dbraw/zinc/08/35/42/623083542.db2.gz PVTWOLSPCXAXTC-AWEZNQCLSA-N 0 3 273.307 2.625 20 10 CFCDHN CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000226585827 623084167 /nfs/dbraw/zinc/08/41/67/623084167.db2.gz ZHZUSKYNQXWFRA-HNNXBMFYSA-N 0 3 291.370 2.932 20 10 CFCDHN CCc1nn(C)cc1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000168661998 623098939 /nfs/dbraw/zinc/09/89/39/623098939.db2.gz XABCRXKUIPKBFP-NSHDSACASA-N 0 3 259.353 2.539 20 10 CFCDHN CO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000227374233 623108669 /nfs/dbraw/zinc/10/86/69/623108669.db2.gz YKPUDASUWAVHST-MRCXROJRSA-N 0 3 253.317 2.749 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)c([O-])c1 ZINC000822476717 623112301 /nfs/dbraw/zinc/11/23/01/623112301.db2.gz UMUVYECJADGZAA-UWOLEIRVSA-N 0 3 291.391 2.694 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2CCC(O)CC2)c1[O-] ZINC000227638197 623114617 /nfs/dbraw/zinc/11/46/17/623114617.db2.gz TZMRLPFZIDQGPG-UHFFFAOYSA-N 0 3 299.798 2.695 20 10 CFCDHN CCOc1ccc(CN2CC(CC(F)F)C2)c(O)c1 ZINC000822520854 623121069 /nfs/dbraw/zinc/12/10/69/623121069.db2.gz QDCBQADYYLRVRD-UHFFFAOYSA-N 0 3 271.307 2.878 20 10 CFCDHN CCOc1ccc(C[NH+]2CC(CC(F)F)C2)c([O-])c1 ZINC000822520854 623121073 /nfs/dbraw/zinc/12/10/73/623121073.db2.gz QDCBQADYYLRVRD-UHFFFAOYSA-N 0 3 271.307 2.878 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2CCC2)c1[O-] ZINC000228672514 623155850 /nfs/dbraw/zinc/15/58/50/623155850.db2.gz DDXKXBDDFUNONW-UHFFFAOYSA-N 0 3 255.745 2.944 20 10 CFCDHN CC(C)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000228970005 623171840 /nfs/dbraw/zinc/17/18/40/623171840.db2.gz JFHLVDPOUUKUAY-ZIAGYGMSSA-N 0 3 291.439 2.564 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1c([O-])cccc1OC)OC ZINC000824597703 623529955 /nfs/dbraw/zinc/52/99/55/623529955.db2.gz WVMZFLARQDFPMU-NHYWBVRUSA-N 0 3 267.369 2.552 20 10 CFCDHN CC[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637182 623537573 /nfs/dbraw/zinc/53/75/73/623537573.db2.gz WNWBHONHRHDVMG-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637182 623537579 /nfs/dbraw/zinc/53/75/79/623537579.db2.gz WNWBHONHRHDVMG-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@H](CO)c1ccccc1 ZINC000824697190 623546541 /nfs/dbraw/zinc/54/65/41/623546541.db2.gz ZRZABTLQETUNAK-OAHLLOKOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@H](CO)c1ccccc1 ZINC000824697190 623546551 /nfs/dbraw/zinc/54/65/51/623546551.db2.gz ZRZABTLQETUNAK-OAHLLOKOSA-N 0 3 275.323 2.697 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](OC)[C@@H](C)C2)c([O-])c1 ZINC000824814863 623570810 /nfs/dbraw/zinc/57/08/10/623570810.db2.gz GBCYMQIBSSYPPN-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](OC)[C@@H](C)C2)c([O-])c1 ZINC000824814863 623570817 /nfs/dbraw/zinc/57/08/17/623570817.db2.gz GBCYMQIBSSYPPN-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C(C)C)[C@@H](CO)C(C)C ZINC000824846420 623576000 /nfs/dbraw/zinc/57/60/00/623576000.db2.gz RRARTVHYPHUQRM-WMLDXEAASA-N 0 3 295.423 2.780 20 10 CFCDHN CC(C)[C@@H](CO)[C@@H]([NH2+]Cc1ccccc1[O-])C(C)C ZINC000824847261 623577338 /nfs/dbraw/zinc/57/73/38/623577338.db2.gz XMTCBVJSEJXYPW-ZBFHGGJFSA-N 0 3 265.397 2.771 20 10 CFCDHN COc1ccc(O)c(CN2CCOCC23CCCCC3)c1 ZINC000825099020 623629301 /nfs/dbraw/zinc/62/93/01/623629301.db2.gz RQRZVCGDSZTEGU-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2C[C@@H](OC)C23CCC3)c1[O-] ZINC000825103376 623630057 /nfs/dbraw/zinc/63/00/57/623630057.db2.gz DGLDPIOSOZQLQL-HUUCEWRRSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2C[C@@H](OC)C23CCC3)c1[O-] ZINC000825103376 623630062 /nfs/dbraw/zinc/63/00/62/623630062.db2.gz DGLDPIOSOZQLQL-HUUCEWRRSA-N 0 3 291.391 2.790 20 10 CFCDHN CO[C@H]1C[C@H]([N@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103978 623630617 /nfs/dbraw/zinc/63/06/17/623630617.db2.gz JNLZRGDJSWQDPP-GJZGRUSLSA-N 0 3 279.355 2.921 20 10 CFCDHN CO[C@H]1C[C@H]([N@@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103978 623630624 /nfs/dbraw/zinc/63/06/24/623630624.db2.gz JNLZRGDJSWQDPP-GJZGRUSLSA-N 0 3 279.355 2.921 20 10 CFCDHN COC[C@H]1CCCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000825294165 623665680 /nfs/dbraw/zinc/66/56/80/623665680.db2.gz IMHINDKZNPLBIU-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN CN(C)c1ccc(CN2CC(C)(C)[C@@H]3COC[C@@H]32)cc1F ZINC000825331331 623674532 /nfs/dbraw/zinc/67/45/32/623674532.db2.gz DOUOWILFINMUDG-CJNGLKHVSA-N 0 3 292.398 2.749 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)C1CC1 ZINC000324174176 623729649 /nfs/dbraw/zinc/72/96/49/623729649.db2.gz WANWTNYRRMKCQR-HNNXBMFYSA-N 0 3 263.337 2.645 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC2=CCCOC2)c([O-])c1 ZINC000827184645 623961372 /nfs/dbraw/zinc/96/13/72/623961372.db2.gz DHGGRLDLPISXDF-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC2=CCCOC2)c([O-])c1 ZINC000827184645 623961376 /nfs/dbraw/zinc/96/13/76/623961376.db2.gz DHGGRLDLPISXDF-UHFFFAOYSA-N 0 3 277.364 2.569 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H]3COC[C@]3(C)C2)c1[O-] ZINC000827285074 623980948 /nfs/dbraw/zinc/98/09/48/623980948.db2.gz XVCYVKBKYLBAMA-WFASDCNBSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1[O-] ZINC000827285074 623980952 /nfs/dbraw/zinc/98/09/52/623980952.db2.gz XVCYVKBKYLBAMA-WFASDCNBSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H](O)C23CCC3)c1[O-] ZINC000827365061 623993820 /nfs/dbraw/zinc/99/38/20/623993820.db2.gz JIZMUEJABXHQEF-OLZOCXBDSA-N 0 3 281.783 2.747 20 10 CFCDHN CC1(C)[C@H](C[NH2+]Cc2cc(F)ccc2[O-])C1(F)F ZINC000827515503 624021647 /nfs/dbraw/zinc/02/16/47/624021647.db2.gz KDDHJNGCLCTCKJ-NSHDSACASA-N 0 3 259.271 2.912 20 10 CFCDHN CCN(CC)c1ccc(CNC2(COC)CC2)cc1F ZINC000765270242 624067729 /nfs/dbraw/zinc/06/77/29/624067729.db2.gz KYBIDCILFXRUQV-UHFFFAOYSA-N 0 3 280.387 2.941 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000827751926 624085933 /nfs/dbraw/zinc/08/59/33/624085933.db2.gz YVLKULSLRWEPJZ-ZBFHGGJFSA-N 0 3 295.354 2.743 20 10 CFCDHN [O-]c1ccccc1C[N@H+](C[C@@H]1COCCO1)C1CCCC1 ZINC000827813361 624099759 /nfs/dbraw/zinc/09/97/59/624099759.db2.gz PUGKPGRYLFREFA-MRXNPFEDSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](C[C@@H]1COCCO1)C1CCCC1 ZINC000827813361 624099761 /nfs/dbraw/zinc/09/97/61/624099761.db2.gz PUGKPGRYLFREFA-MRXNPFEDSA-N 0 3 291.391 2.552 20 10 CFCDHN C[C@@H](O)[C@@H]([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000827855357 624111995 /nfs/dbraw/zinc/11/19/95/624111995.db2.gz BJHMQKXRQSXUET-BDJLRTHQSA-N 0 3 275.323 2.743 20 10 CFCDHN Cc1ncc2c(n1)CC[C@@H]([NH2+][C@@H]1CCc3cccc([O-])c31)C2 ZINC000834508473 625699470 /nfs/dbraw/zinc/69/94/70/625699470.db2.gz MUTLNENHEAZSIZ-GDBMZVCRSA-N 0 3 295.386 2.625 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCN1Cc3ccccc3C1)CC2 ZINC000834540717 625705991 /nfs/dbraw/zinc/70/59/91/625705991.db2.gz GSDLCLOEUKNCKC-KRWDZBQOSA-N 0 3 294.398 2.985 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](CO)Cc1ccccc1)CC2 ZINC000834531315 625703125 /nfs/dbraw/zinc/70/31/25/625703125.db2.gz VUOFQRZLMQHDNB-RDJZCZTQSA-N 0 3 297.398 2.820 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccnc1N(C)C)c1ccccc1[O-] ZINC000154050205 624255272 /nfs/dbraw/zinc/25/52/72/624255272.db2.gz WBPGOUIJLWACLA-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2cncc(F)c2)c1 ZINC000089725880 624328013 /nfs/dbraw/zinc/32/80/13/624328013.db2.gz BWECSRNBIYZPCJ-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N(C)Cc1ccccc1)c1ccccc1[O-] ZINC000179889300 624982829 /nfs/dbraw/zinc/98/28/29/624982829.db2.gz JWACFWNTLXWJNP-AWEZNQCLSA-N 0 3 298.386 2.701 20 10 CFCDHN Oc1cccc2c1[C@H](NCc1cccc(F)n1)CC2 ZINC000834689230 625786728 /nfs/dbraw/zinc/78/67/28/625786728.db2.gz KMPHDTMZZIYRPZ-GFCCVEGCSA-N 0 3 258.296 2.703 20 10 CFCDHN CO[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834702683 625791388 /nfs/dbraw/zinc/79/13/88/625791388.db2.gz SHVJABSJDANKDX-VNHYZAJKSA-N 0 3 261.365 2.784 20 10 CFCDHN CO[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834722691 625803285 /nfs/dbraw/zinc/80/32/85/625803285.db2.gz XYECWFFVBQNTMP-MWLCHTKSSA-N 0 3 275.270 2.546 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000834779168 625855653 /nfs/dbraw/zinc/85/56/53/625855653.db2.gz IKNHSDAUWBHVGM-DLBZAZTESA-N 0 3 297.398 2.881 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCOC[C@@H]1OC)c1ccc(C)cc1[O-] ZINC000834880812 625907312 /nfs/dbraw/zinc/90/73/12/625907312.db2.gz RVRHARHRNCSQOY-KMFMINBZSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@@H]([NH2+]CC1(CF)CCOCC1)c1cc(F)ccc1[O-] ZINC000834886349 625909538 /nfs/dbraw/zinc/90/95/38/625909538.db2.gz RUVBGMDMJZRYOZ-LLVKDONJSA-N 0 3 285.334 2.948 20 10 CFCDHN C[C@H]([NH2+]CC1(CF)CCOCC1)c1cc(F)ccc1[O-] ZINC000834886350 625909597 /nfs/dbraw/zinc/90/95/97/625909597.db2.gz RUVBGMDMJZRYOZ-NSHDSACASA-N 0 3 285.334 2.948 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCC[C@H]1O)c1ccc(C)cc1[O-] ZINC000834905790 625918200 /nfs/dbraw/zinc/91/82/00/625918200.db2.gz LIFYDDYRIKVURI-AEGPPILISA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@]2(C)CCC(=O)N2)c1[O-] ZINC000834907842 625919243 /nfs/dbraw/zinc/91/92/43/625919243.db2.gz DJWFIGUXQRSXJV-BMIGLBTASA-N 0 3 296.798 2.673 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)C1CCC1)c1ccc(C)cc1[O-] ZINC000834906967 625919395 /nfs/dbraw/zinc/91/93/95/625919395.db2.gz VGJINXQFYTWBSR-GDBMZVCRSA-N 0 3 263.381 2.902 20 10 CFCDHN CCO[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834915346 625921427 /nfs/dbraw/zinc/92/14/27/625921427.db2.gz XOUYBOGVQOLRQI-UMVBOHGHSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1ccc(O)c(CNCc2cccc3c2OCC3)c1 ZINC000921740956 626103062 /nfs/dbraw/zinc/10/30/62/626103062.db2.gz RSIUNBFCSXGTPJ-UHFFFAOYSA-N 0 3 285.343 2.626 20 10 CFCDHN C[C@H](NCc1c2c(nn1C)CCC2)c1ccc(N(C)C)cc1 ZINC000922015501 626196809 /nfs/dbraw/zinc/19/68/09/626196809.db2.gz QQSFGLIZGRVDFT-ZDUSSCGKSA-N 0 3 298.434 2.826 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1O ZINC000922988180 626439528 /nfs/dbraw/zinc/43/95/28/626439528.db2.gz MWBVXSLKAIVOIX-SJORKVTESA-N 0 3 269.344 2.530 20 10 CFCDHN C[C@H](O)CCC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000788605306 626483536 /nfs/dbraw/zinc/48/35/36/626483536.db2.gz OWGCVMJLOYIVEK-JBLDHEPKSA-N 0 3 267.344 2.830 20 10 CFCDHN Oc1ccccc1CN(Cc1ccco1)C[C@@H](O)C1CC1 ZINC000838893522 626514438 /nfs/dbraw/zinc/51/44/38/626514438.db2.gz DFHFSDXELIJBLI-QGZVFWFLSA-N 0 3 287.359 2.758 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](Cc1ccco1)C[C@@H](O)C1CC1 ZINC000838893522 626514439 /nfs/dbraw/zinc/51/44/39/626514439.db2.gz DFHFSDXELIJBLI-QGZVFWFLSA-N 0 3 287.359 2.758 20 10 CFCDHN [O-]c1ccccc1C[N@H+](Cc1ccco1)C[C@@H](O)C1CC1 ZINC000838893522 626514440 /nfs/dbraw/zinc/51/44/40/626514440.db2.gz DFHFSDXELIJBLI-QGZVFWFLSA-N 0 3 287.359 2.758 20 10 CFCDHN CC(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000839147159 626526180 /nfs/dbraw/zinc/52/61/80/626526180.db2.gz FMPNKKOHXVNXFU-BETUJISGSA-N 0 3 253.317 2.577 20 10 CFCDHN CN(C)c1ccc(CN(Cc2ccnc(N)c2)C2CC2)cc1 ZINC000839467635 626537585 /nfs/dbraw/zinc/53/75/85/626537585.db2.gz HWXOMHDAJZZTAI-UHFFFAOYSA-N 0 3 296.418 2.894 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2ccccc2NC1=O)c1ccccc1[O-] ZINC000839539228 626546431 /nfs/dbraw/zinc/54/64/31/626546431.db2.gz RQBNEJSTFWEHLR-WBMJQRKESA-N 0 3 296.370 2.996 20 10 CFCDHN Cc1ccccc1C[N@@H+](C)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768437853 627342476 /nfs/dbraw/zinc/34/24/76/627342476.db2.gz KKRGQBHWCORGKX-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1ccccc1C[N@H+](C)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768437853 627342481 /nfs/dbraw/zinc/34/24/81/627342481.db2.gz KKRGQBHWCORGKX-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN C[C@@H]1CCCCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768445075 627342992 /nfs/dbraw/zinc/34/29/92/627342992.db2.gz FDEUGNHNTGETGL-ABAIWWIYSA-N 0 3 277.364 2.583 20 10 CFCDHN C[C@@H]1CCCCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768445075 627342995 /nfs/dbraw/zinc/34/29/95/627342995.db2.gz FDEUGNHNTGETGL-ABAIWWIYSA-N 0 3 277.364 2.583 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)CC1CCCCC1 ZINC000768442650 627343263 /nfs/dbraw/zinc/34/32/63/627343263.db2.gz YEQVRMABXBMZCH-MRXNPFEDSA-N 0 3 291.391 2.830 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)CC1CCCCC1 ZINC000768442650 627343266 /nfs/dbraw/zinc/34/32/66/627343266.db2.gz YEQVRMABXBMZCH-MRXNPFEDSA-N 0 3 291.391 2.830 20 10 CFCDHN Cc1ccccc1C[N@@H+](C)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768437851 627343481 /nfs/dbraw/zinc/34/34/81/627343481.db2.gz KKRGQBHWCORGKX-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1ccccc1C[N@H+](C)Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768437851 627343486 /nfs/dbraw/zinc/34/34/86/627343486.db2.gz KKRGQBHWCORGKX-KRWDZBQOSA-N 0 3 299.370 2.758 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000768519421 627349572 /nfs/dbraw/zinc/34/95/72/627349572.db2.gz PHICSTUQHPEWGR-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000768519421 627349575 /nfs/dbraw/zinc/34/95/75/627349575.db2.gz PHICSTUQHPEWGR-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN CCC[N@H+](Cc1cnc(N)s1)Cc1ccccc1[O-] ZINC000769200628 627412058 /nfs/dbraw/zinc/41/20/58/627412058.db2.gz DNUBUKCQFHNEFZ-UHFFFAOYSA-N 0 3 277.393 2.843 20 10 CFCDHN CCC[N@@H+](Cc1cnc(N)s1)Cc1ccccc1[O-] ZINC000769200628 627412059 /nfs/dbraw/zinc/41/20/59/627412059.db2.gz DNUBUKCQFHNEFZ-UHFFFAOYSA-N 0 3 277.393 2.843 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@@H]2CCCOC2)c([O-])c1 ZINC000769339505 627426564 /nfs/dbraw/zinc/42/65/64/627426564.db2.gz QQDJDAPZGZWWQP-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@@H]2CCCOC2)c([O-])c1 ZINC000769339505 627426566 /nfs/dbraw/zinc/42/65/66/627426566.db2.gz QQDJDAPZGZWWQP-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](OCC(C)C)C1 ZINC000770322944 627513536 /nfs/dbraw/zinc/51/35/36/627513536.db2.gz BKHDMNOAIMUYRH-CYBMUJFWSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000770322944 627513537 /nfs/dbraw/zinc/51/35/37/627513537.db2.gz BKHDMNOAIMUYRH-CYBMUJFWSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1cccc(CN[C@H](CO)c2ccsc2)c1O ZINC000770668156 627539452 /nfs/dbraw/zinc/53/94/52/627539452.db2.gz KKOUFDOJZZBIHE-CYBMUJFWSA-N 0 3 263.362 2.585 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2cncs2)c1 ZINC000772983913 627764780 /nfs/dbraw/zinc/76/47/80/627764780.db2.gz NESVFVDXWUGDES-VIFPVBQESA-N 0 3 264.350 2.708 20 10 CFCDHN CCN(C)c1ccc(CN[C@H](C)c2cnn(C)c2)cc1 ZINC000773840010 627863093 /nfs/dbraw/zinc/86/30/93/627863093.db2.gz PGGUNEBMPYEXJJ-CYBMUJFWSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)c1ccco1)c1ccccc1[O-] ZINC000775416277 628023090 /nfs/dbraw/zinc/02/30/90/628023090.db2.gz UEVKBIZNHUBOEC-TZMCWYRMSA-N 0 3 261.321 2.760 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000775556387 628036933 /nfs/dbraw/zinc/03/69/33/628036933.db2.gz XRWZQQWRGKOPKQ-SQWLQELKSA-N 0 3 279.380 2.627 20 10 CFCDHN CC(C)[C@@H](C)NC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775833573 628073843 /nfs/dbraw/zinc/07/38/43/628073843.db2.gz DWJMSWYTZRVAOM-ZIAGYGMSSA-N 0 3 291.439 2.564 20 10 CFCDHN CC[C@H](COC)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000776212411 628117176 /nfs/dbraw/zinc/11/71/76/628117176.db2.gz KKGJGVZMTBXEDQ-GFCCVEGCSA-N 0 3 257.761 2.869 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000779007915 628344602 /nfs/dbraw/zinc/34/46/02/628344602.db2.gz NNDMFAASTJBEQK-AWEZNQCLSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000779007915 628344608 /nfs/dbraw/zinc/34/46/08/628344608.db2.gz NNDMFAASTJBEQK-AWEZNQCLSA-N 0 3 275.327 2.565 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2CCO)c1[O-] ZINC000779201174 628359971 /nfs/dbraw/zinc/35/99/71/628359971.db2.gz AZZIBFKTTBTLHS-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]2CCO)c1[O-] ZINC000779201174 628359974 /nfs/dbraw/zinc/35/99/74/628359974.db2.gz AZZIBFKTTBTLHS-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c1[O-] ZINC000780891879 628503035 /nfs/dbraw/zinc/50/30/35/628503035.db2.gz BNJVMWJFANPQCC-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@H](C)O)C2)c1[O-] ZINC000780891879 628503038 /nfs/dbraw/zinc/50/30/38/628503038.db2.gz BNJVMWJFANPQCC-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@@H](C)c2ccccc2[O-])n1 ZINC000783518720 628715602 /nfs/dbraw/zinc/71/56/02/628715602.db2.gz NWOCRICSFLVXIW-ZDUSSCGKSA-N 0 3 271.364 2.858 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC(C)(C)C1 ZINC000784008273 628762081 /nfs/dbraw/zinc/76/20/81/628762081.db2.gz NLGPYLPWKOCUGF-IAQYHMDHSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC(C)(C)C1 ZINC000784008273 628762083 /nfs/dbraw/zinc/76/20/83/628762083.db2.gz NLGPYLPWKOCUGF-IAQYHMDHSA-N 0 3 291.391 2.686 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)[C@H]1C ZINC000787242172 629001623 /nfs/dbraw/zinc/00/16/23/629001623.db2.gz UOABLHMBYPGIGT-GXTWGEPZSA-N 0 3 299.370 2.929 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)[C@H]1C ZINC000787242172 629001626 /nfs/dbraw/zinc/00/16/26/629001626.db2.gz UOABLHMBYPGIGT-GXTWGEPZSA-N 0 3 299.370 2.929 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCOCC(F)F)c2c1c(F)ccc2[O-] ZINC000788259203 629053008 /nfs/dbraw/zinc/05/30/08/629053008.db2.gz LNTHBFQBKMERQG-PSASIEDQSA-N 0 3 289.297 2.951 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2cncn2C)c2c1c(F)ccc2[O-] ZINC000788258134 629054010 /nfs/dbraw/zinc/05/40/10/629054010.db2.gz UIABQRXKAXRGRS-GXFFZTMASA-N 0 3 289.354 2.645 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000788984788 629113881 /nfs/dbraw/zinc/11/38/81/629113881.db2.gz TWUMUSQUPWHFMY-NHCYSSNCSA-N 0 3 294.370 2.536 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000790934135 629272089 /nfs/dbraw/zinc/27/20/89/629272089.db2.gz FZAFHDBCYZGUKN-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000790934135 629272093 /nfs/dbraw/zinc/27/20/93/629272093.db2.gz FZAFHDBCYZGUKN-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN C[C@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CCCO1 ZINC000835024907 629320453 /nfs/dbraw/zinc/32/04/53/629320453.db2.gz ASADKHZBINEDSB-VOKGJARPSA-N 0 3 274.408 2.877 20 10 CFCDHN CN(C)c1ccc(/C=C/CNC2(CF)CCOCC2)cc1 ZINC000835053632 629353359 /nfs/dbraw/zinc/35/33/59/629353359.db2.gz FIQHNWKFVLRHDB-ONEGZZNKSA-N 0 3 292.398 2.874 20 10 CFCDHN CN(C)c1ccc(/C=C\CNC2(CF)CCOCC2)cc1 ZINC000835053629 629354365 /nfs/dbraw/zinc/35/43/65/629354365.db2.gz FIQHNWKFVLRHDB-ARJAWSKDSA-N 0 3 292.398 2.874 20 10 CFCDHN CC[C@H]1CN(C)CCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000835055954 629358575 /nfs/dbraw/zinc/35/85/75/629358575.db2.gz QIIQNGCWGKOBOY-LXXRFIIISA-N 0 3 287.451 2.792 20 10 CFCDHN Cc1cnc(CC[NH2+]Cc2cc(Cl)cc(C)c2[O-])cn1 ZINC000835062068 629365030 /nfs/dbraw/zinc/36/50/30/629365030.db2.gz QQSGFUPWDLIESS-UHFFFAOYSA-N 0 3 291.782 2.785 20 10 CFCDHN CON1CCC([N@H+](C)Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000835075867 629372916 /nfs/dbraw/zinc/37/29/16/629372916.db2.gz FCFCSMYRGUXQRN-UHFFFAOYSA-N 0 3 298.814 2.812 20 10 CFCDHN CON1CCC([N@@H+](C)Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000835075867 629372920 /nfs/dbraw/zinc/37/29/20/629372920.db2.gz FCFCSMYRGUXQRN-UHFFFAOYSA-N 0 3 298.814 2.812 20 10 CFCDHN Oc1ccccc1CN(C[C@@H]1CCCO1)CC1(F)CC1 ZINC000792766059 629449890 /nfs/dbraw/zinc/44/98/90/629449890.db2.gz MWFBESSDOTUWLB-AWEZNQCLSA-N 0 3 279.355 2.875 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000794809035 629688750 /nfs/dbraw/zinc/68/87/50/629688750.db2.gz PFZSKCNAOXDECV-GDBMZVCRSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@@H]([NH2+]CCNc1cnccn1)c1ccc(C)cc1[O-] ZINC000794810917 629689010 /nfs/dbraw/zinc/68/90/10/629689010.db2.gz NWFCSHFLUKCOAL-CQSZACIVSA-N 0 3 286.379 2.643 20 10 CFCDHN CC[C@H]([NH2+]CCc1cncn1C)c1ccc(C)cc1[O-] ZINC000794815872 629689524 /nfs/dbraw/zinc/68/95/24/629689524.db2.gz PVRINOGKXBACKW-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(CCO)CCCC2)c([O-])c1 ZINC000796455037 629920601 /nfs/dbraw/zinc/92/06/01/629920601.db2.gz RCBGMOMJCLHQMU-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COC(=O)Nc1cccc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000796490173 629926143 /nfs/dbraw/zinc/92/61/43/629926143.db2.gz KPILYBNVYVKSOB-UHFFFAOYSA-N 0 3 286.331 2.860 20 10 CFCDHN CCCN1CCC[C@H]1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000797114940 630019837 /nfs/dbraw/zinc/01/98/37/630019837.db2.gz SAMVOIPLSLHQSE-KGLIPLIRSA-N 0 3 262.397 2.917 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798963934 630265514 /nfs/dbraw/zinc/26/55/14/630265514.db2.gz LENNUKJREQYPBR-CYBMUJFWSA-N 0 3 284.359 2.785 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798963934 630265516 /nfs/dbraw/zinc/26/55/16/630265516.db2.gz LENNUKJREQYPBR-CYBMUJFWSA-N 0 3 284.359 2.785 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC000799736328 630342045 /nfs/dbraw/zinc/34/20/45/630342045.db2.gz NQZLQVYKXKOGMY-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC000799736328 630342048 /nfs/dbraw/zinc/34/20/48/630342048.db2.gz NQZLQVYKXKOGMY-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CCCCN(CC(=O)N1CCCC1)Cc1ccccc1O ZINC000801596669 630461151 /nfs/dbraw/zinc/46/11/51/630461151.db2.gz JJMVUHZELOYCMJ-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NCCC ZINC000801596876 630461286 /nfs/dbraw/zinc/46/12/86/630461286.db2.gz RVVPBMODTVXUEF-CQSZACIVSA-N 0 3 292.423 2.909 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NCCC ZINC000801596876 630461287 /nfs/dbraw/zinc/46/12/87/630461287.db2.gz RVVPBMODTVXUEF-CQSZACIVSA-N 0 3 292.423 2.909 20 10 CFCDHN C[C@@H](CN(C)C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806169922 630779348 /nfs/dbraw/zinc/77/93/48/630779348.db2.gz MAOHUPDJLNPQNO-SCVCMEIPSA-N 0 3 266.360 2.619 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)c2cccnc2)c([O-])c1 ZINC000806178907 630780307 /nfs/dbraw/zinc/78/03/07/630780307.db2.gz LGOHWWAOTBARKU-HIFRSBDPSA-N 0 3 286.375 2.522 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC(C)CC1)c1ccccc1[O-] ZINC000040771480 649986451 /nfs/dbraw/zinc/98/64/51/649986451.db2.gz IUQWURIIQBAXBB-CQSZACIVSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@@H](CO)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672233 631025254 /nfs/dbraw/zinc/02/52/54/631025254.db2.gz HBSCNYMIZCAGKR-ONGXEEELSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCCCNC2=O)c1[O-] ZINC000808675413 631025920 /nfs/dbraw/zinc/02/59/20/631025920.db2.gz GEPPQBBFZDPNLT-GWCFXTLKSA-N 0 3 296.798 2.673 20 10 CFCDHN CCNC(=O)[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672697 631026264 /nfs/dbraw/zinc/02/62/64/631026264.db2.gz RJRPWTBUCFWICQ-ZJUUUORDSA-N 0 3 284.787 2.529 20 10 CFCDHN COC[C@H](C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-])OC ZINC000808714276 631033674 /nfs/dbraw/zinc/03/36/74/631033674.db2.gz UDJJRJYFFRADGO-PWSUYJOCSA-N 0 3 287.787 2.666 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cncc(OC)c2)c1 ZINC000808743635 631041922 /nfs/dbraw/zinc/04/19/22/631041922.db2.gz KIFMVLXZRMVTKX-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN Oc1cc2c(cc1CN1CCO[C@H](C3CCC3)C1)CCC2 ZINC000840175393 631225291 /nfs/dbraw/zinc/22/52/91/631225291.db2.gz IZDDZXMREQZJMU-SFHVURJKSA-N 0 3 287.403 2.882 20 10 CFCDHN CC[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000840820657 631231341 /nfs/dbraw/zinc/23/13/41/631231341.db2.gz IMKZKNPEBOSJFV-IUPBHXKESA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCC(F)(F)[C@H](CO)C1 ZINC000840948061 631277062 /nfs/dbraw/zinc/27/70/62/631277062.db2.gz PYIUNFUDLJBNNG-AWEZNQCLSA-N 0 3 298.377 2.511 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1ncc[nH]1 ZINC000840977194 631292627 /nfs/dbraw/zinc/29/26/27/631292627.db2.gz ULKXAAQBPCHIQK-CYBMUJFWSA-N 0 3 272.396 2.505 20 10 CFCDHN CCC(N)(CC)C[NH2+]Cc1cccc(Cl)c1[O-] ZINC000841031540 631312361 /nfs/dbraw/zinc/31/23/61/631312361.db2.gz VOGVFDZLJODWFC-UHFFFAOYSA-N 0 3 256.777 2.653 20 10 CFCDHN CCCNCC[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841047055 631320612 /nfs/dbraw/zinc/32/06/12/631320612.db2.gz TWOPYZAWJJIPNR-UHFFFAOYSA-N 0 3 277.195 2.788 20 10 CFCDHN CCc1ccccc1[C@@H](N)C[NH2+]Cc1ccccc1[O-] ZINC000841086800 631335477 /nfs/dbraw/zinc/33/54/77/631335477.db2.gz LPSYXBSTAVVZFE-INIZCTEOSA-N 0 3 270.376 2.744 20 10 CFCDHN [O-]c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCCCNC1 ZINC000841091517 631338158 /nfs/dbraw/zinc/33/81/58/631338158.db2.gz ZQEXTWFGFCLSPY-LLVKDONJSA-N 0 3 289.206 2.931 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(CC(F)F)C2)c([O-])c1 ZINC000841764162 631469213 /nfs/dbraw/zinc/46/92/13/631469213.db2.gz DHNQIAUMKPXZIH-VXGBXAGGSA-N 0 3 284.350 2.691 20 10 CFCDHN CCCN(Cc1cc(C)nn1C)Cc1ccccc1O ZINC000841837130 631478884 /nfs/dbraw/zinc/47/88/84/631478884.db2.gz XRNSTVOMDSKNSI-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN CO[C@H](C[NH2+]Cc1cc(F)ccc1[O-])CC(C)C ZINC000841888949 631487728 /nfs/dbraw/zinc/48/77/28/631487728.db2.gz VVPOISVRVIFAAK-ZDUSSCGKSA-N 0 3 255.333 2.682 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C2CC2)C(C)(C)CO)c([O-])c1 ZINC000811518405 631575503 /nfs/dbraw/zinc/57/55/03/631575503.db2.gz JHFXGOGFVGTHJQ-INIZCTEOSA-N 0 3 293.407 2.678 20 10 CFCDHN Cc1cccc2c1OC[C@@H]([NH2+]Cc1cc(F)ccc1[O-])C2 ZINC000811519309 631576870 /nfs/dbraw/zinc/57/68/70/631576870.db2.gz YCHZWPTXDILHCH-HNNXBMFYSA-N 0 3 287.334 2.933 20 10 CFCDHN Cn1ncc2ccc(CNCc3ccc4c(c3)CCO4)cc21 ZINC000812771607 631771215 /nfs/dbraw/zinc/77/12/15/631771215.db2.gz BAEYXVLFSJAZMY-UHFFFAOYSA-N 0 3 293.370 2.798 20 10 CFCDHN COCC1(CC[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000842891189 631775026 /nfs/dbraw/zinc/77/50/26/631775026.db2.gz PKWQLVYJRKYHRQ-CYBMUJFWSA-N 0 3 261.365 2.786 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)[C@@H]1SC ZINC000842922794 631783117 /nfs/dbraw/zinc/78/31/17/631783117.db2.gz DQNLTDFXTQXXFH-NCZKRNLISA-N 0 3 293.432 2.878 20 10 CFCDHN CN(Cc1c([O-])ccc(Cl)c1F)CC(C)(C)C[NH3+] ZINC000843056532 631815421 /nfs/dbraw/zinc/81/54/21/631815421.db2.gz PGVGRBVSVHEMQQ-UHFFFAOYSA-N 0 3 274.767 2.601 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[NH2+]CC[C@H]3C2)c(Cl)c1 ZINC000843128453 631847865 /nfs/dbraw/zinc/84/78/65/631847865.db2.gz XQURSJROGBYHAB-FZMZJTMJSA-N 0 3 280.799 2.538 20 10 CFCDHN CC[C@H]([NH2+]CCOc1cccnc1)c1ccccc1[O-] ZINC000155841265 650034164 /nfs/dbraw/zinc/03/41/64/650034164.db2.gz CYNHVJXXWSNSTO-HNNXBMFYSA-N 0 3 272.348 2.907 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@@H]1CC[NH2+]C12CCCC2 ZINC000843129082 631849110 /nfs/dbraw/zinc/84/91/10/631849110.db2.gz QPIFKIYHAWTAMQ-CQSZACIVSA-N 0 3 280.799 2.810 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCO)CSC)c1ccccc1[O-] ZINC000155980284 650039350 /nfs/dbraw/zinc/03/93/50/650039350.db2.gz MVIIRIKSLCFUFA-DGCLKSJQSA-N 0 3 269.410 2.547 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000044684725 650053182 /nfs/dbraw/zinc/05/31/82/650053182.db2.gz CSZVWBRBOSTHSN-SWLSCSKDSA-N 0 3 260.381 2.670 20 10 CFCDHN CCc1noc(C)c1CNCc1cccc(OC)c1O ZINC000815146012 632216345 /nfs/dbraw/zinc/21/63/45/632216345.db2.gz KQFHWLPJMMEFES-UHFFFAOYSA-N 0 3 276.336 2.549 20 10 CFCDHN CCOC1(C[NH2+]Cc2c([O-])cccc2OC)CCCC1 ZINC000815147576 632217229 /nfs/dbraw/zinc/21/72/29/632217229.db2.gz YTTFGCQWGSZRKT-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000815150734 632218195 /nfs/dbraw/zinc/21/81/95/632218195.db2.gz MJRQTQBRMHPRRY-CQSZACIVSA-N 0 3 293.407 2.679 20 10 CFCDHN CC[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@@H](C)CO1 ZINC000844729291 632290639 /nfs/dbraw/zinc/29/06/39/632290639.db2.gz HLUAKBQIZAIDSE-BLLLJJGKSA-N 0 3 275.392 2.880 20 10 CFCDHN [NH3+]CCC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000844911126 632333830 /nfs/dbraw/zinc/33/38/30/632333830.db2.gz KWNPOPKPNWDDKC-UHFFFAOYSA-N 0 3 286.778 2.746 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000816535870 632478990 /nfs/dbraw/zinc/47/89/90/632478990.db2.gz CTSFWSFGKLDODD-RYUDHWBXSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000816535870 632478991 /nfs/dbraw/zinc/47/89/91/632478991.db2.gz CTSFWSFGKLDODD-RYUDHWBXSA-N 0 3 298.789 2.901 20 10 CFCDHN CCc1ncc(CN[C@@H](C)c2cc(OC)ccc2O)cn1 ZINC000845970631 632607021 /nfs/dbraw/zinc/60/70/21/632607021.db2.gz AUPMHAPTNGAEJA-NSHDSACASA-N 0 3 287.363 2.604 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H](CO)CCF ZINC000846097051 632630869 /nfs/dbraw/zinc/63/08/69/632630869.db2.gz MNWMAZUTSRTQJI-INIZCTEOSA-N 0 3 289.350 2.869 20 10 CFCDHN CC[C@@H]([NH2+]CCC1(CO)CCC1)c1ccccc1[O-] ZINC000846105189 632632931 /nfs/dbraw/zinc/63/29/31/632632931.db2.gz RBHIOLUPWYLXGA-CQSZACIVSA-N 0 3 263.381 2.986 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846117899 632639033 /nfs/dbraw/zinc/63/90/33/632639033.db2.gz SGMNDKVTZPEZAB-GFCCVEGCSA-N 0 3 257.255 2.762 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846117899 632639040 /nfs/dbraw/zinc/63/90/40/632639040.db2.gz SGMNDKVTZPEZAB-GFCCVEGCSA-N 0 3 257.255 2.762 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CCCCC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000817938123 632742688 /nfs/dbraw/zinc/74/26/88/632742688.db2.gz DXJYXZBDJXJETR-NSHDSACASA-N 0 3 293.367 2.613 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCNCc1cccnc1)CC2 ZINC000817941330 632745638 /nfs/dbraw/zinc/74/56/38/632745638.db2.gz STTZSJKERYUPOW-MRXNPFEDSA-N 0 3 297.402 2.544 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)N)c1ccc(C(F)(F)F)cc1[O-] ZINC000817973530 632773028 /nfs/dbraw/zinc/77/30/28/632773028.db2.gz UVOMQAVGPKNGBI-KWQFWETISA-N 0 3 276.302 2.799 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1NCCc3ccccc31)CC2 ZINC000817975488 632773299 /nfs/dbraw/zinc/77/32/99/632773299.db2.gz VODOVTVJYIMDTB-IAGOWNOFSA-N 0 3 294.398 2.856 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[C@H](F)CN2)c1[O-] ZINC000817976135 632774169 /nfs/dbraw/zinc/77/41/69/632774169.db2.gz GZFYSGMPTVIPKZ-DLOVCJGASA-N 0 3 286.778 2.705 20 10 CFCDHN C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817978143 632776153 /nfs/dbraw/zinc/77/61/53/632776153.db2.gz XAYPNTYITAEWOH-VGMNWLOBSA-N 0 3 276.302 2.797 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)Cc1ccccn1 ZINC000848567360 633291152 /nfs/dbraw/zinc/29/11/52/633291152.db2.gz SZKMOYVAWSHMCK-GFCCVEGCSA-N 0 3 272.348 2.517 20 10 CFCDHN CCc1cccc(CN(C)Cc2cccn2C)c1O ZINC000848888286 633362929 /nfs/dbraw/zinc/36/29/29/633362929.db2.gz RCGHSDUZQSEKKD-UHFFFAOYSA-N 0 3 258.365 2.925 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H](CC)C[C@H](C)CO)c1[O-] ZINC000848898035 633387441 /nfs/dbraw/zinc/38/74/41/633387441.db2.gz OQJUWAVCVPVTDO-WFASDCNBSA-N 0 3 265.397 2.841 20 10 CFCDHN CCc1cccc(C[NH2+]CC2(CCO)CCC2)c1[O-] ZINC000848899268 633388256 /nfs/dbraw/zinc/38/82/56/633388256.db2.gz MESJVMFJJWNAHA-UHFFFAOYSA-N 0 3 263.381 2.597 20 10 CFCDHN CCc1cccc(CN(C)Cc2ccncc2)c1O ZINC000848902502 633389161 /nfs/dbraw/zinc/38/91/61/633389161.db2.gz OXOPAFPYUCAHGV-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CCc1cccc(C[NH2+][C@H]([C@H](CO)C2CC2)C2CC2)c1[O-] ZINC000848916134 633400836 /nfs/dbraw/zinc/40/08/36/633400836.db2.gz PELFUTXKPJLZSL-SJORKVTESA-N 0 3 289.419 2.841 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@H]1CCCCO1 ZINC000848927746 633410722 /nfs/dbraw/zinc/41/07/22/633410722.db2.gz MLSXVQHSFPKTCQ-ZFWWWQNUSA-N 0 3 267.344 2.969 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnn3c2CCC3)cc1 ZINC000850034238 633796949 /nfs/dbraw/zinc/79/69/49/633796949.db2.gz IUEVVXTYCPFVEB-UHFFFAOYSA-N 0 3 298.434 2.965 20 10 CFCDHN Cn1cc(C[C@H]2CCC[C@@H]2[NH2+]Cc2ccccc2[O-])cn1 ZINC000850383978 633970148 /nfs/dbraw/zinc/97/01/48/633970148.db2.gz GLEGMIYMSMQHFW-ZBFHGGJFSA-N 0 3 285.391 2.627 20 10 CFCDHN C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccccc1[O-] ZINC000850411896 633982754 /nfs/dbraw/zinc/98/27/54/633982754.db2.gz NNIHIJZREAOHGI-GUYCJALGSA-N 0 3 271.360 2.646 20 10 CFCDHN CC[C@]1(NCc2cc(F)c(N(C)C)cc2F)CCOC1 ZINC000858160965 636144947 /nfs/dbraw/zinc/14/49/47/636144947.db2.gz WOECDPWKTJXTAY-HNNXBMFYSA-N 0 3 284.350 2.690 20 10 CFCDHN CC(=O)NCc1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000850484895 634013315 /nfs/dbraw/zinc/01/33/15/634013315.db2.gz UBCCLUOBZRDCRV-CYBMUJFWSA-N 0 3 298.386 2.879 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)C1CCC1)c1ccc(C)cc1[O-] ZINC000850487162 634014938 /nfs/dbraw/zinc/01/49/38/634014938.db2.gz FSBBXQULRBJSLB-CABCVRRESA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000850497908 634019212 /nfs/dbraw/zinc/01/92/12/634019212.db2.gz ZZODYIJGOLAOBZ-NHCYSSNCSA-N 0 3 265.328 2.848 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1c([O-])cccc1OC)OCC ZINC000858209963 636156006 /nfs/dbraw/zinc/15/60/06/636156006.db2.gz DNRRAZXEWFCYRR-GFCCVEGCSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H](O)C12CCC2)c1ccccc1[O-] ZINC000850544875 634046003 /nfs/dbraw/zinc/04/60/03/634046003.db2.gz BSAXNXMYNOFKNP-CFVMTHIKSA-N 0 3 261.365 2.736 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](CO)CC2CC2)c([O-])c1 ZINC000850546426 634047353 /nfs/dbraw/zinc/04/73/53/634047353.db2.gz ZQJLGNPEWNDVQN-GXTWGEPZSA-N 0 3 263.381 2.760 20 10 CFCDHN Cc1cncc(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])n1 ZINC000850552168 634051186 /nfs/dbraw/zinc/05/11/86/634051186.db2.gz XNQCQAOUKLADNP-LLVKDONJSA-N 0 3 275.327 2.523 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)[C@@]1(O)CCCOC1)c1ccccc1[O-] ZINC000850561130 634053335 /nfs/dbraw/zinc/05/33/35/634053335.db2.gz HZZCNLMFOATDIS-CXAGYDPISA-N 0 3 293.407 2.611 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@H](O)C2)c1[O-] ZINC000850577895 634058634 /nfs/dbraw/zinc/05/86/34/634058634.db2.gz FBUCWTNCUOHEHH-FBIMIBRVSA-N 0 3 255.745 2.528 20 10 CFCDHN CC[C@@]1(NCc2cc(F)c(N(C)C)cc2F)CCOC1 ZINC000858160966 636144659 /nfs/dbraw/zinc/14/46/59/636144659.db2.gz WOECDPWKTJXTAY-OAHLLOKOSA-N 0 3 284.350 2.690 20 10 CFCDHN C[C@H]1CSC[C@@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858163756 636144914 /nfs/dbraw/zinc/14/49/14/636144914.db2.gz KVQNTMMLIDKSDF-ZANVPECISA-N 0 3 286.391 2.872 20 10 CFCDHN CCn1nccc1CNC/C=C\c1ccc(N(C)C)cc1 ZINC000853093928 634902382 /nfs/dbraw/zinc/90/23/82/634902382.db2.gz NCEUDKPFXCUURB-WAYWQWQTSA-N 0 3 284.407 2.772 20 10 CFCDHN CCN1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000112142986 635286370 /nfs/dbraw/zinc/28/63/70/635286370.db2.gz ZYKIMKBOPFDDKJ-UHFFFAOYSA-N 0 3 287.451 2.814 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(C)oc2C)c([O-])c1 ZINC000114504871 635836505 /nfs/dbraw/zinc/83/65/05/635836505.db2.gz XWKONGLVLZXMAW-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2CCOC2(C)C)cc1F ZINC000858170382 636146333 /nfs/dbraw/zinc/14/63/33/636146333.db2.gz GBQDFBWHAJEJAZ-CQSZACIVSA-N 0 3 284.350 2.688 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2COCC2(C)C)cc1F ZINC000858174622 636148363 /nfs/dbraw/zinc/14/83/63/636148363.db2.gz TWORZOHZDDRVFO-CQSZACIVSA-N 0 3 284.350 2.545 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnc([C@@H](C)O)s2)c1 ZINC000858238968 636160958 /nfs/dbraw/zinc/16/09/58/636160958.db2.gz GDBZGOZPLFIJQB-SNVBAGLBSA-N 0 3 278.377 2.500 20 10 CFCDHN CC1(C)CCC[C@@](CO)([NH2+]Cc2ccccc2[O-])C1 ZINC000858251129 636163720 /nfs/dbraw/zinc/16/37/20/636163720.db2.gz KYGYLUQISTZGFA-MRXNPFEDSA-N 0 3 263.381 2.813 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000858504949 636274933 /nfs/dbraw/zinc/27/49/33/636274933.db2.gz BWMLPXNLEQNAJG-YPMHNXCESA-N 0 3 275.348 2.695 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000858508381 636276870 /nfs/dbraw/zinc/27/68/70/636276870.db2.gz NIQSKSYJVWQNOK-KGLIPLIRSA-N 0 3 287.359 2.621 20 10 CFCDHN C[C@H]1CN(Cc2cc3c(cc2O)CCC3)CC(C)(C)O1 ZINC000194472512 636781345 /nfs/dbraw/zinc/78/13/45/636781345.db2.gz GAYJHYGCENFPFY-LBPRGKRZSA-N 0 3 275.392 2.880 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)CC2CCOCC2)cc1F ZINC000862242077 637296243 /nfs/dbraw/zinc/29/62/43/637296243.db2.gz VHECVXWRUPRWOH-UHFFFAOYSA-N 0 3 298.377 2.889 20 10 CFCDHN COCCC1CC[NH+](Cc2c([O-])cccc2OC)CC1 ZINC000862438203 637377806 /nfs/dbraw/zinc/37/78/06/637377806.db2.gz YDKOKSWKROLMJW-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCCC3(CC3)CC1)[C@H](O)CO2 ZINC000863331699 637628125 /nfs/dbraw/zinc/62/81/25/637628125.db2.gz RZLNPWLGCDRMBT-OAHLLOKOSA-N 0 3 289.375 2.584 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCCC3(CC3)CC1)[C@H](O)CO2 ZINC000863331699 637628129 /nfs/dbraw/zinc/62/81/29/637628129.db2.gz RZLNPWLGCDRMBT-OAHLLOKOSA-N 0 3 289.375 2.584 20 10 CFCDHN C[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc2ccccc2c1[O-] ZINC000863546558 637693374 /nfs/dbraw/zinc/69/33/74/637693374.db2.gz KYAQZFLDMWLRJP-BFQNTYOBSA-N 0 3 270.376 2.946 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NC(C)(C)C ZINC000076074141 650366184 /nfs/dbraw/zinc/36/61/84/650366184.db2.gz MHOLFNADCGOCSO-CYBMUJFWSA-N 0 3 292.423 2.907 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)NC(C)(C)C ZINC000076074141 650366187 /nfs/dbraw/zinc/36/61/87/650366187.db2.gz MHOLFNADCGOCSO-CYBMUJFWSA-N 0 3 292.423 2.907 20 10 CFCDHN CC(C)C(C)(C)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000189468030 650384393 /nfs/dbraw/zinc/38/43/93/650384393.db2.gz XVQMIAAGVJTNTJ-UHFFFAOYSA-N 0 3 265.353 2.893 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCC[C@@H]2O)c1[O-] ZINC000866489123 638829890 /nfs/dbraw/zinc/82/98/90/638829890.db2.gz DQBCQTANSOQNGP-ICCXJUOJSA-N 0 3 269.772 2.918 20 10 CFCDHN CC[C@H]([NH2+]CCCO[C@H]1CCOC1)c1ccccc1[O-] ZINC000121092857 638832854 /nfs/dbraw/zinc/83/28/54/638832854.db2.gz YVQGMINKRZNJMK-ZFWWWQNUSA-N 0 3 279.380 2.629 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccnn1C)c1ccccc1[O-] ZINC000866614949 638855110 /nfs/dbraw/zinc/85/51/10/638855110.db2.gz QRACDCCRLFYBQF-AAEUAGOBSA-N 0 3 259.353 2.928 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1ccccc1[O-] ZINC000866614951 638855370 /nfs/dbraw/zinc/85/53/70/638855370.db2.gz QRACDCCRLFYBQF-WCQYABFASA-N 0 3 259.353 2.928 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866639644 638859872 /nfs/dbraw/zinc/85/98/72/638859872.db2.gz VFLMTYAUSGJZHW-JHEVNIALSA-N 0 3 279.355 2.973 20 10 CFCDHN C[C@@H]([NH2+]CCn1ccc(C(F)(F)F)n1)c1ccccc1[O-] ZINC000872111003 641641459 /nfs/dbraw/zinc/64/14/59/641641459.db2.gz WMTSNPKOWHYSMV-SNVBAGLBSA-N 0 3 299.296 2.958 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[C@H](O)C2)c1[O-] ZINC000872127413 641655747 /nfs/dbraw/zinc/65/57/47/641655747.db2.gz SCBSHZZXJHEYBS-NHCYSSNCSA-N 0 3 269.772 2.776 20 10 CFCDHN CCCOc1ccc(CNC(C)(C)C(=O)NCC)cc1C ZINC000873131295 642022450 /nfs/dbraw/zinc/02/24/50/642022450.db2.gz RSQHVGPFHAQKEF-UHFFFAOYSA-N 0 3 292.423 2.788 20 10 CFCDHN Cc1ccc(C[N@H+](CCC(N)=O)Cc2ccccc2)c([O-])c1 ZINC000876552573 642918425 /nfs/dbraw/zinc/91/84/25/642918425.db2.gz DSLVUZNYFXDLSN-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1ccc(C[N@@H+](CCC(N)=O)Cc2ccccc2)c([O-])c1 ZINC000876552573 642918426 /nfs/dbraw/zinc/91/84/26/642918426.db2.gz DSLVUZNYFXDLSN-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@H+](Cc3c(C)cccc3[O-])C2)n1 ZINC000876612425 642944581 /nfs/dbraw/zinc/94/45/81/642944581.db2.gz LJDPOZFIMSYIDV-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@@H+](Cc3c(C)cccc3[O-])C2)n1 ZINC000876612425 642944583 /nfs/dbraw/zinc/94/45/83/642944583.db2.gz LJDPOZFIMSYIDV-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN CCn1cc(CN(C)Cc2c(C)cccc2O)cn1 ZINC000876739682 642987771 /nfs/dbraw/zinc/98/77/71/642987771.db2.gz FSWCDUMDFIMIQE-UHFFFAOYSA-N 0 3 259.353 2.549 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([O-])c1 ZINC000876771263 643003579 /nfs/dbraw/zinc/00/35/79/643003579.db2.gz PJLSSRRKCYWQEP-AWEZNQCLSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([O-])c1 ZINC000876771263 643003584 /nfs/dbraw/zinc/00/35/84/643003584.db2.gz PJLSSRRKCYWQEP-AWEZNQCLSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876783363 643007146 /nfs/dbraw/zinc/00/71/46/643007146.db2.gz ZYEOCLGYENAMMZ-UKRRQHHQSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876783363 643007148 /nfs/dbraw/zinc/00/71/48/643007148.db2.gz ZYEOCLGYENAMMZ-UKRRQHHQSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876812229 643021259 /nfs/dbraw/zinc/02/12/59/643021259.db2.gz SJEKHVAZRNUNNE-ZBFHGGJFSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876812229 643021266 /nfs/dbraw/zinc/02/12/66/643021266.db2.gz SJEKHVAZRNUNNE-ZBFHGGJFSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]CCC(=O)OC(C)(C)C)c([O-])c1 ZINC000877059467 643126195 /nfs/dbraw/zinc/12/61/95/643126195.db2.gz WIZFPGJIVMUYKE-UHFFFAOYSA-N 0 3 265.353 2.522 20 10 CFCDHN Cc1nnsc1CNCCCSc1nccs1 ZINC000877061551 643128231 /nfs/dbraw/zinc/12/82/31/643128231.db2.gz LCEIAZXUWJAVJJ-UHFFFAOYSA-N 0 3 286.451 2.575 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(CO)CCCCC2)c([O-])c1 ZINC000877083663 643142367 /nfs/dbraw/zinc/14/23/67/643142367.db2.gz OKTBVSLXEXUQHQ-UHFFFAOYSA-N 0 3 263.381 2.733 20 10 CFCDHN COCCC1(C[NH2+]Cc2ccc(C)cc2[O-])CCC1 ZINC000877085261 643143596 /nfs/dbraw/zinc/14/35/96/643143596.db2.gz MKGJHYVEZRRNFF-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)C[C@@H](O)c2ccco2)c([O-])c1 ZINC000877130199 643168150 /nfs/dbraw/zinc/16/81/50/643168150.db2.gz PTEAHWUEBQGJNO-IUODEOHRSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)CCCO)c([O-])c1 ZINC000877131909 643169078 /nfs/dbraw/zinc/16/90/78/643169078.db2.gz OHQBKIAZMZSDQK-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000877139418 643173481 /nfs/dbraw/zinc/17/34/81/643173481.db2.gz NVAAQWNKAZWLQO-GOEBONIOSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000877139418 643173486 /nfs/dbraw/zinc/17/34/86/643173486.db2.gz NVAAQWNKAZWLQO-GOEBONIOSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H]1CCO[C@@H](C)C1 ZINC000877310036 643231638 /nfs/dbraw/zinc/23/16/38/643231638.db2.gz YAXOZKAJFPDSDX-UONOGXRCSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCc2ccccn2)c([O-])c1 ZINC000877317943 643236071 /nfs/dbraw/zinc/23/60/71/643236071.db2.gz GSVVIPYBOWVHNO-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCc2ccccn2)c([O-])c1 ZINC000877317943 643236075 /nfs/dbraw/zinc/23/60/75/643236075.db2.gz GSVVIPYBOWVHNO-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN CC[C@](C)(CC(=O)OC)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877325973 643240657 /nfs/dbraw/zinc/24/06/57/643240657.db2.gz PDBPEPILYWPNSX-OAHLLOKOSA-N 0 3 265.353 2.522 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2[O-])[C@]12CCCO2 ZINC000877345424 643244498 /nfs/dbraw/zinc/24/44/98/643244498.db2.gz CSXWLHIKIMGDOM-BRWVUGGUSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)CNC(=O)OC(C)(C)C)c([O-])c1 ZINC000877398032 643258483 /nfs/dbraw/zinc/25/84/83/643258483.db2.gz AMGRJNFVJSUDKU-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])C(C)C ZINC000877469444 643288770 /nfs/dbraw/zinc/28/87/70/643288770.db2.gz VGJFXWSZAPOQCO-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C)c([O-])c1 ZINC000877474946 643293665 /nfs/dbraw/zinc/29/36/65/643293665.db2.gz AMGRJNFVJSUDKU-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cccc(C)n2)c([O-])c1 ZINC000877487116 643301407 /nfs/dbraw/zinc/30/14/07/643301407.db2.gz QCRVICHZXVQRFK-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000877508302 643319035 /nfs/dbraw/zinc/31/90/35/643319035.db2.gz WKSWIZYONPURGP-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000877508302 643319040 /nfs/dbraw/zinc/31/90/40/643319040.db2.gz WKSWIZYONPURGP-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1ccc(C)cc1[O-] ZINC000877526766 643330540 /nfs/dbraw/zinc/33/05/40/643330540.db2.gz FBGMFOOBHYJIFP-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1ccc(C)cc1[O-] ZINC000877526766 643330542 /nfs/dbraw/zinc/33/05/42/643330542.db2.gz FBGMFOOBHYJIFP-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN Cc1ccc(CN2C[C@@]3(CCCO3)[C@@H]2C2CC2)c(O)c1 ZINC000877555634 643357711 /nfs/dbraw/zinc/35/77/11/643357711.db2.gz YCEPVKOYRNVYCZ-IRXDYDNUSA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c([O-])c1 ZINC000877616054 643402642 /nfs/dbraw/zinc/40/26/42/643402642.db2.gz BUHZVOOULUVIPM-ZDUSSCGKSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c([O-])c1 ZINC000877616054 643402645 /nfs/dbraw/zinc/40/26/45/643402645.db2.gz BUHZVOOULUVIPM-ZDUSSCGKSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCCN3CCCC[C@H]23)c([O-])c1 ZINC000877618879 643404946 /nfs/dbraw/zinc/40/49/46/643404946.db2.gz HSUBGGOHZRPJCB-HZPDHXFCSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)[C@H](C)c1ccccc1 ZINC000877640546 643425153 /nfs/dbraw/zinc/42/51/53/643425153.db2.gz OVEOBZVHZINAFN-KDOFPFPSSA-N 0 3 285.387 2.955 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](O)(CC)C2)c([O-])c1 ZINC000877691757 643457559 /nfs/dbraw/zinc/45/75/59/643457559.db2.gz VOSBMIKEILSHGQ-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](O)(CC)C2)c([O-])c1 ZINC000877691757 643457565 /nfs/dbraw/zinc/45/75/65/643457565.db2.gz VOSBMIKEILSHGQ-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1cccc(O)c1C[N@@H+]1Cc2cccc([O-])c2C1 ZINC000877703200 643468957 /nfs/dbraw/zinc/46/89/57/643468957.db2.gz VVUAGIVUMMOINI-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN Cc1cccc(O)c1C[N@H+]1Cc2cccc([O-])c2C1 ZINC000877703200 643468958 /nfs/dbraw/zinc/46/89/58/643468958.db2.gz VVUAGIVUMMOINI-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000877743374 643520644 /nfs/dbraw/zinc/52/06/44/643520644.db2.gz KERHMRBQMCYBLA-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000877743374 643520646 /nfs/dbraw/zinc/52/06/46/643520646.db2.gz KERHMRBQMCYBLA-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccnn1CC1CC1)c1ccccc1[O-] ZINC000877756021 643536512 /nfs/dbraw/zinc/53/65/12/643536512.db2.gz ZAXJXOFPBKVHBZ-GFCCVEGCSA-N 0 3 271.364 2.850 20 10 CFCDHN COC(=O)c1cc(C[NH2+][C@H](C)c2ccccc2[O-])[nH]c1C ZINC000877757543 643536821 /nfs/dbraw/zinc/53/68/21/643536821.db2.gz MJBFLLMMKWHZKQ-SNVBAGLBSA-N 0 3 288.347 2.666 20 10 CFCDHN COc1cc(Cl)cc(CN[C@H](C)c2ccnn2C)c1O ZINC000877763279 643542937 /nfs/dbraw/zinc/54/29/37/643542937.db2.gz SWGRRDNHZFHXBD-SECBINFHSA-N 0 3 295.770 2.639 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000877762713 643543383 /nfs/dbraw/zinc/54/33/83/643543383.db2.gz OFMZTTAKJPSPAF-INIZCTEOSA-N 0 3 295.386 2.772 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000877762713 643543386 /nfs/dbraw/zinc/54/33/86/643543386.db2.gz OFMZTTAKJPSPAF-INIZCTEOSA-N 0 3 295.386 2.772 20 10 CFCDHN Cc1ccc(CN[C@H](C)c2nccnc2C)c(O)c1 ZINC000877828658 643594391 /nfs/dbraw/zinc/59/43/91/643594391.db2.gz NOGRSWCKTXYMBY-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCOC)cc1F ZINC000127129436 643907269 /nfs/dbraw/zinc/90/72/69/643907269.db2.gz PBMRGUQTQMHHJX-UHFFFAOYSA-N 0 3 268.376 2.750 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N[C@@H]1CCCC[C@@H]1C)c1ccccc1[O-] ZINC000879647610 644360984 /nfs/dbraw/zinc/36/09/84/644360984.db2.gz GCTNYFIJNOJTJK-GZBFAFLISA-N 0 3 290.407 2.738 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)Nc1nccs1 ZINC000879648306 644361601 /nfs/dbraw/zinc/36/16/01/644361601.db2.gz JHPSZRZQQMARBA-NXEZZACHSA-N 0 3 291.376 2.527 20 10 CFCDHN Cc1ccccc1CNC(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879647989 644361765 /nfs/dbraw/zinc/36/17/65/644361765.db2.gz VAKPSWGPDLKFDB-CQSZACIVSA-N 0 3 298.386 2.668 20 10 CFCDHN Cc1cnc([C@@H](C)N[C@H](C)c2ccccc2O)cn1 ZINC000879648840 644363195 /nfs/dbraw/zinc/36/31/95/644363195.db2.gz BSKGSTVMTPPQLR-VXGBXAGGSA-N 0 3 257.337 2.902 20 10 CFCDHN C[C@H]([NH2+]CC[C@H]1COC(C)(C)O1)c1ccccc1[O-] ZINC000879650187 644364496 /nfs/dbraw/zinc/36/44/96/644364496.db2.gz NLBZVBFLRHQHIN-RYUDHWBXSA-N 0 3 265.353 2.584 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)Nc1nccs1 ZINC000879651126 644364593 /nfs/dbraw/zinc/36/45/93/644364593.db2.gz JHPSZRZQQMARBA-VHSXEESVSA-N 0 3 291.376 2.527 20 10 CFCDHN Cc1ccc(O)c(CN2CCOC[C@H]2CC(C)C)c1 ZINC000093340276 650938698 /nfs/dbraw/zinc/93/86/98/650938698.db2.gz NVXRSAQEYMDTNX-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000094618373 650960176 /nfs/dbraw/zinc/96/01/76/650960176.db2.gz TTWLOLBXPCSFGC-MFKMUULPSA-N 0 3 255.333 2.853 20 10 CFCDHN Cc1ccnc(NCc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000882880227 645488430 /nfs/dbraw/zinc/48/84/30/645488430.db2.gz IJSYLCRYYFTSSF-UHFFFAOYSA-N 0 3 296.418 2.754 20 10 CFCDHN CC(C)N1CCC[C@@H](C[NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000882983779 645541902 /nfs/dbraw/zinc/54/19/02/645541902.db2.gz OSMKIDPPFWGHQL-LBPRGKRZSA-N 0 3 298.377 2.880 20 10 CFCDHN CCN(CC)c1ccc(CN(C)[C@H]2CCOC2)cc1F ZINC000132081164 645875776 /nfs/dbraw/zinc/87/57/76/645875776.db2.gz SNZYGMHIMVNZPH-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN COC[C@@H](C)[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000132564552 645935298 /nfs/dbraw/zinc/93/52/98/645935298.db2.gz YOCMWQIBOIUJBE-SECBINFHSA-N 0 3 288.185 2.588 20 10 CFCDHN CN(C(=O)CC[N@H+](C)Cc1ccccc1[O-])c1ccccc1 ZINC000135187134 646488044 /nfs/dbraw/zinc/48/80/44/646488044.db2.gz MIMRKMNKBXMFAG-UHFFFAOYSA-N 0 3 298.386 2.877 20 10 CFCDHN CN(C(=O)CC[N@@H+](C)Cc1ccccc1[O-])c1ccccc1 ZINC000135187134 646488051 /nfs/dbraw/zinc/48/80/51/646488051.db2.gz MIMRKMNKBXMFAG-UHFFFAOYSA-N 0 3 298.386 2.877 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886064420 646850502 /nfs/dbraw/zinc/85/05/02/646850502.db2.gz DJZJMVJAFJHUBR-HOCLYGCPSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886064420 646850508 /nfs/dbraw/zinc/85/05/08/646850508.db2.gz DJZJMVJAFJHUBR-HOCLYGCPSA-N 0 3 261.365 2.782 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c([O-])c1 ZINC000136706480 646868651 /nfs/dbraw/zinc/86/86/51/646868651.db2.gz ULIWAFUVQVQKPB-AWEZNQCLSA-N 0 3 291.391 2.982 20 10 CFCDHN CC(C)[C@H](NCc1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000886493652 647018849 /nfs/dbraw/zinc/01/88/49/647018849.db2.gz UULHERJUJOZAPE-KRWDZBQOSA-N 0 3 286.423 2.973 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886520525 647026817 /nfs/dbraw/zinc/02/68/17/647026817.db2.gz GSSLYWNCMLKIHO-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H](C)[N@H+](C)CCN[C@@H](C)c1c([O-])cccc1F ZINC000886520525 647026822 /nfs/dbraw/zinc/02/68/22/647026822.db2.gz GSSLYWNCMLKIHO-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@H](C)[N@@H+](C)CCN[C@@H](C)c1c([O-])cccc1F ZINC000886520525 647026826 /nfs/dbraw/zinc/02/68/26/647026826.db2.gz GSSLYWNCMLKIHO-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@@H](N[C@@H]1C[NH2+]C[C@H]1C)c1cccc(C(F)(F)F)c1[O-] ZINC000925782613 648321162 /nfs/dbraw/zinc/32/11/62/648321162.db2.gz GTFRSTLMBDSIMI-KBVBSXBZSA-N 0 3 288.313 2.670 20 10 CFCDHN C[C@@H](N[C@@H]1C[NH2+]C[C@H]1C)c1ccc2ccccc2c1[O-] ZINC000925783599 648322227 /nfs/dbraw/zinc/32/22/27/648322227.db2.gz KGSBZFSABQFDKO-XHBSWPGZSA-N 0 3 270.376 2.804 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1C=C[C@H]2C[C@@H]1CO2)c1ccccc1[O-] ZINC000926940804 648665399 /nfs/dbraw/zinc/66/53/99/648665399.db2.gz WIVMQPITYKXGSF-FQUUOJAGSA-N 0 3 259.349 2.634 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCO[C@@H]2CCOC2)c1[O-] ZINC000927081037 648701526 /nfs/dbraw/zinc/70/15/26/648701526.db2.gz MVLQARPCEBMAKN-DGCLKSJQSA-N 0 3 299.798 2.810 20 10 CFCDHN Cc1cc(CN2CCc3nccc(N)c3C2)ccc1N(C)C ZINC000931518678 649446355 /nfs/dbraw/zinc/44/63/55/649446355.db2.gz QZBAIYYBYXLYNF-UHFFFAOYSA-N 0 3 296.418 2.597 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000305745009 651073905 /nfs/dbraw/zinc/07/39/05/651073905.db2.gz MYRPSCAPOPSRRE-QGZVFWFLSA-N 0 3 283.371 2.874 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000305745009 651073906 /nfs/dbraw/zinc/07/39/06/651073906.db2.gz MYRPSCAPOPSRRE-QGZVFWFLSA-N 0 3 283.371 2.874 20 10 CFCDHN CC[C@@H]([NH2+]CCO[C@H]1CC1(F)F)c1ccccc1[O-] ZINC000690732699 770837542 /nfs/dbraw/zinc/83/75/42/770837542.db2.gz SNKCFQHOXORJSR-YPMHNXCESA-N 0 3 271.307 2.857 20 10 CFCDHN C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000694086823 775359732 /nfs/dbraw/zinc/35/97/32/775359732.db2.gz ZZFCQGGAHQGDCI-IUODEOHRSA-N 0 3 268.360 2.995 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CC[C@H](C3CC3)O1)CC2 ZINC000722328705 776473453 /nfs/dbraw/zinc/47/34/53/776473453.db2.gz LDWQYTRBXNRWGA-SQWLQELKSA-N 0 3 273.376 2.927 20 10 CFCDHN C[C@@]1(O)CC[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587994 777268159 /nfs/dbraw/zinc/26/81/59/777268159.db2.gz KYUOECGQWLTGOV-DLBZAZTESA-N 0 3 289.350 2.840 20 10 CFCDHN C[C@@]1(O)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1F ZINC001231587994 777268165 /nfs/dbraw/zinc/26/81/65/777268165.db2.gz KYUOECGQWLTGOV-DLBZAZTESA-N 0 3 289.350 2.840 20 10 CFCDHN C[C@H]1CC[C@@H](CO)[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231587564 777268496 /nfs/dbraw/zinc/26/84/96/777268496.db2.gz FNPPRERWIHCPJI-JSGCOSHPSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@H]1CC[C@@H](CO)[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231587564 777268502 /nfs/dbraw/zinc/26/85/02/777268502.db2.gz FNPPRERWIHCPJI-JSGCOSHPSA-N 0 3 271.360 2.891 20 10 CFCDHN CN1CCC[N@H+](Cc2ccc3ccccc3c2[O-])CC1 ZINC001231878292 777362168 /nfs/dbraw/zinc/36/21/68/777362168.db2.gz GZIAAEVVSOJCKP-UHFFFAOYSA-N 0 3 270.376 2.683 20 10 CFCDHN CN1CCC[N@@H+](Cc2ccc3ccccc3c2[O-])CC1 ZINC001231878292 777362172 /nfs/dbraw/zinc/36/21/72/777362172.db2.gz GZIAAEVVSOJCKP-UHFFFAOYSA-N 0 3 270.376 2.683 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1cccc3c[nH]nc31)CC2 ZINC001231974267 777398411 /nfs/dbraw/zinc/39/84/11/777398411.db2.gz ZKYIYVSMSWOCGY-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1cccc3c[nH]nc31)CC2 ZINC001231974267 777398419 /nfs/dbraw/zinc/39/84/19/777398419.db2.gz ZKYIYVSMSWOCGY-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN CCOC(=O)c1c(CN(C)CC)c2ccccc2n1C ZINC001233270731 777856232 /nfs/dbraw/zinc/85/62/32/777856232.db2.gz YDGGYEQBFSRMJY-UHFFFAOYSA-N 0 3 274.364 2.807 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](CO)CC[C@@H]2C)c1[O-] ZINC001233288098 777869604 /nfs/dbraw/zinc/86/96/04/777869604.db2.gz WGAQWUYQPLBRJI-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](CO)CC[C@@H]2C)c1[O-] ZINC001233288098 777869613 /nfs/dbraw/zinc/86/96/13/777869613.db2.gz WGAQWUYQPLBRJI-QWRGUYRKSA-N 0 3 299.798 2.647 20 10 CFCDHN CCN(Cc1ccc(N(C)C)cc1)Cc1cccc(N)n1 ZINC001233372961 777917338 /nfs/dbraw/zinc/91/73/38/777917338.db2.gz MTGFORWNALEKSQ-UHFFFAOYSA-N 0 3 284.407 2.752 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+](C)CC3COC3)c2c1 ZINC001234562975 778254170 /nfs/dbraw/zinc/25/41/70/778254170.db2.gz ZHBGQMFEWSWEBT-UHFFFAOYSA-N 0 3 287.359 2.632 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+](C)CC3COC3)c2c1 ZINC001234562975 778254175 /nfs/dbraw/zinc/25/41/75/778254175.db2.gz ZHBGQMFEWSWEBT-UHFFFAOYSA-N 0 3 287.359 2.632 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2[O-])C[C@@H]1O ZINC001235002325 778350323 /nfs/dbraw/zinc/35/03/23/778350323.db2.gz PGJXJALAPJHFEH-GUYCJALGSA-N 0 3 283.371 2.872 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2[O-])C[C@@H]1O ZINC001235002325 778350331 /nfs/dbraw/zinc/35/03/31/778350331.db2.gz PGJXJALAPJHFEH-GUYCJALGSA-N 0 3 283.371 2.872 20 10 CFCDHN [O-]c1c(CN2CC[C@H]3[NH2+]CC[C@H]32)cccc1-c1ccccc1 ZINC001235078349 778372133 /nfs/dbraw/zinc/37/21/33/778372133.db2.gz LHIXXFUUJTWGNK-QZTJIDSGSA-N 0 3 294.398 2.995 20 10 CFCDHN COC(=O)CC[N@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680458 778535135 /nfs/dbraw/zinc/53/51/35/778535135.db2.gz UZFCJPPTJJAJAC-UHFFFAOYSA-N 0 3 279.380 2.685 20 10 CFCDHN COC(=O)CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235680458 778535138 /nfs/dbraw/zinc/53/51/38/778535138.db2.gz UZFCJPPTJJAJAC-UHFFFAOYSA-N 0 3 279.380 2.685 20 10 CFCDHN CC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CC[NH2+]1 ZINC001235730074 778548756 /nfs/dbraw/zinc/54/87/56/778548756.db2.gz IMCCFUWQQAYMTI-LBPRGKRZSA-N 0 3 268.788 2.538 20 10 CFCDHN CCCN(Cc1ccc(Cl)cc1[O-])[C@@H]1CC[NH2+]C1 ZINC001236324369 778781128 /nfs/dbraw/zinc/78/11/28/778781128.db2.gz UHNWKQQBTBXMDB-CYBMUJFWSA-N 0 3 268.788 2.620 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]([NH3+])[C@@H]2C)cc1Cl ZINC001236417631 778811543 /nfs/dbraw/zinc/81/15/43/778811543.db2.gz CKSORMDUWCRGMZ-GWCFXTLKSA-N 0 3 268.788 2.666 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001236784027 778935014 /nfs/dbraw/zinc/93/50/14/778935014.db2.gz REAHHADOWRZQGK-KRWDZBQOSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001236784027 778935016 /nfs/dbraw/zinc/93/50/16/778935016.db2.gz REAHHADOWRZQGK-KRWDZBQOSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(CN2CCCC(=O)[C@@H](C)C2)c(O)c1 ZINC001236784047 778935045 /nfs/dbraw/zinc/93/50/45/778935045.db2.gz RJFKZDOJNUTWAV-LBPRGKRZSA-N 0 3 261.365 2.756 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236786941 778937101 /nfs/dbraw/zinc/93/71/01/778937101.db2.gz SLLUFHXFEDYFBV-RHSMWYFYSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236786941 778937105 /nfs/dbraw/zinc/93/71/05/778937105.db2.gz SLLUFHXFEDYFBV-RHSMWYFYSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(CN2CC3(C2)C[C@H](F)CS3)c(O)c1 ZINC001236791767 778939811 /nfs/dbraw/zinc/93/98/11/778939811.db2.gz KMDIXQNGCWZRIL-ZDUSSCGKSA-N 0 3 281.396 2.984 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001236806956 778947091 /nfs/dbraw/zinc/94/70/91/778947091.db2.gz CZLXXHPBBVDSJU-KRWDZBQOSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001236806956 778947097 /nfs/dbraw/zinc/94/70/97/778947097.db2.gz CZLXXHPBBVDSJU-KRWDZBQOSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c([O-])c1 ZINC001236807700 778947295 /nfs/dbraw/zinc/94/72/95/778947295.db2.gz JVCZTHZVDWITRG-BETUJISGSA-N 0 3 261.365 2.941 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c([O-])c1 ZINC001236807700 778947299 /nfs/dbraw/zinc/94/72/99/778947299.db2.gz JVCZTHZVDWITRG-BETUJISGSA-N 0 3 261.365 2.941 20 10 CFCDHN COc1cc(C)c(C[NH+]2CCC3(CCOC3)CC2)c([O-])c1 ZINC001236817055 778952273 /nfs/dbraw/zinc/95/22/73/778952273.db2.gz CGAJOOGGRLDYQD-UHFFFAOYSA-N 0 3 291.391 2.712 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827444 778956576 /nfs/dbraw/zinc/95/65/76/778956576.db2.gz RZUJHWYIGZGJLE-CQSZACIVSA-N 0 3 285.343 2.540 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827444 778956577 /nfs/dbraw/zinc/95/65/77/778956577.db2.gz RZUJHWYIGZGJLE-CQSZACIVSA-N 0 3 285.343 2.540 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@H](O)[C@@H](F)CC1 ZINC001236827539 778957045 /nfs/dbraw/zinc/95/70/45/778957045.db2.gz UYUCORUMYQTNNI-HOTGVXAUSA-N 0 3 289.350 2.840 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@H](O)[C@@H](F)CC1 ZINC001236827539 778957051 /nfs/dbraw/zinc/95/70/51/778957051.db2.gz UYUCORUMYQTNNI-HOTGVXAUSA-N 0 3 289.350 2.840 20 10 CFCDHN C[C@H]1C[C@H](O)CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832648 778957653 /nfs/dbraw/zinc/95/76/53/778957653.db2.gz JWUAMLQYLKZNTC-BLLLJJGKSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@H]1C[C@H](O)CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832648 778957659 /nfs/dbraw/zinc/95/76/59/778957659.db2.gz JWUAMLQYLKZNTC-BLLLJJGKSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832649 778957946 /nfs/dbraw/zinc/95/79/46/778957946.db2.gz JWUAMLQYLKZNTC-LRDDRELGSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@H]1C[C@@H](O)CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832649 778957950 /nfs/dbraw/zinc/95/79/50/778957950.db2.gz JWUAMLQYLKZNTC-LRDDRELGSA-N 0 3 271.360 2.891 20 10 CFCDHN CCC[N@H+](CCOC)Cc1ccc(OCC)cc1[O-] ZINC001237043484 778996156 /nfs/dbraw/zinc/99/61/56/778996156.db2.gz GKODGHOMRVKCSA-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCC[N@@H+](CCOC)Cc1ccc(OCC)cc1[O-] ZINC001237043484 778996159 /nfs/dbraw/zinc/99/61/59/778996159.db2.gz GKODGHOMRVKCSA-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN COC(CN(C)Cc1ccc(C(C)C)cc1O)OC ZINC001237049013 778998601 /nfs/dbraw/zinc/99/86/01/778998601.db2.gz KPKKENABEAAYCN-UHFFFAOYSA-N 0 3 267.369 2.566 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001237047348 778998791 /nfs/dbraw/zinc/99/87/91/778998791.db2.gz LRYRITBITOCJOU-DOMZBBRYSA-N 0 3 289.375 2.592 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001237047348 778998795 /nfs/dbraw/zinc/99/87/95/778998795.db2.gz LRYRITBITOCJOU-DOMZBBRYSA-N 0 3 289.375 2.592 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237049411 779001056 /nfs/dbraw/zinc/00/10/56/779001056.db2.gz OFQMHAQPCPLVHU-HOTGVXAUSA-N 0 3 275.392 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237049411 779001062 /nfs/dbraw/zinc/00/10/62/779001062.db2.gz OFQMHAQPCPLVHU-HOTGVXAUSA-N 0 3 275.392 2.984 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056008 779002206 /nfs/dbraw/zinc/00/22/06/779002206.db2.gz UMIVTDDKSMVIKR-MRXNPFEDSA-N 0 3 290.407 2.568 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056008 779002211 /nfs/dbraw/zinc/00/22/11/779002211.db2.gz UMIVTDDKSMVIKR-MRXNPFEDSA-N 0 3 290.407 2.568 20 10 CFCDHN CN1CCCc2cc(CN3CCNC4=CCCC[C@@H]43)ccc21 ZINC001237220946 779051722 /nfs/dbraw/zinc/05/17/22/779051722.db2.gz UFLLKUALRQMTCR-IBGZPJMESA-N 0 3 297.446 2.911 20 10 CFCDHN Cc1cc(CN2CCNC3=CCCC[C@@H]32)ccc1N(C)C ZINC001237226498 779056161 /nfs/dbraw/zinc/05/61/61/779056161.db2.gz XFEOEWZVWCDWPE-SFHVURJKSA-N 0 3 285.435 2.903 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cccc(OC(F)(F)F)c2[O-])C1 ZINC001233727476 779076094 /nfs/dbraw/zinc/07/60/94/779076094.db2.gz NHFWLCPAOFBUOA-JTQLQIEISA-N 0 3 291.269 2.512 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cccc(OC(F)(F)F)c2[O-])C1 ZINC001233727476 779076099 /nfs/dbraw/zinc/07/60/99/779076099.db2.gz NHFWLCPAOFBUOA-JTQLQIEISA-N 0 3 291.269 2.512 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1Cl ZINC001237406363 779100050 /nfs/dbraw/zinc/10/00/50/779100050.db2.gz UMPFPCUXNGPJQM-SWLSCSKDSA-N 0 3 294.826 2.928 20 10 CFCDHN CC[N@H+](Cc1c(C)cccc1[O-])C1CCN(C)CC1 ZINC001237490655 779119226 /nfs/dbraw/zinc/11/92/26/779119226.db2.gz ZESVWOIKWQXIOU-UHFFFAOYSA-N 0 3 262.397 2.617 20 10 CFCDHN CC[N@@H+](Cc1c(C)cccc1[O-])C1CCN(C)CC1 ZINC001237490655 779119230 /nfs/dbraw/zinc/11/92/30/779119230.db2.gz ZESVWOIKWQXIOU-UHFFFAOYSA-N 0 3 262.397 2.617 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(N2CC(F)(F)C2)CC1 ZINC001237488108 779119021 /nfs/dbraw/zinc/11/90/21/779119021.db2.gz QZNZESFFPRQTEQ-UHFFFAOYSA-N 0 3 296.361 2.616 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(C[C@@H](F)CO2)CC1 ZINC001237493419 779119837 /nfs/dbraw/zinc/11/98/37/779119837.db2.gz YGLKMIHRUISJDD-CYBMUJFWSA-N 0 3 279.355 2.794 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](O)C[C@H]2C)c1[O-] ZINC001237685109 779161743 /nfs/dbraw/zinc/16/17/43/779161743.db2.gz FBAPLRKQFVUODX-MFKMUULPSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](O)C[C@H]2C)c1[O-] ZINC001237685109 779161744 /nfs/dbraw/zinc/16/17/44/779161744.db2.gz FBAPLRKQFVUODX-MFKMUULPSA-N 0 3 269.772 2.699 20 10 CFCDHN CC[N@H+](CCCC(=O)OC)Cc1cc(F)cc(C)c1[O-] ZINC001238057294 779241398 /nfs/dbraw/zinc/24/13/98/779241398.db2.gz KCFUIZROKVBLOA-UHFFFAOYSA-N 0 3 283.343 2.615 20 10 CFCDHN CC[N@@H+](CCCC(=O)OC)Cc1cc(F)cc(C)c1[O-] ZINC001238057294 779241401 /nfs/dbraw/zinc/24/14/01/779241401.db2.gz KCFUIZROKVBLOA-UHFFFAOYSA-N 0 3 283.343 2.615 20 10 CFCDHN CCOC1CC[NH+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238060613 779243029 /nfs/dbraw/zinc/24/30/29/779243029.db2.gz CHYDCIMISITWOZ-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c1[O-] ZINC001238065322 779243726 /nfs/dbraw/zinc/24/37/26/779243726.db2.gz SZUNULWUAVJSBY-HDJSIYSDSA-N 0 3 267.344 2.575 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c1[O-] ZINC001238065322 779243729 /nfs/dbraw/zinc/24/37/29/779243729.db2.gz SZUNULWUAVJSBY-HDJSIYSDSA-N 0 3 267.344 2.575 20 10 CFCDHN CC(=O)[C@H]1CCCN(Cc2cc(F)cc(C)c2O)C1 ZINC001238070047 779245984 /nfs/dbraw/zinc/24/59/84/779245984.db2.gz MHFJVVWJFWDYGR-LBPRGKRZSA-N 0 3 265.328 2.641 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(C)(OC)CC2)c([O-])c1 ZINC001236784062 779637131 /nfs/dbraw/zinc/63/71/31/779637131.db2.gz RSLWOQILAAVCRH-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN C[C@H](O)CCN(Cc1ccco1)Cc1ccccc1O ZINC001117757393 780628982 /nfs/dbraw/zinc/62/89/82/780628982.db2.gz VFCFCEMATVNESB-ZDUSSCGKSA-N 0 3 275.348 2.758 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CO[C@H](C3CC3)C1)CC2 ZINC000700989367 780745482 /nfs/dbraw/zinc/74/54/82/780745482.db2.gz DLBBCGIKTRWDRQ-NFAWXSAZSA-N 0 3 259.349 2.537 20 10 CFCDHN CN1CCC=C(c2ccn(Cc3ccc(F)cc3)c(=O)c2)C1 ZINC001241572293 780989999 /nfs/dbraw/zinc/98/99/99/780989999.db2.gz VAAAPTSIKACOLN-UHFFFAOYSA-N 0 3 298.361 2.755 20 10 CFCDHN CCN1CCN(c2ccc(/C(C)=C/C=C/N)cc2)CC1 ZINC001241742866 781105038 /nfs/dbraw/zinc/10/50/38/781105038.db2.gz JRXUGDWPGBDBBJ-QLIUWUHBSA-N 0 3 271.408 2.704 20 10 CFCDHN CN(C)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000708421151 781272977 /nfs/dbraw/zinc/27/29/77/781272977.db2.gz PXBXWARZJADONC-CHWSQXEVSA-N 0 3 284.350 2.633 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2C[C@@H](OC)C2)c1[O-] ZINC000708715772 781278690 /nfs/dbraw/zinc/27/86/90/781278690.db2.gz YXYJGXHXPXYLPP-WVSHTKLVSA-N 0 3 285.771 2.569 20 10 CFCDHN C[C@H]([NH2+]CCOC1CCC1)c1cc(F)ccc1[O-] ZINC000709816073 781319102 /nfs/dbraw/zinc/31/91/02/781319102.db2.gz QSKBBKAUSUWJNQ-JTQLQIEISA-N 0 3 253.317 2.751 20 10 CFCDHN CC(C)(C)N1CC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000822133894 781893636 /nfs/dbraw/zinc/89/36/36/781893636.db2.gz WUHYJVIPVOWQKB-KBPBESRZSA-N 0 3 274.408 2.842 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H](O)C(F)F ZINC000295030253 199309512 /nfs/dbraw/zinc/30/95/12/199309512.db2.gz LOYDZMRIYVQWJY-PWSUYJOCSA-N 0 3 293.741 2.848 20 10 CFCDHN COc1ccc(CNC[C@H](OC)C(C)C)cc1C ZINC000072924661 346949007 /nfs/dbraw/zinc/94/90/07/346949007.db2.gz IXWBTKXWXBXSNC-HNNXBMFYSA-N 0 3 251.370 2.764 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(CF)CC2)c1[O-] ZINC000295123141 199357959 /nfs/dbraw/zinc/35/79/59/199357959.db2.gz WWCFCNOOTCJWQB-UHFFFAOYSA-N 0 3 267.344 2.972 20 10 CFCDHN COCCN(C)Cc1ccc(N2CCCCC2)cc1 ZINC000053420483 346546236 /nfs/dbraw/zinc/54/62/36/346546236.db2.gz RXHUVBMKAUMIKC-UHFFFAOYSA-N 0 3 262.397 2.755 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)c1ccsc1)CC2 ZINC000297628910 200246160 /nfs/dbraw/zinc/24/61/60/200246160.db2.gz JFBFMFLOGDDQCN-OCCSQVGLSA-N 0 3 275.373 2.764 20 10 CFCDHN C[C@@H](NCC[S@](=O)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000127304520 296126838 /nfs/dbraw/zinc/12/68/38/296126838.db2.gz HHRMCFBNKHZVPJ-ZUOKHONESA-N 0 3 296.480 2.950 20 10 CFCDHN C[C@@H](NCc1ccc(N(C)C)cc1)c1ccncc1 ZINC000020120954 372235375 /nfs/dbraw/zinc/23/53/75/372235375.db2.gz OPLYUFYMENJXEQ-CYBMUJFWSA-N 0 3 255.365 2.998 20 10 CFCDHN Cc1n[nH]cc1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000038011435 372763553 /nfs/dbraw/zinc/76/35/53/372763553.db2.gz YIBVLEMNVUKVAQ-NSHDSACASA-N 0 3 258.369 2.635 20 10 CFCDHN COCc1cccc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000038010435 372764022 /nfs/dbraw/zinc/76/40/22/372764022.db2.gz FCYFCWZMMBFWNB-UHFFFAOYSA-N 0 3 257.333 2.828 20 10 CFCDHN COc1cccc(CN2CC[C@H](OCC(C)C)C2)c1O ZINC000091964459 375074006 /nfs/dbraw/zinc/07/40/06/375074006.db2.gz AHQAOXXXPUUPJQ-AWEZNQCLSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1[O-] ZINC000091964459 375074012 /nfs/dbraw/zinc/07/40/12/375074012.db2.gz AHQAOXXXPUUPJQ-AWEZNQCLSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](OCC(C)C)C2)c1[O-] ZINC000091964459 375074019 /nfs/dbraw/zinc/07/40/19/375074019.db2.gz AHQAOXXXPUUPJQ-AWEZNQCLSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@H+](C)CCc2nccs2)c1[O-] ZINC000093843999 375322623 /nfs/dbraw/zinc/32/26/23/375322623.db2.gz WNAUQODPTFMADK-UHFFFAOYSA-N 0 3 278.377 2.532 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCc2nccs2)c1[O-] ZINC000093843999 375322626 /nfs/dbraw/zinc/32/26/26/375322626.db2.gz WNAUQODPTFMADK-UHFFFAOYSA-N 0 3 278.377 2.532 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H](C)CCSC)c1[O-] ZINC000093558847 375267658 /nfs/dbraw/zinc/26/76/58/375267658.db2.gz LEHTXOMKRQLPME-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H](C)CCSC)c1[O-] ZINC000093558847 375267663 /nfs/dbraw/zinc/26/76/63/375267663.db2.gz LEHTXOMKRQLPME-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN COc1ccc(OCC[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000111235747 375833351 /nfs/dbraw/zinc/83/33/51/375833351.db2.gz PXDOZVCAEYVMOC-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1ccc(OCC[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000111235747 375833357 /nfs/dbraw/zinc/83/33/57/375833357.db2.gz PXDOZVCAEYVMOC-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN CS[C@@H]1CCC[C@@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000117394446 376240900 /nfs/dbraw/zinc/24/09/00/376240900.db2.gz RCACWVLSQUYYDH-VXGBXAGGSA-N 0 3 295.404 2.885 20 10 CFCDHN Cc1cccc(C[NH2+]CCN2CCC(C)CC2)c1[O-] ZINC000124707102 377080311 /nfs/dbraw/zinc/08/03/11/377080311.db2.gz FSBJMWYJTNLLKP-UHFFFAOYSA-N 0 3 262.397 2.522 20 10 CFCDHN C[C@H]1C[C@@H](N(C)Cc2c([O-])cccc2Cl)CC[N@@H+]1C ZINC000130657948 377590046 /nfs/dbraw/zinc/59/00/46/377590046.db2.gz AUSXKDQBBUEAHV-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@@H](N(C)Cc2c([O-])cccc2Cl)CC[N@H+]1C ZINC000130657948 377590053 /nfs/dbraw/zinc/59/00/53/377590053.db2.gz AUSXKDQBBUEAHV-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@@H]([N@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657948 377590059 /nfs/dbraw/zinc/59/00/59/377590059.db2.gz AUSXKDQBBUEAHV-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@@H]([N@@H+](C)Cc2c([O-])cccc2Cl)CCN1C ZINC000130657948 377590062 /nfs/dbraw/zinc/59/00/62/377590062.db2.gz AUSXKDQBBUEAHV-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000134625665 378039937 /nfs/dbraw/zinc/03/99/37/378039937.db2.gz ZRVBQGYRWVCDLM-OFQRWUPVSA-N 0 3 274.408 2.730 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCc2ccnn2C)cc1 ZINC000152182362 378402555 /nfs/dbraw/zinc/40/25/55/378402555.db2.gz WZQLWKRUNZOFAP-ZDUSSCGKSA-N 0 3 272.396 2.727 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1cccc(F)c1)c1ccccc1[O-] ZINC000154113155 378541457 /nfs/dbraw/zinc/54/14/57/378541457.db2.gz YCSABGWJOJRIMA-BZNIZROVSA-N 0 3 275.323 2.916 20 10 CFCDHN CCCNC(=O)C1([NH2+]Cc2ccccc2[O-])CCCCC1 ZINC000154525174 378576449 /nfs/dbraw/zinc/57/64/49/378576449.db2.gz CBMFIXWLMDCLIA-UHFFFAOYSA-N 0 3 290.407 2.711 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H]2c3ccccc3C(=O)N2C)c1[O-] ZINC000529669754 383745320 /nfs/dbraw/zinc/74/53/20/383745320.db2.gz PBVFMKQURUJSOQ-INIZCTEOSA-N 0 3 296.370 2.617 20 10 CFCDHN CCN(CC)c1ccc(CNCC2=CCCOC2)cc1 ZINC000178160331 380415165 /nfs/dbraw/zinc/41/51/65/380415165.db2.gz SJSFCPQJPGIZCH-UHFFFAOYSA-N 0 3 274.408 2.969 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC(C)(O)CC2)c([O-])c1 ZINC000179726040 380575088 /nfs/dbraw/zinc/57/50/88/380575088.db2.gz WMGLGWIKHHPZSJ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000179749991 380575678 /nfs/dbraw/zinc/57/56/78/380575678.db2.gz ATFRUQWFWGRDDE-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN CO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000179749991 380575683 /nfs/dbraw/zinc/57/56/83/380575683.db2.gz ATFRUQWFWGRDDE-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(F)ccc1[O-] ZINC000180257978 380640082 /nfs/dbraw/zinc/64/00/82/380640082.db2.gz RUBVDJUCBSJMFY-CABCVRRESA-N 0 3 278.371 2.590 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)ccc1[O-] ZINC000180257978 380640086 /nfs/dbraw/zinc/64/00/86/380640086.db2.gz RUBVDJUCBSJMFY-CABCVRRESA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)c1ccccc1[O-] ZINC000179889969 380591679 /nfs/dbraw/zinc/59/16/79/380591679.db2.gz KPDSLKKBCJNIRZ-MEDUHNTESA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)c1[O-] ZINC000180484024 380666647 /nfs/dbraw/zinc/66/66/47/380666647.db2.gz OVXXMNIUVUTMMW-INIZCTEOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](Oc3cccnc3)C2)c1[O-] ZINC000180484024 380666655 /nfs/dbraw/zinc/66/66/55/380666655.db2.gz OVXXMNIUVUTMMW-INIZCTEOSA-N 0 3 284.359 2.749 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCc2ncc(C)s2)c1 ZINC000180558226 380676790 /nfs/dbraw/zinc/67/67/90/380676790.db2.gz YHCNMRPEUZZQJL-UHFFFAOYSA-N 0 3 292.404 2.840 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCc2ncc(C)s2)c1 ZINC000180558226 380676798 /nfs/dbraw/zinc/67/67/98/380676798.db2.gz YHCNMRPEUZZQJL-UHFFFAOYSA-N 0 3 292.404 2.840 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@H]2CCOC2)c1[O-] ZINC000180624900 380682760 /nfs/dbraw/zinc/68/27/60/380682760.db2.gz DRIKKRBAEZFLKQ-LLVKDONJSA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CCOC2)c1[O-] ZINC000180624900 380682767 /nfs/dbraw/zinc/68/27/67/380682767.db2.gz DRIKKRBAEZFLKQ-LLVKDONJSA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000180423217 380656985 /nfs/dbraw/zinc/65/69/85/380656985.db2.gz GFORIRVLNBRJDL-UKRRQHHQSA-N 0 3 262.397 2.615 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000180423217 380656991 /nfs/dbraw/zinc/65/69/91/380656991.db2.gz GFORIRVLNBRJDL-UKRRQHHQSA-N 0 3 262.397 2.615 20 10 CFCDHN COC(=O)c1cnc(SCC[C@H]2CCCN2C)s1 ZINC000295433523 380850550 /nfs/dbraw/zinc/85/05/50/380850550.db2.gz ZGMLYMFHALKQOC-SECBINFHSA-N 0 3 286.422 2.506 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1ccccc1[O-] ZINC000368103617 380928024 /nfs/dbraw/zinc/92/80/24/380928024.db2.gz XLQWJUNDWLBTJM-DGCLKSJQSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccccc1[O-] ZINC000368103617 380928026 /nfs/dbraw/zinc/92/80/26/380928026.db2.gz XLQWJUNDWLBTJM-DGCLKSJQSA-N 0 3 271.364 2.714 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1COc2ccc(F)cc2C1 ZINC000288521541 381014075 /nfs/dbraw/zinc/01/40/75/381014075.db2.gz JKIBAYLLXMWOGU-CQSZACIVSA-N 0 3 273.307 2.625 20 10 CFCDHN C[C@@H]1Oc2ccccc2[C@@H]1NCc1cc2c(cc1O)OCO2 ZINC000288623871 381018361 /nfs/dbraw/zinc/01/83/61/381018361.db2.gz RYJMJUPBSAVYCO-DYZYQPBXSA-N 0 3 299.326 2.733 20 10 CFCDHN Cc1ncccc1O[C@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC000368977816 381172593 /nfs/dbraw/zinc/17/25/93/381172593.db2.gz KRCIIUXKZKCLAS-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ncccc1O[C@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000368977816 381172599 /nfs/dbraw/zinc/17/25/99/381172599.db2.gz KRCIIUXKZKCLAS-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN CN(C)[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000296048528 381230159 /nfs/dbraw/zinc/23/01/59/381230159.db2.gz RABHESISDNGVDE-UONOGXRCSA-N 0 3 286.375 2.865 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCN(C3CC3)C[C@H](C)C2)cc1C ZINC000296050060 381231916 /nfs/dbraw/zinc/23/19/16/381231916.db2.gz ONFOWNMRZJCYNX-CYBMUJFWSA-N 0 3 288.435 2.925 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCN(C3CC3)C[C@H](C)C2)cc1C ZINC000296050060 381231927 /nfs/dbraw/zinc/23/19/27/381231927.db2.gz ONFOWNMRZJCYNX-CYBMUJFWSA-N 0 3 288.435 2.925 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccnc1-n1cccn1)c1ccccc1[O-] ZINC000183409862 381269998 /nfs/dbraw/zinc/26/99/98/381269998.db2.gz UOCTXMBQEJDUMB-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccccc1[O-] ZINC000183612101 381293500 /nfs/dbraw/zinc/29/35/00/381293500.db2.gz SOKHNLPRJHMEIK-NWDGAFQWSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H](O)CC(C)(C)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183612088 381293790 /nfs/dbraw/zinc/29/37/90/381293790.db2.gz SOKHNLPRJHMEIK-NEPJUHHUSA-N 0 3 251.370 2.840 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccccn1)CC2 ZINC000296204716 381300572 /nfs/dbraw/zinc/30/05/72/381300572.db2.gz ZCJFADUTGKSKTB-AWEZNQCLSA-N 0 3 254.333 2.607 20 10 CFCDHN COc1cccc(CN(C)[C@@H](C)c2ccccn2)c1O ZINC000183679237 381304953 /nfs/dbraw/zinc/30/49/53/381304953.db2.gz UYMZUEHLGOIXCC-LBPRGKRZSA-N 0 3 272.348 2.989 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000183462519 381275653 /nfs/dbraw/zinc/27/56/53/381275653.db2.gz VHUJPOKGWDSHRO-TXEJJXNPSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000183462519 381275656 /nfs/dbraw/zinc/27/56/56/381275656.db2.gz VHUJPOKGWDSHRO-TXEJJXNPSA-N 0 3 279.380 2.887 20 10 CFCDHN C[C@H]([NH2+]CCCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183490790 381276831 /nfs/dbraw/zinc/27/68/31/381276831.db2.gz KSOGNCFTRVQYKM-LBPRGKRZSA-N 0 3 294.395 2.958 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183492710 381279909 /nfs/dbraw/zinc/27/99/09/381279909.db2.gz FOWIYIPRJNHEEN-WDEREUQCSA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1ccccc1[O-] ZINC000183549576 381285201 /nfs/dbraw/zinc/28/52/01/381285201.db2.gz JMGXMHLSBCWUOK-NVGVWMPQSA-N 0 3 269.344 2.701 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccccc1[O-] ZINC000183543790 381286188 /nfs/dbraw/zinc/28/61/88/381286188.db2.gz LDFBZFYDMKXVFI-RCBQFDQVSA-N 0 3 263.381 2.984 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CO)CC1CCC1)CC2 ZINC000296294459 381336580 /nfs/dbraw/zinc/33/65/80/381336580.db2.gz DFKDAJUAELIDJZ-UONOGXRCSA-N 0 3 261.365 2.520 20 10 CFCDHN OCC[C@@H](N[C@@H]1CCc2cccc(O)c21)c1ccco1 ZINC000296465596 381407889 /nfs/dbraw/zinc/40/78/89/381407889.db2.gz OBDWRWOIBLNWAD-CHWSQXEVSA-N 0 3 273.332 2.686 20 10 CFCDHN OCC[C@H](N[C@H]1CCc2cccc(O)c21)c1ccco1 ZINC000296465613 381408024 /nfs/dbraw/zinc/40/80/24/381408024.db2.gz OBDWRWOIBLNWAD-STQMWFEESA-N 0 3 273.332 2.686 20 10 CFCDHN Cc1cc(O)c(CN[C@@H](CCO)c2ccco2)cc1C ZINC000184505786 381424622 /nfs/dbraw/zinc/42/46/22/381424622.db2.gz MRFQQLZEZKGEQC-AWEZNQCLSA-N 0 3 275.348 2.815 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)CCc1ccccc1)CC2 ZINC000296515739 381430126 /nfs/dbraw/zinc/43/01/26/381430126.db2.gz QSIFBPAJMBGGPI-DLBZAZTESA-N 0 3 297.398 2.963 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CCCO2)c1[O-] ZINC000184678132 381458744 /nfs/dbraw/zinc/45/87/44/381458744.db2.gz IVQSQFRALHKSQG-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CCCO2)c1[O-] ZINC000184678132 381458749 /nfs/dbraw/zinc/45/87/49/381458749.db2.gz IVQSQFRALHKSQG-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN COCC1CC[NH+](Cc2cc(Cl)cc(OC)c2[O-])CC1 ZINC000184689051 381461566 /nfs/dbraw/zinc/46/15/66/381461566.db2.gz XHCXGPOTVJOZDD-UHFFFAOYSA-N 0 3 299.798 2.913 20 10 CFCDHN CC[C@@H](CO)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184841614 381486302 /nfs/dbraw/zinc/48/63/02/381486302.db2.gz ZEQRCKWNBMNDLP-RISCZKNCSA-N 0 3 263.381 2.693 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H]2c3ccccc3C[C@@H]2O)c1 ZINC000185122275 381541405 /nfs/dbraw/zinc/54/14/05/381541405.db2.gz MYRQYUSMWNDKJE-FJNPEDAXSA-N 0 3 299.370 2.710 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1COC3(CCCC3)O1)CC2 ZINC000296936263 381548411 /nfs/dbraw/zinc/54/84/11/381548411.db2.gz QDOPNADMNWFZJE-KGLIPLIRSA-N 0 3 289.375 2.655 20 10 CFCDHN Cc1cnccc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297103655 381550980 /nfs/dbraw/zinc/55/09/80/381550980.db2.gz XUAKMWOXDMRYBY-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCc2cnn(C)c2)c1 ZINC000185313033 381593397 /nfs/dbraw/zinc/59/33/97/381593397.db2.gz XBKMCTJAMINLOY-CYBMUJFWSA-N 0 3 273.380 2.718 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCc2cnn(C)c2)c([O-])c1 ZINC000185313325 381594067 /nfs/dbraw/zinc/59/40/67/381594067.db2.gz NBEPCMLREKOZOA-ZDUSSCGKSA-N 0 3 273.380 2.718 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](C)c2cn(C)nc2C)c1 ZINC000185349589 381607528 /nfs/dbraw/zinc/60/75/28/381607528.db2.gz SQURAQQAFLNQLX-GHMZBOCLSA-N 0 3 289.379 2.855 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185316416 381596343 /nfs/dbraw/zinc/59/63/43/381596343.db2.gz SIJYPQDSJMCAIZ-OLZOCXBDSA-N 0 3 280.412 2.782 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000185534498 381660439 /nfs/dbraw/zinc/66/04/39/381660439.db2.gz WNDMTYPBJJYHHM-DUUOMRMWSA-N 0 3 291.391 2.865 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)OC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185540678 381661593 /nfs/dbraw/zinc/66/15/93/381661593.db2.gz BZVYPFUJHNZRPO-SNVBAGLBSA-N 0 3 283.343 2.914 20 10 CFCDHN CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)[C@H]1SC ZINC000298538349 381666013 /nfs/dbraw/zinc/66/60/13/381666013.db2.gz SUKDUZPRZMJDLG-BZUAXINKSA-N 0 3 294.464 2.751 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c1 ZINC000186114954 381826437 /nfs/dbraw/zinc/82/64/37/381826437.db2.gz WIGPCWXEPXEZLR-DGCLKSJQSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])[nH]n1 ZINC000186131649 381830560 /nfs/dbraw/zinc/83/05/60/381830560.db2.gz ZBPPQMHBZPDLPM-ONGXEEELSA-N 0 3 277.343 2.845 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])n[nH]1 ZINC000186131649 381830571 /nfs/dbraw/zinc/83/05/71/381830571.db2.gz ZBPPQMHBZPDLPM-ONGXEEELSA-N 0 3 277.343 2.845 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000186353966 381888802 /nfs/dbraw/zinc/88/88/02/381888802.db2.gz FFZUDAOMQNUWPY-GFCCVEGCSA-N 0 3 278.396 2.514 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c([O-])c1C ZINC000373266202 381964811 /nfs/dbraw/zinc/96/48/11/381964811.db2.gz LXKUVQWZEWCLOO-TZMCWYRMSA-N 0 3 285.391 2.940 20 10 CFCDHN C[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccccc1[O-] ZINC000374717092 382053173 /nfs/dbraw/zinc/05/31/73/382053173.db2.gz MJQUTVWTYPPSJA-CYBMUJFWSA-N 0 3 285.391 2.818 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])[C@@H]2CCCO[C@H]21 ZINC000374904669 382059570 /nfs/dbraw/zinc/05/95/70/382059570.db2.gz UNTAJUFXRCCCPS-NWANDNLSSA-N 0 3 279.355 2.825 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1C[C@H](CO)c2ccccc21 ZINC000373636706 382022114 /nfs/dbraw/zinc/02/21/14/382022114.db2.gz XIPBNODSAUYMPV-CJNGLKHVSA-N 0 3 269.344 2.703 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])C(C)(C)O ZINC000293564105 382176760 /nfs/dbraw/zinc/17/67/60/382176760.db2.gz GHGOWFMPLCWVEJ-GFCCVEGCSA-N 0 3 271.788 2.993 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnc3n2CCCC3)c1 ZINC000376758440 382172728 /nfs/dbraw/zinc/17/27/28/382172728.db2.gz PAZKZAHJRSSRHA-UHFFFAOYSA-N 0 3 271.364 2.523 20 10 CFCDHN CCC[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])OC ZINC000293622433 382201253 /nfs/dbraw/zinc/20/12/53/382201253.db2.gz IKURDQNCONDWDZ-CMPLNLGQSA-N 0 3 255.333 2.997 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cccc(C)c1[O-])C(C)C ZINC000188003613 382321289 /nfs/dbraw/zinc/32/12/89/382321289.db2.gz IKXSPZISRAAZLX-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000377697452 382323038 /nfs/dbraw/zinc/32/30/38/382323038.db2.gz LLIJZZJGUWOHNA-UKRRQHHQSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H](n2cncn2)C1 ZINC000364622234 382341618 /nfs/dbraw/zinc/34/16/18/382341618.db2.gz JTZUYYLMNKPRGM-DZGCQCFKSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H](n2cncn2)C1 ZINC000364622234 382341625 /nfs/dbraw/zinc/34/16/25/382341625.db2.gz JTZUYYLMNKPRGM-DZGCQCFKSA-N 0 3 286.379 2.772 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000188276083 382381587 /nfs/dbraw/zinc/38/15/87/382381587.db2.gz WVAPATAQJSWTRL-INIZCTEOSA-N 0 3 279.355 2.922 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(c3cn[nH]c3)CC2)c1 ZINC000378346752 382443057 /nfs/dbraw/zinc/44/30/57/382443057.db2.gz AYRSYFIBPORUJD-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1[O-] ZINC000294076889 382406400 /nfs/dbraw/zinc/40/64/00/382406400.db2.gz QUXAKEHHBIYWAK-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1[O-] ZINC000294076889 382406402 /nfs/dbraw/zinc/40/64/02/382406402.db2.gz QUXAKEHHBIYWAK-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC23CCOCC3)c1[O-] ZINC000378441813 382461558 /nfs/dbraw/zinc/46/15/58/382461558.db2.gz IERGQKRGFGSRDE-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC23CCOCC3)c1[O-] ZINC000378441813 382461562 /nfs/dbraw/zinc/46/15/62/382461562.db2.gz IERGQKRGFGSRDE-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cccc(OC)c1[O-])C(C)C ZINC000188861013 382494140 /nfs/dbraw/zinc/49/41/40/382494140.db2.gz AMTIOEBVHSCCKT-ZDUSSCGKSA-N 0 3 267.369 2.552 20 10 CFCDHN COc1ccncc1CN[C@@H](C)c1cc(C)ccc1O ZINC000294432036 382512842 /nfs/dbraw/zinc/51/28/42/382512842.db2.gz UUZZSDZSYKFMOM-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCOC2(C)C)c([O-])c1 ZINC000294798972 382528678 /nfs/dbraw/zinc/52/86/78/382528678.db2.gz MSAYYSQDBAYLJQ-HNNXBMFYSA-N 0 3 279.380 2.838 20 10 CFCDHN CCOCc1cc(CN[C@@H](C)[C@@H](C)OC)ccc1OC ZINC000189099967 382542698 /nfs/dbraw/zinc/54/26/98/382542698.db2.gz ZDPRVXJTQZSTKJ-QWHCGFSZSA-N 0 3 281.396 2.745 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(CF)CC2)c1 ZINC000295113635 382577057 /nfs/dbraw/zinc/57/70/57/382577057.db2.gz VKUNMSPUWUFGHI-UHFFFAOYSA-N 0 3 267.344 2.972 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(C)ccc2[O-])CC1(C)C ZINC000295053152 382567790 /nfs/dbraw/zinc/56/77/90/382567790.db2.gz PSWVVNMLMHRPJU-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(C)ccc2[O-])CC1(C)C ZINC000295053152 382567793 /nfs/dbraw/zinc/56/77/93/382567793.db2.gz PSWVVNMLMHRPJU-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(C)ccc2[O-])CC1(C)C ZINC000295053154 382567880 /nfs/dbraw/zinc/56/78/80/382567880.db2.gz PSWVVNMLMHRPJU-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(C)ccc2[O-])CC1(C)C ZINC000295053154 382567883 /nfs/dbraw/zinc/56/78/83/382567883.db2.gz PSWVVNMLMHRPJU-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN COc1cccc(CN2CC(C)(C)OC(C)(C)C2)c1O ZINC000189658716 382633189 /nfs/dbraw/zinc/63/31/89/382633189.db2.gz MALGVKIUTDXIPJ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H](O)C2(C)C)c1[O-] ZINC000189966042 382647786 /nfs/dbraw/zinc/64/77/86/382647786.db2.gz WKAMKWXIFMKFML-VXGBXAGGSA-N 0 3 269.772 2.603 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCC[C@@H]2CCO)cc1C ZINC000189971877 382647803 /nfs/dbraw/zinc/64/78/03/382647803.db2.gz SGVYZBTUPAOIPP-HIFRSBDPSA-N 0 3 263.381 2.650 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000190211079 382657121 /nfs/dbraw/zinc/65/71/21/382657121.db2.gz LRXSCRHURXSIIK-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000190211079 382657122 /nfs/dbraw/zinc/65/71/22/382657122.db2.gz LRXSCRHURXSIIK-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN C[C@H]1CSCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190839951 382681920 /nfs/dbraw/zinc/68/19/20/382681920.db2.gz ZSPANGNFRWLOCJ-SNVBAGLBSA-N 0 3 255.358 2.716 20 10 CFCDHN C[C@H]1CSCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190839951 382681921 /nfs/dbraw/zinc/68/19/21/382681921.db2.gz ZSPANGNFRWLOCJ-SNVBAGLBSA-N 0 3 255.358 2.716 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)C1CCCCC1 ZINC000190861061 382683035 /nfs/dbraw/zinc/68/30/35/382683035.db2.gz YLVALZCIWOJMBE-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)C1CCCCC1 ZINC000190861061 382683037 /nfs/dbraw/zinc/68/30/37/382683037.db2.gz YLVALZCIWOJMBE-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000249372092 383342415 /nfs/dbraw/zinc/34/24/15/383342415.db2.gz CWFPHBPKDKSFLN-ZIAGYGMSSA-N 0 3 262.397 2.693 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1cccc(F)c1 ZINC000267219157 384327504 /nfs/dbraw/zinc/32/75/04/384327504.db2.gz SJLJDHTUVANQNN-ZBEGNZNMSA-N 0 3 275.323 2.743 20 10 CFCDHN CC[C@@H](NC[C@@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000268825492 384670980 /nfs/dbraw/zinc/67/09/80/384670980.db2.gz IZUPQKIEDYGREB-CHWSQXEVSA-N 0 3 290.329 2.717 20 10 CFCDHN COc1cccc(C[N@H+](C)C2CCN(C(C)C)CC2)c1[O-] ZINC000271039880 385316083 /nfs/dbraw/zinc/31/60/83/385316083.db2.gz LXIOAUDJPUSJBQ-UHFFFAOYSA-N 0 3 292.423 2.705 20 10 CFCDHN COc1cccc(C[N@@H+](C)C2CCN(C(C)C)CC2)c1[O-] ZINC000271039880 385316089 /nfs/dbraw/zinc/31/60/89/385316089.db2.gz LXIOAUDJPUSJBQ-UHFFFAOYSA-N 0 3 292.423 2.705 20 10 CFCDHN CCCC[N@H+](CCC(=O)NCC)Cc1ccccc1[O-] ZINC000282332328 385285642 /nfs/dbraw/zinc/28/56/42/385285642.db2.gz BAPBRBNOTWOLLJ-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN CCCC[N@@H+](CCC(=O)NCC)Cc1ccccc1[O-] ZINC000282332328 385285646 /nfs/dbraw/zinc/28/56/46/385285646.db2.gz BAPBRBNOTWOLLJ-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@H](C)C(C)C)cc1OC ZINC000271100293 385336756 /nfs/dbraw/zinc/33/67/56/385336756.db2.gz OSWYPTYKJUXWRN-LLVKDONJSA-N 0 3 267.369 2.886 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@H](C)C(C)C)cc1OC ZINC000271100293 385336760 /nfs/dbraw/zinc/33/67/60/385336760.db2.gz OSWYPTYKJUXWRN-LLVKDONJSA-N 0 3 267.369 2.886 20 10 CFCDHN CC[N@H+](C)C[C@@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000271169529 385360200 /nfs/dbraw/zinc/36/02/00/385360200.db2.gz DOZPHXAIMRSPMW-LBPRGKRZSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[N@@H+](C)C[C@@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000271169529 385360207 /nfs/dbraw/zinc/36/02/07/385360207.db2.gz DOZPHXAIMRSPMW-LBPRGKRZSA-N 0 3 282.815 2.819 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(c3ncc[nH]3)CC2)c1[O-] ZINC000271742334 385390020 /nfs/dbraw/zinc/39/00/20/385390020.db2.gz RHSMFINXUOKCOW-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c1 ZINC000271184140 385365960 /nfs/dbraw/zinc/36/59/60/385365960.db2.gz MDLLLOUGMBYASM-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H]2C[C@H](C)O)c1 ZINC000271184140 385365963 /nfs/dbraw/zinc/36/59/63/385365963.db2.gz MDLLLOUGMBYASM-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOC[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000271205326 385375925 /nfs/dbraw/zinc/37/59/25/385375925.db2.gz ZLULTMFLLUUOKB-AWEZNQCLSA-N 0 3 280.387 2.750 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000271524594 385385367 /nfs/dbraw/zinc/38/53/67/385385367.db2.gz NJNLZAWZXGMYCC-GDBMZVCRSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@H]2CCOC2)c1[O-] ZINC000271764825 385391633 /nfs/dbraw/zinc/39/16/33/385391633.db2.gz ZYXPVEXBCYAZJX-LBPRGKRZSA-N 0 3 255.745 2.575 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@H]2CCOC2)c1[O-] ZINC000271764825 385391636 /nfs/dbraw/zinc/39/16/36/385391636.db2.gz ZYXPVEXBCYAZJX-LBPRGKRZSA-N 0 3 255.745 2.575 20 10 CFCDHN Cc1cccc(CN[C@@H](CO)c2ccc(F)cc2)c1O ZINC000271775292 385391643 /nfs/dbraw/zinc/39/16/43/385391643.db2.gz CLTFRCVMKQZOHN-HNNXBMFYSA-N 0 3 275.323 2.663 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2cccc(C)c2[O-])CC1 ZINC000271783969 385392065 /nfs/dbraw/zinc/39/20/65/385392065.db2.gz IEFXTIOXABXPPO-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@]2(C)CCOC2)c1[O-] ZINC000271832686 385393969 /nfs/dbraw/zinc/39/39/69/385393969.db2.gz PALNLZACSIFUPP-ZDUSSCGKSA-N 0 3 255.745 2.623 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)c2cn[nH]c2)c1[O-] ZINC000271820990 385394383 /nfs/dbraw/zinc/39/43/83/385394383.db2.gz MTUINEOOCOIXSX-SECBINFHSA-N 0 3 265.744 2.928 20 10 CFCDHN Cc1cccc(C[NH2+]C2CCN(C3CCC3)CC2)c1[O-] ZINC000271910160 385397611 /nfs/dbraw/zinc/39/76/11/385397611.db2.gz QFOLZUJXIKCMOF-UHFFFAOYSA-N 0 3 274.408 2.807 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1cc(F)ccc1[O-] ZINC000272486707 385550249 /nfs/dbraw/zinc/55/02/49/385550249.db2.gz UBOVEZUHXYVWMX-UHFFFAOYSA-N 0 3 283.343 2.743 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC[C@@H](C)O)c([O-])c1 ZINC000285279290 385553977 /nfs/dbraw/zinc/55/39/77/385553977.db2.gz REOJPQDMXSEEPP-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1 ZINC000285414321 385555430 /nfs/dbraw/zinc/55/54/30/385555430.db2.gz XXAKQANZCZCTDM-ZWNOBZJWSA-N 0 3 291.313 2.973 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H]2CCOC[C@H]2C)c1[O-] ZINC000285577915 385556087 /nfs/dbraw/zinc/55/60/87/385556087.db2.gz TUVAFDMUVOMPMU-OLZOCXBDSA-N 0 3 279.380 2.553 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H]2CCOC[C@@H]2C)c1[O-] ZINC000285577923 385556307 /nfs/dbraw/zinc/55/63/07/385556307.db2.gz TUVAFDMUVOMPMU-STQMWFEESA-N 0 3 279.380 2.553 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccccc1[O-] ZINC000285770980 385556909 /nfs/dbraw/zinc/55/69/09/385556909.db2.gz TZBIOHQNDMKSGI-NORZTCDRSA-N 0 3 290.407 2.736 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CCc2cnccn2)c1[O-] ZINC000272827686 385626280 /nfs/dbraw/zinc/62/62/80/385626280.db2.gz PJZUZTRVBLSFGB-UHFFFAOYSA-N 0 3 291.782 2.819 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CCc2cnccn2)c1[O-] ZINC000272827686 385626286 /nfs/dbraw/zinc/62/62/86/385626286.db2.gz PJZUZTRVBLSFGB-UHFFFAOYSA-N 0 3 291.782 2.819 20 10 CFCDHN C[C@H]([NH2+]CCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000272878420 385638603 /nfs/dbraw/zinc/63/86/03/385638603.db2.gz QDUGWJFJEDVLRL-JTQLQIEISA-N 0 3 276.302 2.537 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@]1(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000273397971 385680643 /nfs/dbraw/zinc/68/06/43/385680643.db2.gz FUHCDDOJSCYLEQ-BBRMVZONSA-N 0 3 295.354 2.743 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1C ZINC000273403528 385680776 /nfs/dbraw/zinc/68/07/76/385680776.db2.gz NTCFXDAMIQTLHC-ZDUSSCGKSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@@H]2CCN(C(C)C)C2=O)c(O)c1C ZINC000273519160 385685886 /nfs/dbraw/zinc/68/58/86/385685886.db2.gz TVEKDIMYIOUGRD-UKRRQHHQSA-N 0 3 290.407 2.669 20 10 CFCDHN CS[C@H](CO)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273554505 385687855 /nfs/dbraw/zinc/68/78/55/385687855.db2.gz GQKBVYUUSKPIPM-OUCADQQQSA-N 0 3 283.437 2.772 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCO[C@@H]2CCOC2)c([O-])c1C ZINC000273563892 385689855 /nfs/dbraw/zinc/68/98/55/385689855.db2.gz IZBYYPOYZUQWEI-HUUCEWRRSA-N 0 3 293.407 2.855 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCC(=O)N(C)C)c([O-])c1C ZINC000273607896 385691591 /nfs/dbraw/zinc/69/15/91/385691591.db2.gz USJDQIRIBDNPQE-ZDUSSCGKSA-N 0 3 278.396 2.528 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000273618334 385692678 /nfs/dbraw/zinc/69/26/78/385692678.db2.gz YFCBHVLEDNSPHX-ZIAGYGMSSA-N 0 3 290.407 2.671 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(C)c2[O-])[C@@]12CCCO2 ZINC000273712768 385693932 /nfs/dbraw/zinc/69/39/32/385693932.db2.gz GNHIVTWOQCVJOA-INMHGKMJSA-N 0 3 291.391 2.517 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)CC2(C)C)c1O ZINC000273803989 385695711 /nfs/dbraw/zinc/69/57/11/385695711.db2.gz XOCIOSBQRNFWON-UHFFFAOYSA-N 0 3 298.814 2.580 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCO[C@@H](C3CC3)C1)CC2 ZINC000296247060 285397617 /nfs/dbraw/zinc/39/76/17/285397617.db2.gz BBBWXBFDKGGHAZ-IIAWOOMASA-N 0 3 273.376 2.927 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1cccnc1)CC2 ZINC000296072448 285396767 /nfs/dbraw/zinc/39/67/67/285396767.db2.gz SEJIIDZPWGLILE-AWEZNQCLSA-N 0 3 254.333 2.607 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CN1C1CC1 ZINC000297826148 393447649 /nfs/dbraw/zinc/44/76/49/393447649.db2.gz ROQAPXJAFCRGPB-UXIGCNINSA-N 0 3 272.392 2.594 20 10 CFCDHN Cc1ncc([C@H](C)NCc2ccc3c(c2)CCN3C)c(C)n1 ZINC000372418876 393447753 /nfs/dbraw/zinc/44/77/53/393447753.db2.gz ZFKONHBKOHWOJR-LBPRGKRZSA-N 0 3 296.418 2.937 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@@H](C3CC3)C2)cc1OC ZINC000372391928 393448366 /nfs/dbraw/zinc/44/83/66/393448366.db2.gz QBFIFLIUXGSQLD-GFCCVEGCSA-N 0 3 277.364 2.641 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@@H](C3CC3)C2)cc1OC ZINC000372391928 393448372 /nfs/dbraw/zinc/44/83/72/393448372.db2.gz QBFIFLIUXGSQLD-GFCCVEGCSA-N 0 3 277.364 2.641 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H](c2nnc[nH]2)C1 ZINC000372598865 393452316 /nfs/dbraw/zinc/45/23/16/393452316.db2.gz IOAGOQJLJHSASC-TZMCWYRMSA-N 0 3 286.379 2.841 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@H](c2nnc[nH]2)C1 ZINC000372598865 393452323 /nfs/dbraw/zinc/45/23/23/393452323.db2.gz IOAGOQJLJHSASC-TZMCWYRMSA-N 0 3 286.379 2.841 20 10 CFCDHN CC(C)C[N@@H+]1CCCN(Cc2ccccc2[O-])CC1 ZINC000374260558 393490813 /nfs/dbraw/zinc/49/08/13/393490813.db2.gz XBTOTORUUWOUTM-UHFFFAOYSA-N 0 3 262.397 2.556 20 10 CFCDHN CC(C)C[N@H+]1CCCN(Cc2ccccc2[O-])CC1 ZINC000374260558 393490819 /nfs/dbraw/zinc/49/08/19/393490819.db2.gz XBTOTORUUWOUTM-UHFFFAOYSA-N 0 3 262.397 2.556 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000374256318 393490882 /nfs/dbraw/zinc/49/08/82/393490882.db2.gz VGMFNYGWAOILLG-GJZGRUSLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000374256318 393490888 /nfs/dbraw/zinc/49/08/88/393490888.db2.gz VGMFNYGWAOILLG-GJZGRUSLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCC23CCOCC3)c1 ZINC000374284682 393491316 /nfs/dbraw/zinc/49/13/16/393491316.db2.gz QUBIOPRHSCZTTK-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCC23CCOCC3)c1 ZINC000374284682 393491322 /nfs/dbraw/zinc/49/13/22/393491322.db2.gz QUBIOPRHSCZTTK-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CC(=O)N3CCCC[C@@H]23)c1 ZINC000374509417 393497988 /nfs/dbraw/zinc/49/79/88/393497988.db2.gz XWHOJABOBHULMB-CFVMTHIKSA-N 0 3 288.391 2.505 20 10 CFCDHN CN(C)C(=O)c1cccc(CN(C)Cc2ccccc2O)c1 ZINC000109769127 393879443 /nfs/dbraw/zinc/87/94/43/393879443.db2.gz XRFZMENCKFKIAR-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C[C@H]2CCCOC2)c1 ZINC000119802471 393925449 /nfs/dbraw/zinc/92/54/49/393925449.db2.gz VOSFAFOVUKYLLA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C[C@H]2CCCOC2)c1 ZINC000119802471 393925454 /nfs/dbraw/zinc/92/54/54/393925454.db2.gz VOSFAFOVUKYLLA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN OC[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000364435026 394212329 /nfs/dbraw/zinc/21/23/29/394212329.db2.gz JPRJNOHSGZMPSY-CRAIPNDOSA-N 0 3 295.382 2.932 20 10 CFCDHN Cc1ncccc1CNCc1ccc2c(c1)CCN2C ZINC000364440961 394213730 /nfs/dbraw/zinc/21/37/30/394213730.db2.gz AXCDJZWZGTUCQS-UHFFFAOYSA-N 0 3 267.376 2.672 20 10 CFCDHN CN(C)C1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCC1 ZINC000295895122 394304675 /nfs/dbraw/zinc/30/46/75/394304675.db2.gz IIYSPQTUAROVEH-CQSZACIVSA-N 0 3 274.408 2.844 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@]23C[C@@H]2COC3(C)C)c1[O-] ZINC000529645656 394418461 /nfs/dbraw/zinc/41/84/61/394418461.db2.gz SZHWQEGPNKKPFC-BMIGLBTASA-N 0 3 297.782 2.711 20 10 CFCDHN Cc1cccc(C[NH2+]CCN(C)C(=O)OC(C)(C)C)c1[O-] ZINC000224575716 397622903 /nfs/dbraw/zinc/62/29/03/397622903.db2.gz IAWXKSOHQXIAGX-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccncc1C ZINC000825253291 782007217 /nfs/dbraw/zinc/00/72/17/782007217.db2.gz HHMCGCMMKHCGLZ-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000274869182 286907535 /nfs/dbraw/zinc/90/75/35/286907535.db2.gz FGHRQWWGHXCSAK-GFCCVEGCSA-N 0 3 290.329 2.927 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccccc1)c1ccccc1[O-] ZINC000035601322 172290354 /nfs/dbraw/zinc/29/03/54/172290354.db2.gz SQUHBMZFXDKRAO-WBMJQRKESA-N 0 3 257.333 2.776 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccnn1C)c1ccc(C)cc1[O-] ZINC000280042184 522660435 /nfs/dbraw/zinc/66/04/35/522660435.db2.gz IXCSUPOVAJBUDU-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCOCC[C@H]2C)c([O-])c1 ZINC000368595072 267190255 /nfs/dbraw/zinc/19/02/55/267190255.db2.gz VWUZKTTVJNWATJ-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCOCC[C@H]2C)c([O-])c1 ZINC000368595072 267190258 /nfs/dbraw/zinc/19/02/58/267190258.db2.gz VWUZKTTVJNWATJ-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000368763028 267202855 /nfs/dbraw/zinc/20/28/55/267202855.db2.gz BGGQRHJEJNBTHF-DLBZAZTESA-N 0 3 291.391 2.696 20 10 CFCDHN Cc1ccn(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)n1 ZINC000369289921 267232251 /nfs/dbraw/zinc/23/22/51/267232251.db2.gz GRSRXJKRSZZOIM-UHFFFAOYSA-N 0 3 289.354 2.873 20 10 CFCDHN Cc1ccn(C2CC[NH+](Cc3ccccc3[O-])CC2)n1 ZINC000369294306 267232350 /nfs/dbraw/zinc/23/23/50/267232350.db2.gz QHBSPNRSRAAFDX-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[NH+]1CCC(n2cncn2)CC1 ZINC000369594948 267252864 /nfs/dbraw/zinc/25/28/64/267252864.db2.gz AOUVWHBMOOQLID-OAHLLOKOSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOC2(CCOCC2)C1 ZINC000369594785 267253050 /nfs/dbraw/zinc/25/30/50/267253050.db2.gz LEINODMCXRZMFL-HNNXBMFYSA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOC2(CCOCC2)C1 ZINC000369594785 267253054 /nfs/dbraw/zinc/25/30/54/267253054.db2.gz LEINODMCXRZMFL-HNNXBMFYSA-N 0 3 291.391 2.725 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@]3(CCOC3)C2)c([O-])c1 ZINC000369902195 267275095 /nfs/dbraw/zinc/27/50/95/267275095.db2.gz LCRIKMDAFQPLDJ-GRDNDAEWSA-N 0 3 291.391 2.689 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)c1[O-] ZINC000371682225 267447998 /nfs/dbraw/zinc/44/79/98/267447998.db2.gz WYZZNTVKOFPOMJ-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1[O-] ZINC000371682225 267448002 /nfs/dbraw/zinc/44/80/02/267448002.db2.gz WYZZNTVKOFPOMJ-HNNXBMFYSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc(CNCc2ccccc2N(C)C)c1O ZINC000267898747 274146489 /nfs/dbraw/zinc/14/64/89/274146489.db2.gz XLIXVLDEYOUNSN-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296132445 274860945 /nfs/dbraw/zinc/86/09/45/274860945.db2.gz VVAXLIQVVLQVRT-CQSZACIVSA-N 0 3 271.364 2.564 20 10 CFCDHN CCCN1CC[C@H](C[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000295976981 276014103 /nfs/dbraw/zinc/01/41/03/276014103.db2.gz MZCTZPYKPVXYLY-UKRRQHHQSA-N 0 3 274.408 2.701 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@@H](C)[C@@H](OC)C23CCC3)c1[O-] ZINC000365024303 278013046 /nfs/dbraw/zinc/01/30/46/278013046.db2.gz WWFNPVGCKKMUSB-HFBAOOFYSA-N 0 3 291.391 2.694 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cc(F)ccc1[O-] ZINC000094617424 278382910 /nfs/dbraw/zinc/38/29/10/278382910.db2.gz QGRPQTYOCRZIAZ-YGRLFVJLSA-N 0 3 289.354 2.993 20 10 CFCDHN C[C@@H](N[C@H]1CCCc2c[nH]nc21)c1ccccc1O ZINC000272846854 278383805 /nfs/dbraw/zinc/38/38/05/278383805.db2.gz KJQLNZQIMVKFNT-MFKMUULPSA-N 0 3 257.337 2.844 20 10 CFCDHN CC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)[C@H](O)C(F)F ZINC000296561776 288081057 /nfs/dbraw/zinc/08/10/57/288081057.db2.gz SHYGNLIAYOYYDG-SWHYSGLUSA-N 0 3 286.366 2.808 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c1 ZINC000185368739 295168343 /nfs/dbraw/zinc/16/83/43/295168343.db2.gz URCWCPYHCQKPPN-RYUDHWBXSA-N 0 3 278.396 2.534 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@@H]3OCC[C@H]31)CC2 ZINC000296264477 328289895 /nfs/dbraw/zinc/28/98/95/328289895.db2.gz BQIUMECKZBIXOS-NHIYQJMISA-N 0 3 273.376 2.927 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC[C@@H]2CCCOC2)cc1C ZINC000527741341 330282700 /nfs/dbraw/zinc/28/27/00/330282700.db2.gz ZONJYQVSEZVFMJ-AWEZNQCLSA-N 0 3 263.381 2.915 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC2COC2)c1[O-] ZINC000528024288 330304864 /nfs/dbraw/zinc/30/48/64/330304864.db2.gz DUXQWVCEYGPSFB-VIFPVBQESA-N 0 3 255.745 2.651 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@H](O)C(F)(F)F)cc1 ZINC000219452786 333150091 /nfs/dbraw/zinc/15/00/91/333150091.db2.gz YOWFZHOIZMCYJC-ZDUSSCGKSA-N 0 3 290.329 2.546 20 10 CFCDHN CCCCN1CCC([NH2+]Cc2ccccc2[O-])CC1 ZINC000037150097 520578288 /nfs/dbraw/zinc/57/82/88/520578288.db2.gz POFLWNXCTNGDPG-UHFFFAOYSA-N 0 3 262.397 2.746 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H](C)C2)c1[O-] ZINC000230935345 522540857 /nfs/dbraw/zinc/54/08/57/522540857.db2.gz IGSBXOJYNKETHB-JOYOIKCWSA-N 0 3 285.771 2.711 20 10 CFCDHN CC(C)C(=O)N1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000037142671 519458457 /nfs/dbraw/zinc/45/84/57/519458457.db2.gz UVTPKMADHNVKKM-CYBMUJFWSA-N 0 3 290.407 2.690 20 10 CFCDHN CC(=O)N1CCC[C@@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000280981291 519540063 /nfs/dbraw/zinc/54/00/63/519540063.db2.gz MBTBQXRQWJVTTJ-HIFRSBDPSA-N 0 3 290.407 2.610 20 10 CFCDHN CC(C)CC[C@@H](O)C[N@H+](C)Cc1ccccc1[O-] ZINC000280277785 519683985 /nfs/dbraw/zinc/68/39/85/519683985.db2.gz RUMKVWNWCCTRSQ-CQSZACIVSA-N 0 3 251.370 2.621 20 10 CFCDHN CC(C)CC[C@@H](O)C[N@@H+](C)Cc1ccccc1[O-] ZINC000280277785 519683987 /nfs/dbraw/zinc/68/39/87/519683987.db2.gz RUMKVWNWCCTRSQ-CQSZACIVSA-N 0 3 251.370 2.621 20 10 CFCDHN CC(C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])N1CCCC1 ZINC000226584343 519795072 /nfs/dbraw/zinc/79/50/72/519795072.db2.gz VJCJRWHVAMOHJD-OAHLLOKOSA-N 0 3 280.387 2.741 20 10 CFCDHN CC(C)[C@H](O)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185463537 519823729 /nfs/dbraw/zinc/82/37/29/519823729.db2.gz KGTKXCLBZOFQKW-SJKOYZFVSA-N 0 3 277.408 2.939 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC000279599413 520347024 /nfs/dbraw/zinc/34/70/24/520347024.db2.gz DKNPLIASPVWGPM-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC000279599413 520347031 /nfs/dbraw/zinc/34/70/31/520347031.db2.gz DKNPLIASPVWGPM-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@](C)(O)CCC)c([O-])c1 ZINC000264897478 520365998 /nfs/dbraw/zinc/36/59/98/520365998.db2.gz YLDDPMCKLAOSGY-INIZCTEOSA-N 0 3 281.396 2.822 20 10 CFCDHN CCCCOC[C@H](O)C[N@H+](CCC)Cc1ccccc1[O-] ZINC000279840291 520804220 /nfs/dbraw/zinc/80/42/20/520804220.db2.gz AHRSNJQPYXYTOK-MRXNPFEDSA-N 0 3 295.423 2.782 20 10 CFCDHN CCCCOC[C@H](O)C[N@@H+](CCC)Cc1ccccc1[O-] ZINC000279840291 520804222 /nfs/dbraw/zinc/80/42/22/520804222.db2.gz AHRSNJQPYXYTOK-MRXNPFEDSA-N 0 3 295.423 2.782 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000066057177 520893115 /nfs/dbraw/zinc/89/31/15/520893115.db2.gz UBRXBXNIFHVTKW-UHFFFAOYSA-N 0 3 276.424 2.737 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000230934513 520936080 /nfs/dbraw/zinc/93/60/80/520936080.db2.gz CRHSSVNAIBKRMP-CQSZACIVSA-N 0 3 287.787 2.695 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C(C)C)[C@H]2CCOC2)c1 ZINC000291343602 521139429 /nfs/dbraw/zinc/13/94/29/521139429.db2.gz WHJCPVBCNXAXMY-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C(C)C)[C@H]2CCOC2)c1 ZINC000291343602 521139439 /nfs/dbraw/zinc/13/94/39/521139439.db2.gz WHJCPVBCNXAXMY-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c1 ZINC000290529136 521143356 /nfs/dbraw/zinc/14/33/56/521143356.db2.gz QNZYPDFDCORNDF-XJKSGUPXSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c1 ZINC000290529136 521143366 /nfs/dbraw/zinc/14/33/66/521143366.db2.gz QNZYPDFDCORNDF-XJKSGUPXSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(O)c(CN2CCS[C@H](C)C2)c1 ZINC000131408795 521147664 /nfs/dbraw/zinc/14/76/64/521147664.db2.gz FVBLGXMRDGOUDS-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(C)ccc1[O-] ZINC000278570807 521316456 /nfs/dbraw/zinc/31/64/56/521316456.db2.gz BZJFZPXXJYGFAW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cc(C)ccc1[O-] ZINC000278570807 521316465 /nfs/dbraw/zinc/31/64/65/521316465.db2.gz BZJFZPXXJYGFAW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@]23CCOC3)c1[O-] ZINC000312735618 521336962 /nfs/dbraw/zinc/33/69/62/521336962.db2.gz UDOORVJUQKWFGY-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@]23CCOC3)c1[O-] ZINC000312735618 521336973 /nfs/dbraw/zinc/33/69/73/521336973.db2.gz UDOORVJUQKWFGY-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC000271219028 521337292 /nfs/dbraw/zinc/33/72/92/521337292.db2.gz OEYCQSBCPKOGGP-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC000271219028 521337300 /nfs/dbraw/zinc/33/73/00/521337300.db2.gz OEYCQSBCPKOGGP-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCCCC(=O)OC)c1[O-] ZINC000289958597 521361543 /nfs/dbraw/zinc/36/15/43/521361543.db2.gz YHJHDLCSODHPKQ-UHFFFAOYSA-N 0 3 295.379 2.614 20 10 CFCDHN CCOc1cccc(C[NH2+]CCC(=O)OC(C)(C)C)c1[O-] ZINC000174434526 521363027 /nfs/dbraw/zinc/36/30/27/521363027.db2.gz MZQGLXWDEYYTQQ-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@]2(O)CCCC2(C)C)c1[O-] ZINC000293062992 521366104 /nfs/dbraw/zinc/36/61/04/521366104.db2.gz UXGXPFUOBGKPFB-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN CCN1CCC([NH2+][C@H](C)c2cc(OC)ccc2[O-])CC1 ZINC000038097932 521580733 /nfs/dbraw/zinc/58/07/33/521580733.db2.gz VPWAYTMGGNMBCM-GFCCVEGCSA-N 0 3 278.396 2.536 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000276621946 521652092 /nfs/dbraw/zinc/65/20/92/521652092.db2.gz ICOZOSWOVMVTLT-GFCCVEGCSA-N 0 3 281.396 2.993 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280168898 521652568 /nfs/dbraw/zinc/65/25/68/521652568.db2.gz RCLNVHXMNTVBBN-GULBITTBSA-N 0 3 293.407 2.671 20 10 CFCDHN CCCN(Cc1c(C)cnn1C)Cc1ccccc1O ZINC000289473434 521679076 /nfs/dbraw/zinc/67/90/76/521679076.db2.gz ZDZKEQBJGKEADI-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN CN(C)c1ccc(CNCc2cccn2C)cc1F ZINC000161854440 522208245 /nfs/dbraw/zinc/20/82/45/522208245.db2.gz JBDUSERAOWBZKD-UHFFFAOYSA-N 0 3 261.344 2.520 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H](C)C2)c1[O-] ZINC000230935352 522539408 /nfs/dbraw/zinc/53/94/08/522539408.db2.gz IGSBXOJYNKETHB-BXKDBHETSA-N 0 3 285.771 2.711 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCSC2)c1[O-] ZINC000230935063 522541040 /nfs/dbraw/zinc/54/10/40/522541040.db2.gz ZRKPKHWFRSLTQX-SNVBAGLBSA-N 0 3 273.785 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](CO)C2CCCC2)c1[O-] ZINC000290849289 522541452 /nfs/dbraw/zinc/54/14/52/522541452.db2.gz IXZXFXTWABAZOS-CYBMUJFWSA-N 0 3 299.798 2.695 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H](O)C1(C)C)c1ccc(C)cc1[O-] ZINC000280009241 522725972 /nfs/dbraw/zinc/72/59/72/522725972.db2.gz GOOWJROULRDSLB-CFVMTHIKSA-N 0 3 263.381 2.901 20 10 CFCDHN COC(=O)C(C)(C)CCNCc1ccc(N(C)C)c(F)c1 ZINC000279909437 522772325 /nfs/dbraw/zinc/77/23/25/522772325.db2.gz LSTLRDFRRZKYGB-UHFFFAOYSA-N 0 3 296.386 2.571 20 10 CFCDHN CC[C@@H]([NH2+]CCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000121083618 522836630 /nfs/dbraw/zinc/83/66/30/522836630.db2.gz OVPUJOQQRLQYAR-CYBMUJFWSA-N 0 3 294.395 2.958 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cnn(C)c1)c1ccc(C)cc1[O-] ZINC000280184389 522844980 /nfs/dbraw/zinc/84/49/80/522844980.db2.gz RWCHSXSGMGEEII-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)C[C@@H](C)O)c1ccccc1[O-] ZINC000155962568 522848000 /nfs/dbraw/zinc/84/80/00/522848000.db2.gz DITXSAHSKQHFIG-OUCADQQQSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@@H]([NH2+]C[C@](C)(O)CCOC)c1ccc(C)cc1[O-] ZINC000279926017 522867641 /nfs/dbraw/zinc/86/76/41/522867641.db2.gz AKJKULZIEQILCM-GDBMZVCRSA-N 0 3 281.396 2.529 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCCO1 ZINC000226563266 523181943 /nfs/dbraw/zinc/18/19/43/523181943.db2.gz XPVLYTGSJSSYKC-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCCO1 ZINC000226563266 523181951 /nfs/dbraw/zinc/18/19/51/523181951.db2.gz XPVLYTGSJSSYKC-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284050336 523511919 /nfs/dbraw/zinc/51/19/19/523511919.db2.gz KGEQODLTXQETGY-DOMZBBRYSA-N 0 3 251.370 2.821 20 10 CFCDHN CO[C@@](C)(C[NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000291357446 523800372 /nfs/dbraw/zinc/80/03/72/523800372.db2.gz XVOKPWVPLDWTFB-BMIGLBTASA-N 0 3 267.344 2.997 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000156092420 523834251 /nfs/dbraw/zinc/83/42/51/523834251.db2.gz XZIJPZZQSAQDIR-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000156092420 523834262 /nfs/dbraw/zinc/83/42/62/523834262.db2.gz XZIJPZZQSAQDIR-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN Cc1cccc(C[NH2+]CC2(CO)CC3(CCC3)C2)c1[O-] ZINC000279354981 524429392 /nfs/dbraw/zinc/42/93/92/524429392.db2.gz GPOHNCDVQBSWSB-UHFFFAOYSA-N 0 3 275.392 2.733 20 10 CFCDHN Cc1cccc(C[NH2+]Cc2ccc3c(c2)OCO3)c1[O-] ZINC000158070381 524433262 /nfs/dbraw/zinc/43/32/62/524433262.db2.gz IOMYHMCVFNHNHB-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1cccc(CNCc2ccc3c(c2)OCO3)c1O ZINC000158070381 524433268 /nfs/dbraw/zinc/43/32/68/524433268.db2.gz IOMYHMCVFNHNHB-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN C[C@H](CNCc1c([O-])cccc1Cl)C[NH+]1CCCC1 ZINC000083551989 524487776 /nfs/dbraw/zinc/48/77/76/524487776.db2.gz WTQARPFREGKSBJ-GFCCVEGCSA-N 0 3 282.815 2.867 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000292755952 524748045 /nfs/dbraw/zinc/74/80/45/524748045.db2.gz IYXJCMHEORGWHA-KGLIPLIRSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000292755952 524748054 /nfs/dbraw/zinc/74/80/54/524748054.db2.gz IYXJCMHEORGWHA-KGLIPLIRSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000292755952 524748063 /nfs/dbraw/zinc/74/80/63/524748063.db2.gz IYXJCMHEORGWHA-KGLIPLIRSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCSC)c1 ZINC000069432703 524763202 /nfs/dbraw/zinc/76/32/02/524763202.db2.gz HFINHHCJNDAAHB-SNVBAGLBSA-N 0 3 255.383 2.805 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H](C(C)C)N2CCCC2)c1 ZINC000020201026 524751650 /nfs/dbraw/zinc/75/16/50/524751650.db2.gz WTNNRKGAUAZHFO-INIZCTEOSA-N 0 3 292.423 2.611 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)SC)c1 ZINC000168851239 524764256 /nfs/dbraw/zinc/76/42/56/524764256.db2.gz OSKAUDJWFCPLHN-NXEZZACHSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2c(C)noc2C)c1 ZINC000092328725 524764484 /nfs/dbraw/zinc/76/44/84/524764484.db2.gz SAGKZOQIYKTKHD-SECBINFHSA-N 0 3 276.336 2.856 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCC(C)CC2)c1 ZINC000040771298 524764762 /nfs/dbraw/zinc/76/47/62/524764762.db2.gz AKDYNMOJFXMLSK-CQSZACIVSA-N 0 3 292.423 2.783 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](C)c2cnn(C)c2)c1 ZINC000273618426 524766829 /nfs/dbraw/zinc/76/68/29/524766829.db2.gz YIFSMDFRIGOOJB-WDEREUQCSA-N 0 3 275.352 2.546 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CN(C)C(C)C)c1 ZINC000290269868 524773914 /nfs/dbraw/zinc/77/39/14/524773914.db2.gz WAZZOOANMHJGAH-OLZOCXBDSA-N 0 3 280.412 2.780 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C)C2)c1 ZINC000230670308 524775169 /nfs/dbraw/zinc/77/51/69/524775169.db2.gz UTSMTQJMBAHBGR-SDDRHHMPSA-N 0 3 265.353 2.619 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCOC2)c1[O-] ZINC000290268132 524871205 /nfs/dbraw/zinc/87/12/05/524871205.db2.gz XMJWYAMMBMTAEB-GFCCVEGCSA-N 0 3 255.745 2.623 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)CCCCCO)cc1C ZINC000279505714 525312093 /nfs/dbraw/zinc/31/20/93/525312093.db2.gz WQHRHQZVPDYMTN-UHFFFAOYSA-N 0 3 251.370 2.603 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)CCCCCO)cc1C ZINC000279505714 525312102 /nfs/dbraw/zinc/31/21/02/525312102.db2.gz WQHRHQZVPDYMTN-UHFFFAOYSA-N 0 3 251.370 2.603 20 10 CFCDHN Cc1cc(O)c(CN[C@H](CC(N)=O)c2ccccc2)cc1C ZINC000293045292 525323610 /nfs/dbraw/zinc/32/36/10/525323610.db2.gz RAQMLHYBVAVASR-MRXNPFEDSA-N 0 3 298.386 2.715 20 10 CFCDHN CSC1(C[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000193364049 525333533 /nfs/dbraw/zinc/33/35/33/525333533.db2.gz UUPIDAIKFDUTRT-UHFFFAOYSA-N 0 3 255.358 2.907 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccccc1[O-] ZINC000278394981 525339602 /nfs/dbraw/zinc/33/96/02/525339602.db2.gz DCQQVDQAOSNUIB-CABCVRRESA-N 0 3 292.423 2.544 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000366545257 525343490 /nfs/dbraw/zinc/34/34/90/525343490.db2.gz PGZZYLJWCNGBMM-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000366545257 525343501 /nfs/dbraw/zinc/34/35/01/525343501.db2.gz PGZZYLJWCNGBMM-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000289776077 525348688 /nfs/dbraw/zinc/34/86/88/525348688.db2.gz JEXCCMARBUQSGI-PKOBYXMFSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC[C@H](O)c2ccccc2)c1 ZINC000289418242 525350589 /nfs/dbraw/zinc/35/05/89/525350589.db2.gz ITCWUAYIQKWLKC-KRWDZBQOSA-N 0 3 271.360 2.914 20 10 CFCDHN C[C@H]([NH2+]CCOCC1CC1)c1cc(F)ccc1[O-] ZINC000230661343 525357866 /nfs/dbraw/zinc/35/78/66/525357866.db2.gz MFYIBCZXEFJPFV-JTQLQIEISA-N 0 3 253.317 2.609 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCC[C@H](C)CO)c1 ZINC000230669692 525362777 /nfs/dbraw/zinc/36/27/77/525362777.db2.gz UXZAJFGWFSURGK-STQMWFEESA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@H]2C2CC2)c1 ZINC000300419168 525365938 /nfs/dbraw/zinc/36/59/38/525365938.db2.gz RARCGTAWHDJNFE-PJODQICGSA-N 0 3 261.365 2.919 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1[O-] ZINC000094618360 525413236 /nfs/dbraw/zinc/41/32/36/525413236.db2.gz FDEQAEWHGDNXAK-WDMOLILDSA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@@H]([NH2+]CCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000272878422 525446155 /nfs/dbraw/zinc/44/61/55/525446155.db2.gz QDUGWJFJEDVLRL-SNVBAGLBSA-N 0 3 276.302 2.537 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccccc1[O-] ZINC000040735491 525463917 /nfs/dbraw/zinc/46/39/17/525463917.db2.gz MUMIYTSWHXZNGX-GFCCVEGCSA-N 0 3 257.333 2.991 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCSC1)c1cc(F)ccc1[O-] ZINC000228558986 525485486 /nfs/dbraw/zinc/48/54/86/525485486.db2.gz JWGFHJQAEMKWFG-ZJUUUORDSA-N 0 3 255.358 2.935 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCO[C@@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000230669918 525623465 /nfs/dbraw/zinc/62/34/65/525623465.db2.gz PSDWOQVIJFQCLH-DYQSUWPFSA-N 0 3 265.328 2.749 20 10 CFCDHN Cc1c(C[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])cnn1C ZINC000285067687 525728632 /nfs/dbraw/zinc/72/86/32/525728632.db2.gz JCFQEUXRRTUCLB-GFCCVEGCSA-N 0 3 273.380 2.902 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1ccccc1[O-])c1ccc(F)cc1 ZINC000157857743 525777563 /nfs/dbraw/zinc/77/75/63/525777563.db2.gz XSTRBBRHJVJMKI-MRXNPFEDSA-N 0 3 275.323 2.529 20 10 CFCDHN C[C@@]12CC[N@H+](Cc3ccccc3[O-])C[C@@H]1C2(F)F ZINC000292744240 525912660 /nfs/dbraw/zinc/91/26/60/525912660.db2.gz HWCQPJVSUDCJPL-QWHCGFSZSA-N 0 3 253.292 2.869 20 10 CFCDHN C[C@@]12CC[N@@H+](Cc3ccccc3[O-])C[C@@H]1C2(F)F ZINC000292744240 525912678 /nfs/dbraw/zinc/91/26/78/525912678.db2.gz HWCQPJVSUDCJPL-QWHCGFSZSA-N 0 3 253.292 2.869 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@H](C)O)c([O-])c1C ZINC000278893887 525920759 /nfs/dbraw/zinc/92/07/59/525920759.db2.gz UIIRHONUOPFMLU-AAEUAGOBSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c([O-])c1 ZINC000228615631 525941631 /nfs/dbraw/zinc/94/16/31/525941631.db2.gz LLZPTMXKARTILD-SOZUMNATSA-N 0 3 269.410 2.508 20 10 CFCDHN Cc1ccc([C@H](O)CNCc2ccc3c(c2)CCO3)cc1 ZINC000237652164 525975758 /nfs/dbraw/zinc/97/57/58/525975758.db2.gz LFSGYCOISBKAIC-QGZVFWFLSA-N 0 3 283.371 2.753 20 10 CFCDHN Cc1nnc(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])s1 ZINC000289583006 526329338 /nfs/dbraw/zinc/32/93/38/526329338.db2.gz BODQKMYHIAXLAK-QMMMGPOBSA-N 0 3 281.356 2.585 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](n2cccn2)C1 ZINC000361066658 526349702 /nfs/dbraw/zinc/34/97/02/526349702.db2.gz KZIFKGMNPXIKLV-AWEZNQCLSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](n2cccn2)C1 ZINC000361066658 526349707 /nfs/dbraw/zinc/34/97/07/526349707.db2.gz KZIFKGMNPXIKLV-AWEZNQCLSA-N 0 3 275.327 2.565 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000290828442 526371825 /nfs/dbraw/zinc/37/18/25/526371825.db2.gz HIKWKMOFTDTTPQ-HOTGVXAUSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000290828442 526371829 /nfs/dbraw/zinc/37/18/29/526371829.db2.gz HIKWKMOFTDTTPQ-HOTGVXAUSA-N 0 3 273.376 2.926 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000278357583 526372756 /nfs/dbraw/zinc/37/27/56/526372756.db2.gz JHZUJZWSIOKRND-YPMHNXCESA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000278357583 526372761 /nfs/dbraw/zinc/37/27/61/526372761.db2.gz JHZUJZWSIOKRND-YPMHNXCESA-N 0 3 289.297 2.527 20 10 CFCDHN Cc1nnsc1CN[C@H](C)c1ccc(C)cc1O ZINC000293275478 526449341 /nfs/dbraw/zinc/44/93/41/526449341.db2.gz CNQRPKNGEKOGRI-SECBINFHSA-N 0 3 263.366 2.711 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000289870246 527625649 /nfs/dbraw/zinc/62/56/49/527625649.db2.gz OYIFCNDFHUMBQE-FUHWJXTLSA-N 0 3 283.371 2.648 20 10 CFCDHN C[C@@H]1COCCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000753987741 574061211 /nfs/dbraw/zinc/06/12/11/574061211.db2.gz SZYICRGBVMFZNF-LBPRGKRZSA-N 0 3 293.407 2.864 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1C[C@@](C)(OC)C1(C)C ZINC000744448320 574075030 /nfs/dbraw/zinc/07/50/30/574075030.db2.gz IDTHPPKXQSJPBO-GOEBONIOSA-N 0 3 279.380 2.694 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756369791 574097793 /nfs/dbraw/zinc/09/77/93/574097793.db2.gz CYGJAKJSNYJTNC-PWSUYJOCSA-N 0 3 275.327 2.566 20 10 CFCDHN COc1cc(CN2CC[C@@H](OC)C2)c(O)c(C(C)(C)C)c1 ZINC000754736342 574117442 /nfs/dbraw/zinc/11/74/42/574117442.db2.gz JYLCSOXVQMNWOH-CYBMUJFWSA-N 0 3 293.407 2.919 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)C(C)C)c([O-])c1C ZINC000756586421 574127197 /nfs/dbraw/zinc/12/71/97/574127197.db2.gz RNSYSRBTHXBLNL-TZMCWYRMSA-N 0 3 251.370 2.677 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CC[C@H](C)C2)c1 ZINC000756630482 574127562 /nfs/dbraw/zinc/12/75/62/574127562.db2.gz WHUKRRSVPSLSBA-UONOGXRCSA-N 0 3 262.397 2.693 20 10 CFCDHN CCCCCCN(C)CC(=O)NCc1ccccc1O ZINC000731872680 574131922 /nfs/dbraw/zinc/13/19/22/574131922.db2.gz OUZDVQOBBQZQCJ-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN COCC(C)(C)CN(C)c1ccc(OCCN(C)C)cc1 ZINC000756098812 574209622 /nfs/dbraw/zinc/20/96/22/574209622.db2.gz GKIFRVBAHMKINY-UHFFFAOYSA-N 0 3 294.439 2.736 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756345469 574227708 /nfs/dbraw/zinc/22/77/08/574227708.db2.gz XQHSAINANZZUOZ-YPMHNXCESA-N 0 3 289.354 2.956 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccco2)c([O-])c1C ZINC000756383305 574231776 /nfs/dbraw/zinc/23/17/76/574231776.db2.gz XKQMNOCLZLEBEZ-OCCSQVGLSA-N 0 3 275.348 2.986 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)c2ccco2)c1 ZINC000756382924 574231799 /nfs/dbraw/zinc/23/17/99/574231799.db2.gz HGCPZRAHHQIDHO-RISCZKNCSA-N 0 3 261.321 2.678 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1cc(F)ccc1[O-] ZINC000756433961 574236763 /nfs/dbraw/zinc/23/67/63/574236763.db2.gz ROUPDHJHWGTGFB-YGRLFVJLSA-N 0 3 266.360 2.522 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756457179 574238679 /nfs/dbraw/zinc/23/86/79/574238679.db2.gz HFWDBSYYANGGFS-ZYHUDNBSSA-N 0 3 294.370 2.586 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@](C)(CC)CC(=O)OC)c1 ZINC000748242181 574242424 /nfs/dbraw/zinc/24/24/24/574242424.db2.gz JIINVANOGLPRQV-MRXNPFEDSA-N 0 3 295.379 2.612 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756552536 574246381 /nfs/dbraw/zinc/24/63/81/574246381.db2.gz GFXNJGPSRVJTNC-OSQNNJELSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@@H]2CCOC2)c([O-])c1C ZINC000756564181 574248211 /nfs/dbraw/zinc/24/82/11/574248211.db2.gz QYDFKDCCGCRDGI-HUUCEWRRSA-N 0 3 293.407 2.713 20 10 CFCDHN C[C@@H]([NH2+]CCOc1cccnc1)c1cc(F)ccc1[O-] ZINC000756570196 574248705 /nfs/dbraw/zinc/24/87/05/574248705.db2.gz BJKSEHVGGKHNPX-LLVKDONJSA-N 0 3 276.311 2.656 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756573664 574249331 /nfs/dbraw/zinc/24/93/31/574249331.db2.gz BQLUZIZQABSFRU-SCVCMEIPSA-N 0 3 267.344 2.830 20 10 CFCDHN CCCCN(C)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756574626 574249369 /nfs/dbraw/zinc/24/93/69/574249369.db2.gz DRQHTRJJLQRNLH-LBPRGKRZSA-N 0 3 268.376 2.914 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000756576736 574249867 /nfs/dbraw/zinc/24/98/67/574249867.db2.gz ODUNNQYMVFMHEE-OZVIIMIRSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@@H]2CCCO2)c([O-])c1 ZINC000756585109 574250606 /nfs/dbraw/zinc/25/06/06/574250606.db2.gz XHJCDNASPUAGRT-KGLIPLIRSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756602817 574251652 /nfs/dbraw/zinc/25/16/52/574251652.db2.gz FPTCBKSVSHKZHC-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@@H]2C)c1 ZINC000756619774 574252504 /nfs/dbraw/zinc/25/25/04/574252504.db2.gz ZSJMVYYEYMZCFX-STQMWFEESA-N 0 3 278.396 2.536 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@]2(O)CCSC2)c2c1c(F)ccc2[O-] ZINC000756636327 574253794 /nfs/dbraw/zinc/25/37/94/574253794.db2.gz ITTAJFZVBWCNIT-VPJDZLOFSA-N 0 3 297.395 2.537 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)C[C@H]2CCOC2)c1 ZINC000756644967 574254476 /nfs/dbraw/zinc/25/44/76/574254476.db2.gz DJNCGFTTWAZOOC-RWMBFGLXSA-N 0 3 279.380 2.867 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](CO)Cc2ccco2)c1 ZINC000756659720 574256269 /nfs/dbraw/zinc/25/62/69/574256269.db2.gz FNRIUEOFABUZLH-KBPBESRZSA-N 0 3 289.375 2.795 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1cc(F)ccc1[O-] ZINC000756661186 574256396 /nfs/dbraw/zinc/25/63/96/574256396.db2.gz PLJLVGNVHZBDBY-RYUDHWBXSA-N 0 3 293.338 2.626 20 10 CFCDHN Cc1noc(CC[NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)n1 ZINC000756689130 574257486 /nfs/dbraw/zinc/25/74/86/574257486.db2.gz RPWLWNLLJLULNN-KWQFWETISA-N 0 3 291.326 2.603 20 10 CFCDHN CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C(F)(F)F ZINC000756834296 574266099 /nfs/dbraw/zinc/26/60/99/574266099.db2.gz DTLMWUNPIFKFFY-WRWORJQWSA-N 0 3 281.249 2.759 20 10 CFCDHN CO[C@H](CN[C@@H](C)c1cc(C)ccc1O)C(F)(F)F ZINC000756834603 574266132 /nfs/dbraw/zinc/26/61/32/574266132.db2.gz HNYYMCWAFIADTL-JOYOIKCWSA-N 0 3 277.286 2.929 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]3COCC[C@@H]31)CCC2 ZINC000756884770 574270699 /nfs/dbraw/zinc/27/06/99/574270699.db2.gz JFRGNDWXOGYQMJ-WBVHZDCISA-N 0 3 287.403 2.882 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]3COCC[C@@H]31)CCC2 ZINC000756884770 574270700 /nfs/dbraw/zinc/27/07/00/574270700.db2.gz JFRGNDWXOGYQMJ-WBVHZDCISA-N 0 3 287.403 2.882 20 10 CFCDHN CCN(C)c1ccc(CN2CCSCC2)cc1 ZINC000741754568 574300597 /nfs/dbraw/zinc/30/05/97/574300597.db2.gz SJUAWAXNEIOVSB-UHFFFAOYSA-N 0 3 250.411 2.692 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@@H]([C@@H]3CCOC3)C1)CCC2 ZINC000749797990 574309671 /nfs/dbraw/zinc/30/96/71/574309671.db2.gz CXRGUVSACIIUEC-HZPDHXFCSA-N 0 3 287.403 2.739 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@@H]([C@@H]3CCOC3)C1)CCC2 ZINC000749797990 574309672 /nfs/dbraw/zinc/30/96/72/574309672.db2.gz CXRGUVSACIIUEC-HZPDHXFCSA-N 0 3 287.403 2.739 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(O)CCCCCC1 ZINC000735505940 574327517 /nfs/dbraw/zinc/32/75/17/574327517.db2.gz AHTZIYOCZLZXMR-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCN1CCc2ccccc21 ZINC000725848951 574329299 /nfs/dbraw/zinc/32/92/99/574329299.db2.gz DOKGGPRISQMOJN-UHFFFAOYSA-N 0 3 268.360 2.545 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)COc2ccccc2)c1[O-] ZINC000725849351 574330050 /nfs/dbraw/zinc/33/00/50/574330050.db2.gz KWNQBDYZGZGOQU-ZDUSSCGKSA-N 0 3 287.359 2.958 20 10 CFCDHN CCN(CC)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743396358 574362502 /nfs/dbraw/zinc/36/25/02/574362502.db2.gz ZMSKGKGOJBTVAK-HNNXBMFYSA-N 0 3 299.418 2.857 20 10 CFCDHN CCN(CC)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743396358 574362506 /nfs/dbraw/zinc/36/25/06/574362506.db2.gz ZMSKGKGOJBTVAK-HNNXBMFYSA-N 0 3 299.418 2.857 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H](CC)C[C@@H](C)CO)c1 ZINC000743499712 574367043 /nfs/dbraw/zinc/36/70/43/574367043.db2.gz PPKHCUHAMWYICU-TZMCWYRMSA-N 0 3 281.396 2.678 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]CCN1CCC1 ZINC000752107937 574388080 /nfs/dbraw/zinc/38/80/80/574388080.db2.gz TYPAFUYZFHTRLH-UHFFFAOYSA-N 0 3 282.387 2.855 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCOC1 ZINC000752106490 574388114 /nfs/dbraw/zinc/38/81/14/574388114.db2.gz YXRUQWJLJNSTLF-INIZCTEOSA-N 0 3 269.344 2.938 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@@H](C)C2CC2)c([O-])c1OC ZINC000891643195 617694530 /nfs/dbraw/zinc/69/45/30/617694530.db2.gz IQGOISNGBGKKSL-JTQLQIEISA-N 0 3 265.353 2.640 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)c([O-])c1OC ZINC000891643195 617694531 /nfs/dbraw/zinc/69/45/31/617694531.db2.gz IQGOISNGBGKKSL-JTQLQIEISA-N 0 3 265.353 2.640 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@]1(C)Br ZINC000891714048 617724176 /nfs/dbraw/zinc/72/41/76/617724176.db2.gz PZGDLXXBBILMGV-AAEUAGOBSA-N 0 3 284.197 2.998 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@]1(C)Br ZINC000891714048 617724179 /nfs/dbraw/zinc/72/41/79/617724179.db2.gz PZGDLXXBBILMGV-AAEUAGOBSA-N 0 3 284.197 2.998 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](CO)c1cccnc1)c1ccccc1[O-] ZINC000806179018 617843174 /nfs/dbraw/zinc/84/31/74/617843174.db2.gz NFXLSQBLMXKCFF-GOEBONIOSA-N 0 3 286.375 2.604 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000806660221 617883369 /nfs/dbraw/zinc/88/33/69/617883369.db2.gz ALLIJQBASXQTAI-NHCYSSNCSA-N 0 3 265.328 2.848 20 10 CFCDHN CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)CCS1 ZINC000892068162 617936772 /nfs/dbraw/zinc/93/67/72/617936772.db2.gz ZVJVHEAFONQTRX-GFCCVEGCSA-N 0 3 297.420 2.737 20 10 CFCDHN COc1ccc(O)c(CNCc2ccccc2[N+](=O)[O-])c1 ZINC000050015554 618060226 /nfs/dbraw/zinc/06/02/26/618060226.db2.gz KDINAYMUFMDATF-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN COC[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000307778887 618142537 /nfs/dbraw/zinc/14/25/37/618142537.db2.gz OQKYSAIPNDDSGA-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN COC[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000307778887 618142538 /nfs/dbraw/zinc/14/25/38/618142538.db2.gz OQKYSAIPNDDSGA-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CCC[NH+]1CCC(N(C)Cc2cc(F)cc(F)c2[O-])CC1 ZINC000893968153 618255727 /nfs/dbraw/zinc/25/57/27/618255727.db2.gz ZKIWQMGBNGNOKV-UHFFFAOYSA-N 0 3 298.377 2.977 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@@H]21 ZINC000894096430 618323824 /nfs/dbraw/zinc/32/38/24/618323824.db2.gz UZWOIHGIDBCKJP-ABAIWWIYSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@@H]21 ZINC000894096430 618323830 /nfs/dbraw/zinc/32/38/30/618323830.db2.gz UZWOIHGIDBCKJP-ABAIWWIYSA-N 0 3 296.361 2.587 20 10 CFCDHN CNC(=O)[C@]1(C)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000320139457 618427268 /nfs/dbraw/zinc/42/72/68/618427268.db2.gz FGWSRVRWUWXVIG-GOSISDBHSA-N 0 3 298.386 2.503 20 10 CFCDHN CNC(=O)[C@]1(C)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000320139457 618427269 /nfs/dbraw/zinc/42/72/69/618427269.db2.gz FGWSRVRWUWXVIG-GOSISDBHSA-N 0 3 298.386 2.503 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CC[C@@H]3COCC[C@@H]3C2)c([O-])c1 ZINC000894184552 618431970 /nfs/dbraw/zinc/43/19/70/618431970.db2.gz BETHKCUWXUNPER-BPLDGKMQSA-N 0 3 291.391 2.696 20 10 CFCDHN CCCN(CC(=O)NCC1CCC1)Cc1ccccc1O ZINC000066497622 618619537 /nfs/dbraw/zinc/61/95/37/618619537.db2.gz XRWQVJBQNDMKKD-UHFFFAOYSA-N 0 3 290.407 2.521 20 10 CFCDHN Cc1ncsc1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000310822673 618649261 /nfs/dbraw/zinc/64/92/61/618649261.db2.gz HQUIIJXLGUEMQI-LLVKDONJSA-N 0 3 260.362 2.934 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)CC2 ZINC000312060956 618865374 /nfs/dbraw/zinc/86/53/74/618865374.db2.gz CKWPAWNYPHTESM-IOASZLSFSA-N 0 3 259.349 2.537 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCN(Cc2ccccn2)CC1 ZINC000238095912 619209176 /nfs/dbraw/zinc/20/91/76/619209176.db2.gz VWGUFIKBICYPLZ-UHFFFAOYSA-N 0 3 297.402 2.541 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895843831 619617310 /nfs/dbraw/zinc/61/73/10/619617310.db2.gz DAJOLPFMSVXNRW-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895843831 619617311 /nfs/dbraw/zinc/61/73/11/619617311.db2.gz DAJOLPFMSVXNRW-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895843832 619617449 /nfs/dbraw/zinc/61/74/49/619617449.db2.gz DAJOLPFMSVXNRW-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895843832 619617450 /nfs/dbraw/zinc/61/74/50/619617450.db2.gz DAJOLPFMSVXNRW-XJKSGUPXSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@@H](C(F)(F)F)O2)c([O-])c1 ZINC000896284588 619709844 /nfs/dbraw/zinc/70/98/44/619709844.db2.gz XYZPSGYUCICMDH-AAEUAGOBSA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1nc2c(s1)CCC2 ZINC000896840169 619838034 /nfs/dbraw/zinc/83/80/34/619838034.db2.gz BETOPZGHSQUMHI-UHFFFAOYSA-N 0 3 288.416 2.978 20 10 CFCDHN Cc1cccc(CNCc2cc(C(F)(F)F)nn2C)c1O ZINC000896841530 619838245 /nfs/dbraw/zinc/83/82/45/619838245.db2.gz MYWKKQZBYCOCCL-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CC2)[C@H]2CCCOC2)c([O-])c1 ZINC000897082584 619926353 /nfs/dbraw/zinc/92/63/53/619926353.db2.gz VJEILFZSDZMNNZ-DOTOQJQBSA-N 0 3 275.392 2.995 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2ccco2)c1[O-] ZINC000228669582 620072692 /nfs/dbraw/zinc/07/26/92/620072692.db2.gz YFCHQPLDDQTCED-UHFFFAOYSA-N 0 3 281.739 2.980 20 10 CFCDHN COc1ccc(O)c(CN2CC(Cc3ccoc3)C2)c1 ZINC000898160805 620341079 /nfs/dbraw/zinc/34/10/79/620341079.db2.gz VGHDXFBGOJFAML-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN COc1ccc(CNCc2ccc(CCO)cc2)cc1C ZINC000898172635 620343119 /nfs/dbraw/zinc/34/31/19/620343119.db2.gz SOZJNGYMURPHAP-UHFFFAOYSA-N 0 3 285.387 2.828 20 10 CFCDHN C[C@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCCO1 ZINC000927018208 620440067 /nfs/dbraw/zinc/44/00/67/620440067.db2.gz KXGWQASOVMVZBT-XJKSGUPXSA-N 0 3 261.365 2.928 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOC1CCSCC1 ZINC000898440932 620462569 /nfs/dbraw/zinc/46/25/69/620462569.db2.gz WEJYFEZXUHHELY-UHFFFAOYSA-N 0 3 285.384 2.533 20 10 CFCDHN CC[C@H](N[C@@H]1C[NH2+]CC1(C)C)c1ccc(F)cc1[O-] ZINC000902445260 621083147 /nfs/dbraw/zinc/08/31/47/621083147.db2.gz PQDFLKDYXWTKCV-GXTWGEPZSA-N 0 3 266.360 2.570 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CC(=O)N(C)C2)c([O-])c1 ZINC000903213678 621289955 /nfs/dbraw/zinc/28/99/55/621289955.db2.gz PJGGEWMPPSMXOE-UONOGXRCSA-N 0 3 290.407 2.528 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])CCOC1 ZINC000903357522 621347331 /nfs/dbraw/zinc/34/73/31/621347331.db2.gz MZOAQUSSIBWEDK-BLLLJJGKSA-N 0 3 297.370 2.766 20 10 CFCDHN Cc1ncccc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000903417209 621366222 /nfs/dbraw/zinc/36/62/22/621366222.db2.gz BICYBBVIDBCILX-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@H](C2OCCO2)C1 ZINC000905695269 621829077 /nfs/dbraw/zinc/82/90/77/621829077.db2.gz MUSLUWOUSYUDGX-AWEZNQCLSA-N 0 3 299.370 2.740 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@H](C2OCCO2)C1 ZINC000905695269 621829080 /nfs/dbraw/zinc/82/90/80/621829080.db2.gz MUSLUWOUSYUDGX-AWEZNQCLSA-N 0 3 299.370 2.740 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000156685313 622954312 /nfs/dbraw/zinc/95/43/12/622954312.db2.gz BYQVBPUXVAHOTN-TZMCWYRMSA-N 0 3 290.407 2.832 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1cc(F)ccc1[O-] ZINC000227372905 623108728 /nfs/dbraw/zinc/10/87/28/623108728.db2.gz ZSIXSXGSVIBYSQ-CQDKDKBSSA-N 0 3 278.371 2.809 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1=O)c1ccccc1[O-] ZINC000822817903 623181092 /nfs/dbraw/zinc/18/10/92/623181092.db2.gz BLABQQOMUBETAN-UONOGXRCSA-N 0 3 290.407 2.832 20 10 CFCDHN CCN(C)c1ccc(CN2CCC[C@H](n3ccnn3)C2)cc1 ZINC000823469354 623328399 /nfs/dbraw/zinc/32/83/99/623328399.db2.gz VVFRIGMCZOWUNF-KRWDZBQOSA-N 0 3 299.422 2.571 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCCC1CCOCC1 ZINC000824477797 623511631 /nfs/dbraw/zinc/51/16/31/623511631.db2.gz YBRRWPNSHWHXPU-UHFFFAOYSA-N 0 3 267.344 2.828 20 10 CFCDHN CCN(Cc1cnn2c1CCC2)Cc1ccc(N(C)C)cc1 ZINC000824484683 623512487 /nfs/dbraw/zinc/51/24/87/623512487.db2.gz QJTIINUXRRMQQE-UHFFFAOYSA-N 0 3 298.434 2.917 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@](C)(COC)C2)c([O-])c1 ZINC000824576925 623526982 /nfs/dbraw/zinc/52/69/82/623526982.db2.gz VEKLBJRTGCILEO-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@](C)(COC)C2)c([O-])c1 ZINC000824576925 623526988 /nfs/dbraw/zinc/52/69/88/623526988.db2.gz VEKLBJRTGCILEO-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c1[O-] ZINC000824715562 623550083 /nfs/dbraw/zinc/55/00/83/623550083.db2.gz MVSQNVCPGQCMLF-RRFJBIMHSA-N 0 3 291.391 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c1[O-] ZINC000824715562 623550088 /nfs/dbraw/zinc/55/00/88/623550088.db2.gz MVSQNVCPGQCMLF-RRFJBIMHSA-N 0 3 291.391 2.526 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@](C)(CC)OC)c([O-])c1 ZINC000824743982 623556389 /nfs/dbraw/zinc/55/63/89/623556389.db2.gz ULOOVOSCJLGMNU-HNNXBMFYSA-N 0 3 267.369 2.696 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000824820403 623572950 /nfs/dbraw/zinc/57/29/50/623572950.db2.gz FQSQJNSJEDNETR-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000824820403 623572953 /nfs/dbraw/zinc/57/29/53/623572953.db2.gz FQSQJNSJEDNETR-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1ccccc1[O-])[C@@H](CO)C(C)C ZINC000824847259 623577314 /nfs/dbraw/zinc/57/73/14/623577314.db2.gz XMTCBVJSEJXYPW-GOEBONIOSA-N 0 3 265.397 2.771 20 10 CFCDHN CO[C@@H]1C[C@H]([N@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103980 623631593 /nfs/dbraw/zinc/63/15/93/623631593.db2.gz JNLZRGDJSWQDPP-LSDHHAIUSA-N 0 3 279.355 2.921 20 10 CFCDHN CO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103980 623631596 /nfs/dbraw/zinc/63/15/96/623631596.db2.gz JNLZRGDJSWQDPP-LSDHHAIUSA-N 0 3 279.355 2.921 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H]2CCCN(C)C2)cc1Cl ZINC000825258286 623660810 /nfs/dbraw/zinc/66/08/10/623660810.db2.gz BSQFDABMXRFERU-GFCCVEGCSA-N 0 3 282.815 2.785 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)C1CC1 ZINC000324174177 623729571 /nfs/dbraw/zinc/72/95/71/623729571.db2.gz WANWTNYRRMKCQR-OAHLLOKOSA-N 0 3 263.337 2.645 20 10 CFCDHN COCCC1C[NH+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000826899857 623905179 /nfs/dbraw/zinc/90/51/79/623905179.db2.gz WYDRMTVMENDNGW-UHFFFAOYSA-N 0 3 269.772 2.822 20 10 CFCDHN COCCC1CN(Cc2cc(Cl)cc(C)c2O)C1 ZINC000826899857 623905181 /nfs/dbraw/zinc/90/51/81/623905181.db2.gz WYDRMTVMENDNGW-UHFFFAOYSA-N 0 3 269.772 2.822 20 10 CFCDHN COCC1(C2CCC2)C[NH+](Cc2c([O-])cccc2OC)C1 ZINC000827012523 623925018 /nfs/dbraw/zinc/92/50/18/623925018.db2.gz ZSXWHOSTICDRPR-UHFFFAOYSA-N 0 3 291.391 2.649 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000827179303 623960233 /nfs/dbraw/zinc/96/02/33/623960233.db2.gz UMQBZBGXPSGGLL-ZBFHGGJFSA-N 0 3 273.307 2.799 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1COc2cc(F)ccc2C1 ZINC000827261209 623976928 /nfs/dbraw/zinc/97/69/28/623976928.db2.gz XWZCSWAVYTWJFG-CQSZACIVSA-N 0 3 291.297 2.764 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827284705 623980834 /nfs/dbraw/zinc/98/08/34/623980834.db2.gz VNJGMXUTPUWCPH-XHDPSFHLSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827284705 623980835 /nfs/dbraw/zinc/98/08/35/623980835.db2.gz VNJGMXUTPUWCPH-XHDPSFHLSA-N 0 3 297.782 2.523 20 10 CFCDHN C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 ZINC000827370172 623994576 /nfs/dbraw/zinc/99/45/76/623994576.db2.gz BBGPRDBKSVEMNU-OLZOCXBDSA-N 0 3 280.387 2.891 20 10 CFCDHN COc1cnccc1[C@@H](C)NCc1cc(C)ccc1O ZINC000189561691 625696612 /nfs/dbraw/zinc/69/66/12/625696612.db2.gz PGSRBFMVXVCECE-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN CN(C)c1ccc(CN(C)CC2=CCSC2)cc1F ZINC000827804844 624097170 /nfs/dbraw/zinc/09/71/70/624097170.db2.gz ATVDACQLOLICGB-UHFFFAOYSA-N 0 3 280.412 2.997 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccccc1CO)CC2 ZINC000834531097 625702695 /nfs/dbraw/zinc/70/26/95/625702695.db2.gz PDKDMUACCAUUCL-HNNXBMFYSA-N 0 3 269.344 2.662 20 10 CFCDHN CCn1nccc1CNCc1cc(Cl)cc(OC)c1O ZINC000827957392 624139377 /nfs/dbraw/zinc/13/93/77/624139377.db2.gz SYYRKUTZJRHMEE-UHFFFAOYSA-N 0 3 295.770 2.560 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1cn3c(n1)CCCC3)CC2 ZINC000834509106 625699540 /nfs/dbraw/zinc/69/95/40/625699540.db2.gz WRAIRVKAEKFPIR-HNNXBMFYSA-N 0 3 297.402 2.745 20 10 CFCDHN COc1ccc2c(c1)C[C@@H](C[N@H+](C)Cc1ccccc1[O-])O2 ZINC000929974937 624335452 /nfs/dbraw/zinc/33/54/52/624335452.db2.gz CGQGGMYWAGTPBB-INIZCTEOSA-N 0 3 299.370 2.836 20 10 CFCDHN COc1ccc2c(c1)C[C@@H](C[N@@H+](C)Cc1ccccc1[O-])O2 ZINC000929974937 624335456 /nfs/dbraw/zinc/33/54/56/624335456.db2.gz CGQGGMYWAGTPBB-INIZCTEOSA-N 0 3 299.370 2.836 20 10 CFCDHN COc1cccc(C[N@H+](CCN(C)C)C2CCCC2)c1[O-] ZINC000154611399 624409377 /nfs/dbraw/zinc/40/93/77/624409377.db2.gz LKSOXWDCAFMIJZ-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN COc1cccc(C[N@@H+](CCN(C)C)C2CCCC2)c1[O-] ZINC000154611399 624409389 /nfs/dbraw/zinc/40/93/89/624409389.db2.gz LKSOXWDCAFMIJZ-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN CN(Cc1ccccc1O)Cc1cccc2nccn21 ZINC000179770436 624976705 /nfs/dbraw/zinc/97/67/05/624976705.db2.gz XJUAJXYSBFAJMT-UHFFFAOYSA-N 0 3 267.332 2.672 20 10 CFCDHN CO[C@]1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000180816759 625042368 /nfs/dbraw/zinc/04/23/68/625042368.db2.gz OGDYJTWVIWROGV-UKRRQHHQSA-N 0 3 267.344 2.825 20 10 CFCDHN C[C@@H](Cc1ccncc1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834615872 625735735 /nfs/dbraw/zinc/73/57/35/625735735.db2.gz JKONIAYWVOBSRN-SWLSCSKDSA-N 0 3 268.360 2.995 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccc(CO)cc1)CC2 ZINC000834702371 625791357 /nfs/dbraw/zinc/79/13/57/625791357.db2.gz OADNXEIJHMXFEB-INIZCTEOSA-N 0 3 283.371 2.704 20 10 CFCDHN CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834793932 625863347 /nfs/dbraw/zinc/86/33/47/625863347.db2.gz KBEHGIWUDKXZTF-GUTXKFCHSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@](C)(O)COC)c1ccc(C)cc1[O-] ZINC000834844153 625899528 /nfs/dbraw/zinc/89/95/28/625899528.db2.gz NNEBYHMFTMAQQF-GDBMZVCRSA-N 0 3 281.396 2.529 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCOC[C@H]1OC)c1ccc(C)cc1[O-] ZINC000834880814 625907643 /nfs/dbraw/zinc/90/76/43/625907643.db2.gz RVRHARHRNCSQOY-UKPHBRMFSA-N 0 3 293.407 2.793 20 10 CFCDHN CO[C@@H]1COCC[C@@H]1C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000834880766 625907677 /nfs/dbraw/zinc/90/76/77/625907677.db2.gz QAICMBAZURGWQR-SQWLQELKSA-N 0 3 293.407 2.711 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2cnn(C)c2)c([O-])c1 ZINC000834896849 625913212 /nfs/dbraw/zinc/91/32/12/625913212.db2.gz OJRNGFPMVGPIEJ-STQMWFEESA-N 0 3 273.380 2.716 20 10 CFCDHN CC[C@@H]([NH2+]CCC1(CO)CC1)c1ccc(C)cc1[O-] ZINC000834898039 625914148 /nfs/dbraw/zinc/91/41/48/625914148.db2.gz YQEQBJVOZNOSKT-CQSZACIVSA-N 0 3 263.381 2.904 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000834906301 625918104 /nfs/dbraw/zinc/91/81/04/625918104.db2.gz OOZJDILASUPWMH-HZSPNIEDSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCC[C@H]2O)c1[O-] ZINC000834912583 625920846 /nfs/dbraw/zinc/92/08/46/625920846.db2.gz DQBCQTANSOQNGP-ZWKOPEQDSA-N 0 3 269.772 2.918 20 10 CFCDHN C[C@@H]([NH2+][C@H](CN)C1CC1)c1cc(Br)ccc1[O-] ZINC000817960759 625964820 /nfs/dbraw/zinc/96/48/20/625964820.db2.gz RDDCOCCCHGPLLB-PRHODGIISA-N 0 3 299.212 2.543 20 10 CFCDHN O[C@@H]1Cc2ccccc2[C@@H]1NCc1ccc2c(c1)CCCO2 ZINC000921654380 626049601 /nfs/dbraw/zinc/04/96/01/626049601.db2.gz ISQBUXLSMCVDDB-MJGOQNOKSA-N 0 3 295.382 2.760 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)NCc1ccc2c(c1)CCCO2 ZINC000921688087 626084103 /nfs/dbraw/zinc/08/41/03/626084103.db2.gz OLTZJZVFNNCUJO-LBPRGKRZSA-N 0 3 285.391 2.904 20 10 CFCDHN CN(C)c1ccnc(CNCc2ccc3c(c2)CCCO3)c1 ZINC000922477334 626294976 /nfs/dbraw/zinc/29/49/76/626294976.db2.gz AWDOFTULRLHGTQ-UHFFFAOYSA-N 0 3 297.402 2.762 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC000922692934 626343679 /nfs/dbraw/zinc/34/36/79/626343679.db2.gz CHYUNKGYRMUEBH-WCQYABFASA-N 0 3 289.297 2.982 20 10 CFCDHN CCC[C@@H](O)CCNCc1cc(F)c(N(C)C)cc1F ZINC000922819500 626373731 /nfs/dbraw/zinc/37/37/31/626373731.db2.gz XOADWWQJVKZLHK-GFCCVEGCSA-N 0 3 286.366 2.672 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000839191839 626530666 /nfs/dbraw/zinc/53/06/66/626530666.db2.gz KNWKYGIJKNGZMV-DOTOQJQBSA-N 0 3 293.382 2.904 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000839191839 626530667 /nfs/dbraw/zinc/53/06/67/626530667.db2.gz KNWKYGIJKNGZMV-DOTOQJQBSA-N 0 3 293.382 2.904 20 10 CFCDHN CCCN(Cc1ccccc1O)[C@H](C)c1n[nH]c(C)n1 ZINC000839498371 626538203 /nfs/dbraw/zinc/53/82/03/626538203.db2.gz IWZINLSFRPXOLA-LLVKDONJSA-N 0 3 274.368 2.792 20 10 CFCDHN COc1ccc(CNCc2cccc(OC)c2O)c(F)c1 ZINC000758486556 626595600 /nfs/dbraw/zinc/59/56/00/626595600.db2.gz FENFHEAIHQRKQZ-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CCO)C2)c1[O-] ZINC000761194332 626814629 /nfs/dbraw/zinc/81/46/29/626814629.db2.gz YUEWJABBOYPTCQ-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CCO)C2)c1[O-] ZINC000761194332 626814633 /nfs/dbraw/zinc/81/46/33/626814633.db2.gz YUEWJABBOYPTCQ-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN CCC[N@H+](CCC(OC)OC)Cc1ccccc1[O-] ZINC000851792762 634531408 /nfs/dbraw/zinc/53/14/08/634531408.db2.gz SGTGTPPKEQCGBO-UHFFFAOYSA-N 0 3 267.369 2.613 20 10 CFCDHN CCC[N@@H+](CCC(OC)OC)Cc1ccccc1[O-] ZINC000851792762 634531417 /nfs/dbraw/zinc/53/14/17/634531417.db2.gz SGTGTPPKEQCGBO-UHFFFAOYSA-N 0 3 267.369 2.613 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000762785671 626937158 /nfs/dbraw/zinc/93/71/58/626937158.db2.gz GDTKEMCCGZJZKT-GXFFZTMASA-N 0 3 289.354 2.645 20 10 CFCDHN Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2[O-])c(C)n1 ZINC000765625369 627151125 /nfs/dbraw/zinc/15/11/25/627151125.db2.gz HWQQKJLXQNRHSZ-SNVBAGLBSA-N 0 3 257.337 2.650 20 10 CFCDHN CCc1cc(CN[C@H](C)c2ccc(N(C)C)cc2)n[nH]1 ZINC000765995244 627169784 /nfs/dbraw/zinc/16/97/84/627169784.db2.gz STKPWJMPARDNQY-GFCCVEGCSA-N 0 3 272.396 2.889 20 10 CFCDHN CCc1cc(CN[C@H](C)c2ccc(N(C)C)cc2)[nH]n1 ZINC000765995244 627169785 /nfs/dbraw/zinc/16/97/85/627169785.db2.gz STKPWJMPARDNQY-GFCCVEGCSA-N 0 3 272.396 2.889 20 10 CFCDHN CCCC[N@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC1 ZINC000768440105 627342532 /nfs/dbraw/zinc/34/25/32/627342532.db2.gz DCGVKUMZBYNNRN-OAHLLOKOSA-N 0 3 277.364 2.583 20 10 CFCDHN CCCC[N@@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC1 ZINC000768440105 627342538 /nfs/dbraw/zinc/34/25/38/627342538.db2.gz DCGVKUMZBYNNRN-OAHLLOKOSA-N 0 3 277.364 2.583 20 10 CFCDHN CC[C@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464799 627345001 /nfs/dbraw/zinc/34/50/01/627345001.db2.gz AOJPHEBIHBUFCU-NVXWUHKLSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464799 627345005 /nfs/dbraw/zinc/34/50/05/627345005.db2.gz AOJPHEBIHBUFCU-NVXWUHKLSA-N 0 3 291.391 2.830 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC000769035137 627397559 /nfs/dbraw/zinc/39/75/59/627397559.db2.gz VPFBQVMUXJXNBF-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC000769035137 627397563 /nfs/dbraw/zinc/39/75/63/627397563.db2.gz VPFBQVMUXJXNBF-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN C[N@H+](Cc1cc(Cl)ccc1[O-])[C@@H]1CCN(C2CC2)C1 ZINC000769326427 627424651 /nfs/dbraw/zinc/42/46/51/627424651.db2.gz MBIJGUJFDJUDNZ-CQSZACIVSA-N 0 3 280.799 2.714 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)ccc1[O-])[C@@H]1CCN(C2CC2)C1 ZINC000769326427 627424653 /nfs/dbraw/zinc/42/46/53/627424653.db2.gz MBIJGUJFDJUDNZ-CQSZACIVSA-N 0 3 280.799 2.714 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2c([O-])cccc2OC)C1 ZINC000769422084 627437004 /nfs/dbraw/zinc/43/70/04/627437004.db2.gz GLEBUURRPZPPSA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2c([O-])cccc2OC)C1 ZINC000769422084 627437005 /nfs/dbraw/zinc/43/70/05/627437005.db2.gz GLEBUURRPZPPSA-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]3COCC[C@@H]32)c([O-])c1 ZINC000770285895 627511255 /nfs/dbraw/zinc/51/12/55/627511255.db2.gz LHIIRKAIWIHXNS-HOCLYGCPSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c([O-])c1 ZINC000770285895 627511259 /nfs/dbraw/zinc/51/12/59/627511259.db2.gz LHIIRKAIWIHXNS-HOCLYGCPSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC1(O)CCC([NH2+]Cc2c([O-])cccc2OC)CC1 ZINC000771875134 627640677 /nfs/dbraw/zinc/64/06/77/627640677.db2.gz OURJLZLWCSVERA-UHFFFAOYSA-N 0 3 279.380 2.574 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2cncs2)c1 ZINC000772983911 627765014 /nfs/dbraw/zinc/76/50/14/627765014.db2.gz NESVFVDXWUGDES-SECBINFHSA-N 0 3 264.350 2.708 20 10 CFCDHN CCCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000774480981 627931720 /nfs/dbraw/zinc/93/17/20/627931720.db2.gz GPFZOCCNMIKKQB-UONOGXRCSA-N 0 3 291.439 2.708 20 10 CFCDHN CC(C)N(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000774480710 627931734 /nfs/dbraw/zinc/93/17/34/627931734.db2.gz CGFLOJJMYYCERE-ZIAGYGMSSA-N 0 3 291.439 2.659 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000775174154 627997521 /nfs/dbraw/zinc/99/75/21/627997521.db2.gz WKTARQJOCHWEEF-OAHLLOKOSA-N 0 3 287.334 2.884 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C[C@@H](C)O)C(C)C)c1[O-] ZINC000775682418 628054546 /nfs/dbraw/zinc/05/45/46/628054546.db2.gz XCSBEFFWIKSHEO-LLVKDONJSA-N 0 3 271.788 2.945 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C[C@@H](C)O)C(C)C)c1[O-] ZINC000775682418 628054548 /nfs/dbraw/zinc/05/45/48/628054548.db2.gz XCSBEFFWIKSHEO-LLVKDONJSA-N 0 3 271.788 2.945 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)[C@@H](C)[C@@H]2C)c1O ZINC000775984034 628091358 /nfs/dbraw/zinc/09/13/58/628091358.db2.gz FBDLIGSNMWRTDS-QWRGUYRKSA-N 0 3 298.814 2.579 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCN(CC)C1=O ZINC000852019458 634628771 /nfs/dbraw/zinc/62/87/71/634628771.db2.gz ZEVWWVMDSWJWDZ-OAHLLOKOSA-N 0 3 290.407 2.615 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCN(CC)C1=O ZINC000852019458 634628774 /nfs/dbraw/zinc/62/87/74/634628774.db2.gz ZEVWWVMDSWJWDZ-OAHLLOKOSA-N 0 3 290.407 2.615 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@H](C)[C@H](OC)C2(C)C)c([O-])c1 ZINC000776497672 628154114 /nfs/dbraw/zinc/15/41/14/628154114.db2.gz DVRLRKAIRMRHBE-XZJROXQQSA-N 0 3 293.407 2.940 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000779062164 628348871 /nfs/dbraw/zinc/34/88/71/628348871.db2.gz PXHBPXJKLSGIEZ-TZMCWYRMSA-N 0 3 271.364 2.644 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000779115132 628353092 /nfs/dbraw/zinc/35/30/92/628353092.db2.gz HVWSMELYTXZOKE-HNNXBMFYSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000779115132 628353095 /nfs/dbraw/zinc/35/30/95/628353095.db2.gz HVWSMELYTXZOKE-HNNXBMFYSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000779117519 628353590 /nfs/dbraw/zinc/35/35/90/628353590.db2.gz XQOHNTOYJXLOSW-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000779117519 628353591 /nfs/dbraw/zinc/35/35/91/628353591.db2.gz XQOHNTOYJXLOSW-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000781531876 628557349 /nfs/dbraw/zinc/55/73/49/628557349.db2.gz LIFNPHYCEOOHFM-LLVKDONJSA-N 0 3 257.280 2.596 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000781531876 628557352 /nfs/dbraw/zinc/55/73/52/628557352.db2.gz LIFNPHYCEOOHFM-LLVKDONJSA-N 0 3 257.280 2.596 20 10 CFCDHN COc1cccc(O)c1CN1CCC[C@@H](OC(F)F)C1 ZINC000781531855 628557649 /nfs/dbraw/zinc/55/76/49/628557649.db2.gz KYFWVKKGFVZDBX-SNVBAGLBSA-N 0 3 287.306 2.604 20 10 CFCDHN CCCCN(C)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783510660 628714326 /nfs/dbraw/zinc/71/43/26/628714326.db2.gz QRULQTOGFPOPLT-ZDUSSCGKSA-N 0 3 250.386 2.775 20 10 CFCDHN C[C@@H]([NH2+]CCOc1cccnc1)c1ccccc1[O-] ZINC000783508557 628714384 /nfs/dbraw/zinc/71/43/84/628714384.db2.gz FMVWTYBZYOZIJV-GFCCVEGCSA-N 0 3 258.321 2.517 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCCN(Cc2ccccc2O)C1 ZINC000783718041 628737628 /nfs/dbraw/zinc/73/76/28/628737628.db2.gz OATDALCWEHAUGM-ZDUSSCGKSA-N 0 3 289.297 2.936 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000783718041 628737633 /nfs/dbraw/zinc/73/76/33/628737633.db2.gz OATDALCWEHAUGM-ZDUSSCGKSA-N 0 3 289.297 2.936 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000783718041 628737636 /nfs/dbraw/zinc/73/76/36/628737636.db2.gz OATDALCWEHAUGM-ZDUSSCGKSA-N 0 3 289.297 2.936 20 10 CFCDHN COc1ccc(C[NH2+]C2CC(OC(C)(C)C)C2)c([O-])c1 ZINC000784678011 628836408 /nfs/dbraw/zinc/83/64/08/628836408.db2.gz FHWIAXSHYRDKMV-UHFFFAOYSA-N 0 3 279.380 2.837 20 10 CFCDHN CCn1cccc(CN[C@H](C)c2ccc(N(C)C)cc2)c1=O ZINC000788603925 629086061 /nfs/dbraw/zinc/08/60/61/629086061.db2.gz GFZBRBSSORZBOC-CQSZACIVSA-N 0 3 299.418 2.785 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C[C@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000788981856 629113108 /nfs/dbraw/zinc/11/31/08/629113108.db2.gz PTFPWSDRPATPER-HKPALBBZSA-N 0 3 293.260 2.592 20 10 CFCDHN CCC[N@H+](CCC[C@@H](C)O)Cc1ccccc1[O-] ZINC000789326383 629147482 /nfs/dbraw/zinc/14/74/82/629147482.db2.gz HFHAOCQLIWBCLP-CYBMUJFWSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[N@@H+](CCC[C@@H](C)O)Cc1ccccc1[O-] ZINC000789326383 629147484 /nfs/dbraw/zinc/14/74/84/629147484.db2.gz HFHAOCQLIWBCLP-CYBMUJFWSA-N 0 3 251.370 2.765 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000790634307 629253763 /nfs/dbraw/zinc/25/37/63/629253763.db2.gz FUEGSWLYXVXWFI-UHFFFAOYSA-N 0 3 280.274 2.678 20 10 CFCDHN CO[C@@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835026183 629322994 /nfs/dbraw/zinc/32/29/94/629322994.db2.gz RQNFZXPDQZZIOD-XQDHMALISA-N 0 3 274.408 2.877 20 10 CFCDHN CCn1ccc(CN(C)Cc2cc(OC)ccc2O)c1 ZINC000792183438 629406655 /nfs/dbraw/zinc/40/66/55/629406655.db2.gz NMSSXCYKUCBHDK-UHFFFAOYSA-N 0 3 274.364 2.854 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000793609063 629578252 /nfs/dbraw/zinc/57/82/52/629578252.db2.gz MZFWQTVLKBPKMY-BBRMVZONSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000793609063 629578258 /nfs/dbraw/zinc/57/82/58/629578258.db2.gz MZFWQTVLKBPKMY-BBRMVZONSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC000793620152 629580168 /nfs/dbraw/zinc/58/01/68/629580168.db2.gz MBXPMNVKEHFPIU-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC000793620152 629580172 /nfs/dbraw/zinc/58/01/72/629580172.db2.gz MBXPMNVKEHFPIU-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000794807102 629688110 /nfs/dbraw/zinc/68/81/10/629688110.db2.gz KDYBNJXCJLQNJM-ZBFHGGJFSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@H]([NH2+]CCc1ccnn1C)c1ccc(C)cc1[O-] ZINC000794818921 629690188 /nfs/dbraw/zinc/69/01/88/629690188.db2.gz ZIFMQTCKGNCBBZ-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+]CC1(CO)CCC1)c1ccc(C)cc1[O-] ZINC000794819464 629690422 /nfs/dbraw/zinc/69/04/22/629690422.db2.gz WNRCDMBYRZYUEM-AWEZNQCLSA-N 0 3 263.381 2.904 20 10 CFCDHN CCCN(Cc1ccnc(C)n1)Cc1ccccc1O ZINC000796444759 629918477 /nfs/dbraw/zinc/91/84/77/629918477.db2.gz IRVDIRGUGRXSFI-UHFFFAOYSA-N 0 3 271.364 2.903 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000796758383 629961299 /nfs/dbraw/zinc/96/12/99/629961299.db2.gz DHLULDRVQCEDCX-WFASDCNBSA-N 0 3 280.387 2.914 20 10 CFCDHN CC1=CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000798090445 630149686 /nfs/dbraw/zinc/14/96/86/630149686.db2.gz LPKDDLCTYVCGOF-UHFFFAOYSA-N 0 3 290.382 2.814 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCCC[C@@H]2OC)c([O-])c1 ZINC000799352195 630303763 /nfs/dbraw/zinc/30/37/63/630303763.db2.gz OHNCUMYBLUTXFB-HOCLYGCPSA-N 0 3 279.380 2.838 20 10 CFCDHN O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2[O-])cc1 ZINC000040675873 649985775 /nfs/dbraw/zinc/98/57/75/649985775.db2.gz CTINUXGZUARXMU-UHFFFAOYSA-N 0 3 272.304 2.633 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCC(=O)NC(C)C)c1[O-] ZINC000808675307 631026565 /nfs/dbraw/zinc/02/65/65/631026565.db2.gz CFESSHNTJZEGKR-NSHDSACASA-N 0 3 298.814 2.919 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808679473 631027473 /nfs/dbraw/zinc/02/74/73/631027473.db2.gz QBJCSITZOCAYSY-NSHDSACASA-N 0 3 298.814 2.921 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)Cn2cncn2)c1[O-] ZINC000808683430 631028255 /nfs/dbraw/zinc/02/82/55/631028255.db2.gz FUDUXCSTHCDUEL-WDEREUQCSA-N 0 3 294.786 2.685 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC2(O)CCC2)c1[O-] ZINC000808694679 631030094 /nfs/dbraw/zinc/03/00/94/631030094.db2.gz GBFKGZVKNLJZQA-JTQLQIEISA-N 0 3 269.772 2.920 20 10 CFCDHN CO[C@@]1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000808712706 631032930 /nfs/dbraw/zinc/03/29/30/631032930.db2.gz AMGHSHOIFPOSLX-IAQYHMDHSA-N 0 3 299.798 2.810 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC(=O)NCC2CC2)c1[O-] ZINC000808714025 631033000 /nfs/dbraw/zinc/03/30/00/631033000.db2.gz RNJURPWTIZQCLW-JTQLQIEISA-N 0 3 296.798 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@]2(O)CCO[C@@H]2C)c1[O-] ZINC000808716225 631034378 /nfs/dbraw/zinc/03/43/78/631034378.db2.gz KCEYDELHMMSDGW-FIXISWKDSA-N 0 3 299.798 2.545 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000808720529 631036484 /nfs/dbraw/zinc/03/64/84/631036484.db2.gz ALLIJQBASXQTAI-UMNHJUIQSA-N 0 3 265.328 2.848 20 10 CFCDHN CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000840768664 631221444 /nfs/dbraw/zinc/22/14/44/631221444.db2.gz XNZNAVVOSRWGTN-MJBXVCDLSA-N 0 3 261.365 2.925 20 10 CFCDHN CC[C@@H](N[C@H](c1nncn1C)C(C)C)c1ccccc1O ZINC000809691714 631264219 /nfs/dbraw/zinc/26/42/19/631264219.db2.gz LUGGHOIMNNYBDA-HIFRSBDPSA-N 0 3 288.395 2.959 20 10 CFCDHN CO[C@@H](CNCc1ccc(N(C)C)cc1C)C(F)(F)F ZINC000840934380 631267613 /nfs/dbraw/zinc/26/76/13/631267613.db2.gz QNXJHHIMGDYYKZ-ZDUSSCGKSA-N 0 3 290.329 2.728 20 10 CFCDHN C[C@@H]1CN(C)CC[C@H]1[N@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763864 631282911 /nfs/dbraw/zinc/28/29/11/631282911.db2.gz AMYYGWSDTOFCPK-BXUZGUMPSA-N 0 3 282.815 2.818 20 10 CFCDHN C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763864 631282915 /nfs/dbraw/zinc/28/29/15/631282915.db2.gz AMYYGWSDTOFCPK-BXUZGUMPSA-N 0 3 282.815 2.818 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c1[O-] ZINC000840980152 631293510 /nfs/dbraw/zinc/29/35/10/631293510.db2.gz WLKMYLOXGLBAGH-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)[C@@H]2C)c1[O-] ZINC000840980152 631293515 /nfs/dbraw/zinc/29/35/15/631293515.db2.gz WLKMYLOXGLBAGH-RYUDHWBXSA-N 0 3 283.799 2.947 20 10 CFCDHN CC(C)(C)[C@@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841086681 631334915 /nfs/dbraw/zinc/33/49/15/631334915.db2.gz CSCVNSXNDNCNFN-GFCCVEGCSA-N 0 3 256.777 2.509 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000841089458 631336853 /nfs/dbraw/zinc/33/68/53/631336853.db2.gz NMFOWOAQWRSKGK-GFCCVEGCSA-N 0 3 280.799 2.810 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2cncn2C)c2c1c(F)ccc2[O-] ZINC000810243561 631348591 /nfs/dbraw/zinc/34/85/91/631348591.db2.gz QFNKDVKQPBBSHF-CABZTGNLSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2cncn2C)c2c1c(F)ccc2[O-] ZINC000810243560 631348747 /nfs/dbraw/zinc/34/87/47/631348747.db2.gz QFNKDVKQPBBSHF-BXKDBHETSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2cn[nH]c2)c2c1c(F)ccc2[O-] ZINC000810248499 631350055 /nfs/dbraw/zinc/35/00/55/631350055.db2.gz WVKBSTWRZBLLMX-BXKDBHETSA-N 0 3 275.327 2.635 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(Cl)cc1[O-] ZINC000841752481 631465376 /nfs/dbraw/zinc/46/53/76/631465376.db2.gz AXUXJEHSOGTPKJ-MWLCHTKSSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(CC(F)F)C1)c1cc(F)ccc1[O-] ZINC000841766054 631469901 /nfs/dbraw/zinc/46/99/01/631469901.db2.gz YKVVARSLLYNTRJ-KOLCDFICSA-N 0 3 288.313 2.521 20 10 CFCDHN Cc1cccc2c1OC[C@H]([NH2+]Cc1cc(F)ccc1[O-])C2 ZINC000811519310 631576891 /nfs/dbraw/zinc/57/68/91/631576891.db2.gz YCHZWPTXDILHCH-OAHLLOKOSA-N 0 3 287.334 2.933 20 10 CFCDHN CN(C)c1ccc(CNCc2c3c(nn2C)CCCC3)cc1 ZINC000812773596 631770699 /nfs/dbraw/zinc/77/06/99/631770699.db2.gz HLJLFGCGVRKQQJ-UHFFFAOYSA-N 0 3 298.434 2.655 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)[C@]2(O)CCOC2)c([O-])c1 ZINC000842918776 631781860 /nfs/dbraw/zinc/78/18/60/631781860.db2.gz IYBAWJWWFWSANP-GUYCJALGSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@@H]([NH2+]CCSCCCO)c1ccccc1[O-] ZINC000155713574 650029735 /nfs/dbraw/zinc/02/97/35/650029735.db2.gz JNWCGYLRXXTDCU-CYBMUJFWSA-N 0 3 269.410 2.549 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]([NH3+])[C@@H](C)C2)c(Cl)c1 ZINC000843051006 631815502 /nfs/dbraw/zinc/81/55/02/631815502.db2.gz DDSQFOYQIOZXOQ-GXFFZTMASA-N 0 3 268.788 2.523 20 10 CFCDHN CC[C@@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@@H]1[NH3+] ZINC000843053136 631817519 /nfs/dbraw/zinc/81/75/19/631817519.db2.gz XQPIYTGNMKBFTE-MFKMUULPSA-N 0 3 268.788 2.605 20 10 CFCDHN [NH3+][C@@H]1CCC[C@@H]2CN(Cc3c([O-])ccc(Cl)c3F)C[C@H]21 ZINC000843059675 631822730 /nfs/dbraw/zinc/82/27/30/631822730.db2.gz PJYININPYKVAPD-GIPNMCIBSA-N 0 3 298.789 2.744 20 10 CFCDHN [NH3+][C@@H]1CCC[C@H]2CN(Cc3c([O-])ccc(Cl)c3F)C[C@H]21 ZINC000843059676 631823097 /nfs/dbraw/zinc/82/30/97/631823097.db2.gz PJYININPYKVAPD-OPQQBVKSSA-N 0 3 298.789 2.744 20 10 CFCDHN COc1cccc(N2CC[NH+](Cc3ccccc3[O-])CC2)c1 ZINC000155979383 650038967 /nfs/dbraw/zinc/03/89/67/650038967.db2.gz FLUWRKFFBMYBTQ-UHFFFAOYSA-N 0 3 298.386 2.723 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[C@]2(CC[NH2+]C2)C1 ZINC000843123201 631843793 /nfs/dbraw/zinc/84/37/93/631843793.db2.gz IWDHCMHKWSEOFY-OAHLLOKOSA-N 0 3 280.799 2.621 20 10 CFCDHN COc1ccc(CNCc2ccnn2CC(C)C)c(O)c1 ZINC000843406929 631946955 /nfs/dbraw/zinc/94/69/55/631946955.db2.gz MVRCCIRZYJVBMD-UHFFFAOYSA-N 0 3 289.379 2.543 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccnn2CC(C)C)c([O-])c1 ZINC000843406929 631946957 /nfs/dbraw/zinc/94/69/57/631946957.db2.gz MVRCCIRZYJVBMD-UHFFFAOYSA-N 0 3 289.379 2.543 20 10 CFCDHN CCC[N@H+](Cc1cccc(OCC)c1[O-])[C@H]1CCN(C)C1 ZINC000843421392 631951209 /nfs/dbraw/zinc/95/12/09/631951209.db2.gz DANFKAZKHKISPV-HNNXBMFYSA-N 0 3 292.423 2.707 20 10 CFCDHN CCC[N@@H+](Cc1cccc(OCC)c1[O-])[C@H]1CCN(C)C1 ZINC000843421392 631951212 /nfs/dbraw/zinc/95/12/12/631951212.db2.gz DANFKAZKHKISPV-HNNXBMFYSA-N 0 3 292.423 2.707 20 10 CFCDHN CCCN(CC(N)=O)Cc1cc(-c2ccccc2)ccc1O ZINC000814177693 632023388 /nfs/dbraw/zinc/02/33/88/632023388.db2.gz MCOVYKOMSSGLOY-UHFFFAOYSA-N 0 3 298.386 2.757 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000044684720 650052633 /nfs/dbraw/zinc/05/26/33/650052633.db2.gz CSZVWBRBOSTHSN-DOMZBBRYSA-N 0 3 260.381 2.670 20 10 CFCDHN CCc1ccc(CN(C)Cc2ccccc2O)nc1 ZINC000815070312 632194964 /nfs/dbraw/zinc/19/49/64/632194964.db2.gz OTABTQFDNAFXFO-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C2CCC(C(N)=O)CC2)c([O-])c1 ZINC000815593803 632294102 /nfs/dbraw/zinc/29/41/02/632294102.db2.gz XSVWAWLACNYEBK-IYXRBSQSSA-N 0 3 290.407 2.704 20 10 CFCDHN [NH3+]C[C@]12CCC[C@H]1CN(Cc1cc(Cl)cc(F)c1[O-])C2 ZINC000844901979 632331430 /nfs/dbraw/zinc/33/14/30/632331430.db2.gz LFBDKEXECBLBKO-NHYWBVRUSA-N 0 3 298.789 2.746 20 10 CFCDHN CC(C)N(C)CC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816544272 632480663 /nfs/dbraw/zinc/48/06/63/632480663.db2.gz CICDDEQQKXUZOA-UHFFFAOYSA-N 0 3 272.392 2.975 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1C[NH2+]CCCN1CCCC1 ZINC000816561474 632484368 /nfs/dbraw/zinc/48/43/68/632484368.db2.gz ZCHAACIISYLFLP-UHFFFAOYSA-N 0 3 286.778 2.760 20 10 CFCDHN C[C@@H](O)[C@@H](NCc1ccccc1O)c1ccccc1F ZINC000846016917 632615038 /nfs/dbraw/zinc/61/50/38/632615038.db2.gz KLVBBSXJEZSZGE-BDJLRTHQSA-N 0 3 275.323 2.743 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](OC(C)C)C1 ZINC000846016980 632615455 /nfs/dbraw/zinc/61/54/55/632615455.db2.gz ZXKDEKTXXBBDMK-CYBMUJFWSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000846016980 632615460 /nfs/dbraw/zinc/61/54/60/632615460.db2.gz ZXKDEKTXXBBDMK-CYBMUJFWSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@](C)(O)c1ccccc1 ZINC000846040335 632620796 /nfs/dbraw/zinc/62/07/96/632620796.db2.gz WGJJDIGJUPQQAU-SJCJKPOMSA-N 0 3 289.350 2.917 20 10 CFCDHN Cc1cccnc1NCc1ccc(N2CCN(C)CC2)cc1 ZINC000817407367 632621900 /nfs/dbraw/zinc/62/19/00/632621900.db2.gz LIEOJSFFDPQGNK-UHFFFAOYSA-N 0 3 296.418 2.754 20 10 CFCDHN CC[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000817414716 632626553 /nfs/dbraw/zinc/62/65/53/632626553.db2.gz ITSXZLDWBOVVAZ-STQMWFEESA-N 0 3 253.317 2.579 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2cccc(OC)c2O)[nH]n1 ZINC000846148116 632646568 /nfs/dbraw/zinc/64/65/68/632646568.db2.gz XCSLFYKTTFNIHN-JTQLQIEISA-N 0 3 275.352 2.537 20 10 CFCDHN C[C@@H](COCC1CC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000846205012 632660126 /nfs/dbraw/zinc/66/01/26/632660126.db2.gz LYJNWLHVPVTMKI-SMDDNHRTSA-N 0 3 261.365 2.784 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@]1(O)CCCOC1)c1ccc(C)cc1[O-] ZINC000846215199 632663192 /nfs/dbraw/zinc/66/31/92/632663192.db2.gz ZCXIPSYZUFCLOH-RDJZCZTQSA-N 0 3 293.407 2.673 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCc2c1ccc(=O)n2C)c1ccccc1[O-] ZINC000846215999 632663595 /nfs/dbraw/zinc/66/35/95/632663595.db2.gz OUHHBHIRVBHIRT-IUODEOHRSA-N 0 3 298.386 2.819 20 10 CFCDHN CCCN1C[C@@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])CC1=O ZINC000817590175 632673144 /nfs/dbraw/zinc/67/31/44/632673144.db2.gz VQZNCGYRNSUEQH-ZIAGYGMSSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@@H](NCc1ccc(N2CCCC2)cc1)c1cnccc1N ZINC000817898332 632721952 /nfs/dbraw/zinc/72/19/52/632721952.db2.gz GHDUKHOOHPOOKS-CQSZACIVSA-N 0 3 296.418 2.945 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCCN2C)c1cnccc1N ZINC000817900330 632724512 /nfs/dbraw/zinc/72/45/12/632724512.db2.gz MHUZKPSGOQLPOT-ZDUSSCGKSA-N 0 3 296.418 2.727 20 10 CFCDHN C[C@@H](NC[C@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817951387 632751821 /nfs/dbraw/zinc/75/18/21/632751821.db2.gz DXXMLFNAURYOHL-TZMCWYRMSA-N 0 3 270.376 2.948 20 10 CFCDHN C[C@@H](NCC[NH2+]C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817952511 632752906 /nfs/dbraw/zinc/75/29/06/632752906.db2.gz FNEOGEWFULETBO-SECBINFHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@H]([NH2+]C[C@H](N)c1ccccc1)c1cc(F)ccc1[O-] ZINC000817955373 632754357 /nfs/dbraw/zinc/75/43/57/632754357.db2.gz WQSIFPZQAIVHBW-NHYWBVRUSA-N 0 3 274.339 2.882 20 10 CFCDHN CC[C@H](NCC[NH2+]C1CC1)c1cccc(Cl)c1[O-] ZINC000817954590 632754998 /nfs/dbraw/zinc/75/49/98/632754998.db2.gz ZLNFYUKYUDIBRD-ZDUSSCGKSA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1[O-] ZINC000817955818 632755465 /nfs/dbraw/zinc/75/54/65/632755465.db2.gz ILBDTLDCFCLFEO-LBPRGKRZSA-N 0 3 256.349 2.868 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@H](C)N)c1cc(Cl)ccc1[O-] ZINC000817977225 632775265 /nfs/dbraw/zinc/77/52/65/632775265.db2.gz FBZHHQNFLNPZEQ-SBMIAAHKSA-N 0 3 256.777 2.822 20 10 CFCDHN C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000817977345 632775458 /nfs/dbraw/zinc/77/54/58/632775458.db2.gz HZYZETBETGBUEB-WOPDTQHZSA-N 0 3 258.365 2.932 20 10 CFCDHN C[C@H](N[C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(Cl)c(Cl)c1[O-] ZINC000817977796 632775502 /nfs/dbraw/zinc/77/55/02/632775502.db2.gz PECGTYPDSXTECL-FNQQPIMXSA-N 0 3 287.190 2.567 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CN)C1CCCC1)c1ccccc1[O-] ZINC000817980983 632777890 /nfs/dbraw/zinc/77/78/90/632777890.db2.gz GCEVZSQFINIXDL-GJZGRUSLSA-N 0 3 262.397 2.950 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1ccc(F)cc1[O-] ZINC000817984890 632781306 /nfs/dbraw/zinc/78/13/06/632781306.db2.gz BNRCHWWYXCUVGT-YPMHNXCESA-N 0 3 278.371 2.857 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000818223125 632816075 /nfs/dbraw/zinc/81/60/75/632816075.db2.gz PZFURSXCOSQKPN-STQMWFEESA-N 0 3 261.365 2.927 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c1[O-] ZINC000857062166 635922102 /nfs/dbraw/zinc/92/21/02/635922102.db2.gz YSWWUUJPOIWXRR-MFKMUULPSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c1[O-] ZINC000857062166 635922108 /nfs/dbraw/zinc/92/21/08/635922108.db2.gz YSWWUUJPOIWXRR-MFKMUULPSA-N 0 3 283.799 2.804 20 10 CFCDHN COc1cc(Br)cc([C@@H](C)NCCF)c1O ZINC000848548235 633286321 /nfs/dbraw/zinc/28/63/21/633286321.db2.gz BJNKLPAWMIRVMS-SSDOTTSWSA-N 0 3 292.148 2.783 20 10 CFCDHN COc1c(C)cccc1C[NH2+]Cc1ccccc1[O-] ZINC000848565215 633290909 /nfs/dbraw/zinc/29/09/09/633290909.db2.gz VDIRTQNMMLLNNN-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCc1cccc(CN2CCN(c3ccccn3)CC2)c1O ZINC000848877829 633357251 /nfs/dbraw/zinc/35/72/51/633357251.db2.gz UAPWDCQQSXYVOL-UHFFFAOYSA-N 0 3 297.402 2.672 20 10 CFCDHN CCc1cccc(CN[C@H](CO)c2cccc(F)c2)c1O ZINC000848896514 633381073 /nfs/dbraw/zinc/38/10/73/633381073.db2.gz BSXWPCXRKHAHCX-MRXNPFEDSA-N 0 3 289.350 2.917 20 10 CFCDHN CCc1cccc(CN2CCO[C@H](C3CC3)C2)c1O ZINC000848904301 633390664 /nfs/dbraw/zinc/39/06/64/633390664.db2.gz PSAIGUPFQPPVPS-HNNXBMFYSA-N 0 3 261.365 2.565 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H]1CCCCO1 ZINC000848927745 633410858 /nfs/dbraw/zinc/41/08/58/633410858.db2.gz MLSXVQHSFPKTCQ-UKRRQHHQSA-N 0 3 267.344 2.969 20 10 CFCDHN Cc1ccc(O)c(CNc2ccc([C@H]3CNCCO3)cc2)c1 ZINC000849353079 633627251 /nfs/dbraw/zinc/62/72/51/633627251.db2.gz YEWWPSIWYADSON-GOSISDBHSA-N 0 3 298.386 2.974 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccc(C)o3)C2)cc1 ZINC000850345434 633947468 /nfs/dbraw/zinc/94/74/68/633947468.db2.gz AAZJTHHUCMZGFQ-CQSZACIVSA-N 0 3 286.375 2.965 20 10 CFCDHN COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C1CCOCC1 ZINC000850493409 634017405 /nfs/dbraw/zinc/01/74/05/634017405.db2.gz HIHRWQWCSQEJFE-XJKSGUPXSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000850497907 634018273 /nfs/dbraw/zinc/01/82/73/634018273.db2.gz ZZODYIJGOLAOBZ-JBLDHEPKSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H]([S@](C)=O)C1)c1cc(F)ccc1[O-] ZINC000850500458 634020389 /nfs/dbraw/zinc/02/03/89/634020389.db2.gz DNBZVHGMYGQNEA-IUNRRVLSSA-N 0 3 299.411 2.872 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000850514936 634026128 /nfs/dbraw/zinc/02/61/28/634026128.db2.gz SHLVUVDDZYWUEQ-DLOVCJGASA-N 0 3 253.317 2.749 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000858212666 636156402 /nfs/dbraw/zinc/15/64/02/636156402.db2.gz ZODIMWDZDRQHTA-HNNXBMFYSA-N 0 3 299.370 2.632 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@]13OCCC[C@H]1C3(F)F)CC2 ZINC000850532674 634038652 /nfs/dbraw/zinc/03/86/52/634038652.db2.gz NGVGBLWXFYYXNG-KYOSRNDESA-N 0 3 295.329 2.783 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](O)C23CCC3)c2c1c(F)ccc2[O-] ZINC000850545409 634046075 /nfs/dbraw/zinc/04/60/75/634046075.db2.gz GVTXNIABALXGLK-MWQHPAIMSA-N 0 3 291.366 2.973 20 10 CFCDHN CN(Cc1ccccc1O)C(=O)C[C@H]1NCc2ccccc21 ZINC000852789643 634837343 /nfs/dbraw/zinc/83/73/43/634837343.db2.gz JUKXCHVFPSGHPQ-MRXNPFEDSA-N 0 3 296.370 2.585 20 10 CFCDHN CCn1nccc1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000853239528 634948494 /nfs/dbraw/zinc/94/84/94/634948494.db2.gz HLIJGERJCUYMGM-SNVBAGLBSA-N 0 3 263.316 2.599 20 10 CFCDHN CC[C@@H](NCC12CC(C1)C[NH2+]2)c1cccc(Cl)c1[O-] ZINC000854226295 635264059 /nfs/dbraw/zinc/26/40/59/635264059.db2.gz HDQQUFVMFMICOP-VROQLPPWSA-N 0 3 280.799 2.838 20 10 CFCDHN CC[C@@H]([NH2+]CC12CC(C1)CN2)c1cccc(Cl)c1[O-] ZINC000854226295 635264065 /nfs/dbraw/zinc/26/40/65/635264065.db2.gz HDQQUFVMFMICOP-VROQLPPWSA-N 0 3 280.799 2.838 20 10 CFCDHN CCC[N@H+](CCOC[C@@H]1CCCO1)Cc1ccccc1[O-] ZINC000112683960 635403686 /nfs/dbraw/zinc/40/36/86/635403686.db2.gz SSLFLFLGJNMONR-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN CCC[N@@H+](CCOC[C@@H]1CCCO1)Cc1ccccc1[O-] ZINC000112683960 635403692 /nfs/dbraw/zinc/40/36/92/635403692.db2.gz SSLFLFLGJNMONR-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CC1(F)F ZINC000856802672 635864616 /nfs/dbraw/zinc/86/46/16/635864616.db2.gz WRBCVJOKJANUJP-SECBINFHSA-N 0 3 257.280 2.536 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@@H]2CCCCO2)cc1F ZINC000858109746 636128396 /nfs/dbraw/zinc/12/83/96/636128396.db2.gz WLXSGLGGKJHCAU-LBPRGKRZSA-N 0 3 284.350 2.690 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@]2(C)CCCO2)cc1F ZINC000858149579 636141070 /nfs/dbraw/zinc/14/10/70/636141070.db2.gz OYNYIUKHAQYVTE-HNNXBMFYSA-N 0 3 284.350 2.690 20 10 CFCDHN CO[C@@](C)(CNCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858166426 636146419 /nfs/dbraw/zinc/14/64/19/636146419.db2.gz NADDCEOHDJDMEY-INIZCTEOSA-N 0 3 298.377 2.936 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858284138 636176120 /nfs/dbraw/zinc/17/61/20/636176120.db2.gz XORNENMAHWTLLW-IDYSPNNHSA-N 0 3 298.377 2.932 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC=C(C(=O)OC)C1)c1ccccc1[O-] ZINC000858473411 636260800 /nfs/dbraw/zinc/26/08/00/636260800.db2.gz NQVGSYGNOGYIES-OCCSQVGLSA-N 0 3 275.348 2.695 20 10 CFCDHN COC(=O)C1=CC[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000858475050 636262463 /nfs/dbraw/zinc/26/24/63/636262463.db2.gz XAWWLKYVDZGOQP-WCQYABFASA-N 0 3 275.348 2.613 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000858486566 636268844 /nfs/dbraw/zinc/26/88/44/636268844.db2.gz VSBGWEAZERTNJE-KBPBESRZSA-N 0 3 263.381 2.766 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000858486569 636269264 /nfs/dbraw/zinc/26/92/64/636269264.db2.gz VSBGWEAZERTNJE-ZIAGYGMSSA-N 0 3 263.381 2.766 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000858506592 636275817 /nfs/dbraw/zinc/27/58/17/636275817.db2.gz VCADZDZMBHXJSO-MFKMUULPSA-N 0 3 293.338 2.834 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2ccc[nH]c2=O)c2c1c(F)ccc2[O-] ZINC000858563143 636293602 /nfs/dbraw/zinc/29/36/02/636293602.db2.gz QELJSLWDGAEVON-BXKDBHETSA-N 0 3 288.322 2.970 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)c1ccccc1[O-] ZINC000858603235 636305831 /nfs/dbraw/zinc/30/58/31/636305831.db2.gz VDDRSCWHDCUTNM-CABCVRRESA-N 0 3 288.391 2.586 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2CCO)c1 ZINC000188009462 650311744 /nfs/dbraw/zinc/31/17/44/650311744.db2.gz LEZUUIMRMWXCLX-GZBFAFLISA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@H](C)N(CCO)Cc1cc(F)c(N(C)C)cc1F ZINC000862386769 637349274 /nfs/dbraw/zinc/34/92/74/637349274.db2.gz CAIMHHMSPVFUNX-LLVKDONJSA-N 0 3 286.366 2.624 20 10 CFCDHN CC[C@H](C)[N@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000862386998 637349454 /nfs/dbraw/zinc/34/94/54/637349454.db2.gz GHRKWIRCBNIAPW-NSHDSACASA-N 0 3 271.788 2.947 20 10 CFCDHN CC[C@H](C)[N@@H+](CCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000862386998 637349459 /nfs/dbraw/zinc/34/94/59/637349459.db2.gz GHRKWIRCBNIAPW-NSHDSACASA-N 0 3 271.788 2.947 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1[O-] ZINC000862443777 637383156 /nfs/dbraw/zinc/38/31/56/637383156.db2.gz UANYPWBWFZIKSJ-DTORHVGOSA-N 0 3 253.729 2.506 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1[O-] ZINC000862443777 637383161 /nfs/dbraw/zinc/38/31/61/637383161.db2.gz UANYPWBWFZIKSJ-DTORHVGOSA-N 0 3 253.729 2.506 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](C)[S@](C)=O)c1ccccc1[O-] ZINC000119212270 637533131 /nfs/dbraw/zinc/53/31/31/637533131.db2.gz MPOGSPFBJRPGKS-SUFBMKPHSA-N 0 3 269.410 2.590 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N)CCOCC1)c1cc(Cl)ccc1[O-] ZINC000863541351 637689048 /nfs/dbraw/zinc/68/90/48/637689048.db2.gz LEWWULCTRNKVMA-CYBMUJFWSA-N 0 3 298.814 2.594 20 10 CFCDHN CC[C@]1(C)CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000190333751 650427314 /nfs/dbraw/zinc/42/73/14/650427314.db2.gz BYSKXDDHYFEZGY-QGZVFWFLSA-N 0 3 275.392 2.882 20 10 CFCDHN C[C@@H]([NH2+]CC1CCC2(CC1)OCCO2)c1ccccc1[O-] ZINC000190321528 650427446 /nfs/dbraw/zinc/42/74/46/650427446.db2.gz SGTUSEBGHTVSMM-CYBMUJFWSA-N 0 3 291.391 2.976 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CCCS1 ZINC000865725348 638537785 /nfs/dbraw/zinc/53/77/85/638537785.db2.gz XRHRROLGZZWYHZ-LLVKDONJSA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])c1ccnn1C ZINC000866612611 638854442 /nfs/dbraw/zinc/85/44/42/638854442.db2.gz ACKVCSJFEHFEHJ-NXEZZACHSA-N 0 3 263.316 2.677 20 10 CFCDHN COc1cccc([C@@H](C)N[C@H](C)c2ccnn2C)c1O ZINC000866615919 638855321 /nfs/dbraw/zinc/85/53/21/638855321.db2.gz XUHRBAJGDOOXAX-GHMZBOCLSA-N 0 3 275.352 2.546 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCn2nccc21)c1cc(F)ccc1[O-] ZINC000866634312 638858447 /nfs/dbraw/zinc/85/84/47/638858447.db2.gz QDQYBZYUAORVFD-GXFFZTMASA-N 0 3 275.327 2.914 20 10 CFCDHN CCCCN1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000122046825 638929799 /nfs/dbraw/zinc/92/97/99/638929799.db2.gz YEDDKTRVDBDCCN-UHFFFAOYSA-N 0 3 266.360 2.756 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000191609004 650513111 /nfs/dbraw/zinc/51/31/11/650513111.db2.gz CFAXKCSCLYLISR-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCOC2=O)c([O-])c1 ZINC000872112594 641643869 /nfs/dbraw/zinc/64/38/69/641643869.db2.gz KLVWSUXEENQQDF-QWHCGFSZSA-N 0 3 277.364 2.695 20 10 CFCDHN Cc1cc(O)c(CN[C@@H](C)c2nccnc2C)cc1C ZINC000873187420 642055737 /nfs/dbraw/zinc/05/57/37/642055737.db2.gz RNUYITQJEKUINU-ZDUSSCGKSA-N 0 3 271.364 2.958 20 10 CFCDHN Cc1ccc(CN2CCc3ccc(O)cc3C2)c(O)c1 ZINC000876616196 642945717 /nfs/dbraw/zinc/94/57/17/642945717.db2.gz JDYJKCHLWVZOOV-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c([O-])c1 ZINC000876621132 642949224 /nfs/dbraw/zinc/94/92/24/642949224.db2.gz WBRUAIJLUYVUKQ-CQSZACIVSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c([O-])c1 ZINC000876621132 642949227 /nfs/dbraw/zinc/94/92/27/642949227.db2.gz WBRUAIJLUYVUKQ-CQSZACIVSA-N 0 3 271.364 2.803 20 10 CFCDHN CCCN(Cc1ccccc1O)C(=O)[C@@H](N)CCC(C)C ZINC000876632680 642951594 /nfs/dbraw/zinc/95/15/94/642951594.db2.gz MJJDMYXWLVOWSM-HNNXBMFYSA-N 0 3 292.423 2.894 20 10 CFCDHN CO[C@@H](C)C[N@H+](Cc1ccc(C)cc1[O-])C(C)C ZINC000876758860 642998461 /nfs/dbraw/zinc/99/84/61/642998461.db2.gz LDTCQEZRWWQGQY-ZDUSSCGKSA-N 0 3 251.370 2.946 20 10 CFCDHN CO[C@@H](C)C[N@@H+](Cc1ccc(C)cc1[O-])C(C)C ZINC000876758860 642998463 /nfs/dbraw/zinc/99/84/63/642998463.db2.gz LDTCQEZRWWQGQY-ZDUSSCGKSA-N 0 3 251.370 2.946 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([O-])c1 ZINC000876771265 643004376 /nfs/dbraw/zinc/00/43/76/643004376.db2.gz PJLSSRRKCYWQEP-CQSZACIVSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([O-])c1 ZINC000876771265 643004377 /nfs/dbraw/zinc/00/43/77/643004377.db2.gz PJLSSRRKCYWQEP-CQSZACIVSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000876804902 643017031 /nfs/dbraw/zinc/01/70/31/643017031.db2.gz VURINJSVIFUBAM-DZGCQCFKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000876804902 643017040 /nfs/dbraw/zinc/01/70/40/643017040.db2.gz VURINJSVIFUBAM-DZGCQCFKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](OCC(C)C)C2)c([O-])c1 ZINC000876809899 643018523 /nfs/dbraw/zinc/01/85/23/643018523.db2.gz ZPQCQVCWNPOYEJ-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](OCC(C)C)C2)c([O-])c1 ZINC000876809899 643018535 /nfs/dbraw/zinc/01/85/35/643018535.db2.gz ZPQCQVCWNPOYEJ-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCCc3[nH]c(=O)ccc32)c([O-])c1 ZINC000876909518 643061157 /nfs/dbraw/zinc/06/11/57/643061157.db2.gz AHSSIQJRWSZZJL-AWEZNQCLSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1ccc(C[NH2+]CCOCCC(C)C)c([O-])c1 ZINC000876987313 643093479 /nfs/dbraw/zinc/09/34/79/643093479.db2.gz XAOXFGGDRWKXCQ-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)c1ccccc1 ZINC000877039643 643115680 /nfs/dbraw/zinc/11/56/80/643115680.db2.gz HYEPXFVNTKCRKH-QGZVFWFLSA-N 0 3 271.360 2.698 20 10 CFCDHN Cc1ccc(CC[NH2+]Cc2c(C)cccc2[O-])cn1 ZINC000877039913 643116315 /nfs/dbraw/zinc/11/63/15/643116315.db2.gz REABZLFTCXRDCA-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN COc1ccccc1[C@H](CO)NCc1ccc(C)cc1O ZINC000877040724 643116798 /nfs/dbraw/zinc/11/67/98/643116798.db2.gz FHCCJAKAKBINED-HNNXBMFYSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)C[C@H](C)O ZINC000877055093 643123943 /nfs/dbraw/zinc/12/39/43/643123943.db2.gz OQVYGWQAVBOZNR-LBPRGKRZSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2c(F)cccc2F)c([O-])c1 ZINC000877055180 643124012 /nfs/dbraw/zinc/12/40/12/643124012.db2.gz QNGSJCOVPQOAEZ-HNNXBMFYSA-N 0 3 293.313 2.802 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](CCO)c2ccccc2)c([O-])c1 ZINC000877055125 643124136 /nfs/dbraw/zinc/12/41/36/643124136.db2.gz NIFYHHRBYJZWBA-INIZCTEOSA-N 0 3 285.387 2.956 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOc1ccc(Cl)cn1 ZINC000877084810 643143939 /nfs/dbraw/zinc/14/39/39/643143939.db2.gz JNDZJZHKGURPOH-UHFFFAOYSA-N 0 3 292.766 2.918 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@]2(CCSC2)C1 ZINC000877095754 643150597 /nfs/dbraw/zinc/15/05/97/643150597.db2.gz SYBPQLGZWWXRKW-XJKSGUPXSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)c([O-])c1 ZINC000877094573 643150862 /nfs/dbraw/zinc/15/08/62/643150862.db2.gz KIMNUKGZUAQTGY-GDBMZVCRSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877112956 643157743 /nfs/dbraw/zinc/15/77/43/643157743.db2.gz WDIPEBJIFLQQEG-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1ncc(CC[NH2+]Cc2ccc(C)cc2[O-])s1 ZINC000877115902 643158874 /nfs/dbraw/zinc/15/88/74/643158874.db2.gz VYZUDORQFGSHSU-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)c2ccc(F)cc2)c([O-])c1 ZINC000877127471 643166057 /nfs/dbraw/zinc/16/60/57/643166057.db2.gz HQHAERUZYDBCCJ-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1([C@H](C)CCO)CCC1 ZINC000877138117 643172942 /nfs/dbraw/zinc/17/29/42/643172942.db2.gz PAWUPQYVYNPDPR-CQSZACIVSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(CCCO)CC2)c([O-])c1 ZINC000877194788 643197927 /nfs/dbraw/zinc/19/79/27/643197927.db2.gz WJDVRWHNWLHKHB-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[NH+]2CCC([C@H]3CCOC3)CC2)c([O-])c1 ZINC000877306781 643228718 /nfs/dbraw/zinc/22/87/18/643228718.db2.gz DHRSQACWSXCEMN-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN COC(=O)C1(C[NH2+]Cc2ccc(C)cc2[O-])CCCC1 ZINC000877311664 643232710 /nfs/dbraw/zinc/23/27/10/643232710.db2.gz MEIQMPJMKJMRJR-UHFFFAOYSA-N 0 3 277.364 2.524 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2c(C)cccc2[O-])[C@]12CCCO2 ZINC000877346756 643245201 /nfs/dbraw/zinc/24/52/01/643245201.db2.gz MWSOEBUZDGDJLZ-BRWVUGGUSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCOCC2(CCC2)C1 ZINC000877351091 643247020 /nfs/dbraw/zinc/24/70/20/643247020.db2.gz YPBJEUFLUSEJOL-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCOCC2(CCC2)C1 ZINC000877351091 643247027 /nfs/dbraw/zinc/24/70/27/643247027.db2.gz YPBJEUFLUSEJOL-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@H](C3CC3)C2)c([O-])c1 ZINC000877374551 643249732 /nfs/dbraw/zinc/24/97/32/643249732.db2.gz CXOKXTNURXAIHW-HOCLYGCPSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(CN[C@@H](CO)c2ccsc2)c(O)c1 ZINC000877399101 643259985 /nfs/dbraw/zinc/25/99/85/643259985.db2.gz JFYVAKRGCAISEK-ZDUSSCGKSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000877486610 643301260 /nfs/dbraw/zinc/30/12/60/643301260.db2.gz OLCBYYJJADTKNA-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000877486610 643301264 /nfs/dbraw/zinc/30/12/64/643301264.db2.gz OLCBYYJJADTKNA-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c([O-])c1 ZINC000877508299 643318020 /nfs/dbraw/zinc/31/80/20/643318020.db2.gz WKSWIZYONPURGP-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c([O-])c1 ZINC000877508299 643318027 /nfs/dbraw/zinc/31/80/27/643318027.db2.gz WKSWIZYONPURGP-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2COc3ccccc32)c([O-])c1 ZINC000877537996 643340842 /nfs/dbraw/zinc/34/08/42/643340842.db2.gz RZYWDHMTICSEEV-AWEZNQCLSA-N 0 3 269.344 2.966 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c([O-])c1 ZINC000877543964 643346577 /nfs/dbraw/zinc/34/65/77/643346577.db2.gz NYSMEATWKSRVFT-INIZCTEOSA-N 0 3 277.408 2.977 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1c(C)cccc1[O-])OC ZINC000877558301 643357948 /nfs/dbraw/zinc/35/79/48/643357948.db2.gz CJFDGLISJNIZKW-IAQYHMDHSA-N 0 3 251.370 2.851 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2c(C)cccc2[O-])CC1 ZINC000877575918 643374294 /nfs/dbraw/zinc/37/42/94/643374294.db2.gz FSXAGDKDCZDADP-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])CC1 ZINC000877575918 643374297 /nfs/dbraw/zinc/37/42/97/643374297.db2.gz FSXAGDKDCZDADP-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])CC(C)C ZINC000877591962 643384693 /nfs/dbraw/zinc/38/46/93/643384693.db2.gz CGRPSEZZCFCLIE-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(O)CCC(F)(F)CC2)c([O-])c1 ZINC000877637222 643421622 /nfs/dbraw/zinc/42/16/22/643421622.db2.gz QSEZCGKAMACWHU-UHFFFAOYSA-N 0 3 285.334 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(CC(N)=O)CCCCC1 ZINC000877639096 643424136 /nfs/dbraw/zinc/42/41/36/643424136.db2.gz BTRQTXKBPCACOO-UHFFFAOYSA-N 0 3 290.407 2.616 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)[C@@H](C)c1ccccc1 ZINC000877640545 643425387 /nfs/dbraw/zinc/42/53/87/643425387.db2.gz OVEOBZVHZINAFN-KBXCAEBGSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)[C@H](C)c1ccccc1 ZINC000877640548 643425627 /nfs/dbraw/zinc/42/56/27/643425627.db2.gz OVEOBZVHZINAFN-RDTXWAMCSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1c2ccccc2C(=O)N1C ZINC000877656237 643436360 /nfs/dbraw/zinc/43/63/60/643436360.db2.gz BGNDECSCIWKSOP-INIZCTEOSA-N 0 3 296.370 2.617 20 10 CFCDHN CC1(C)CC[C@@H](O)[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000877683701 643452283 /nfs/dbraw/zinc/45/22/83/643452283.db2.gz HSQKYCKEKCDUCY-TZMCWYRMSA-N 0 3 267.344 2.561 20 10 CFCDHN CCOC(=O)C1CCC([NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000877717056 643480952 /nfs/dbraw/zinc/48/09/52/643480952.db2.gz DKTYKNCAOIKMOB-UHFFFAOYSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCC23CCOCC3)c([O-])c1 ZINC000877729113 643489989 /nfs/dbraw/zinc/48/99/89/643489989.db2.gz XQFAMIMMLQRXAP-OAHLLOKOSA-N 0 3 275.392 2.997 20 10 CFCDHN CN1Cc2ccccc2[C@H]1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000877733655 643493098 /nfs/dbraw/zinc/49/30/98/643493098.db2.gz VTNPLBZQSPKEOU-MRXNPFEDSA-N 0 3 286.350 2.808 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2[O-])[C@]12CCCO2 ZINC000877755913 643535171 /nfs/dbraw/zinc/53/51/71/643535171.db2.gz SHWAVSXJTPZENF-BASLNEPJSA-N 0 3 291.391 2.769 20 10 CFCDHN C[C@@H](NCc1cc(C(F)(F)F)n[nH]1)c1ccccc1O ZINC000877755886 643536090 /nfs/dbraw/zinc/53/60/90/643536090.db2.gz QWIPFBQUSHOWRK-MRVPVSSYSA-N 0 3 285.269 2.985 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(C(F)(F)F)n[nH]1)c1ccccc1[O-] ZINC000877755886 643536095 /nfs/dbraw/zinc/53/60/95/643536095.db2.gz QWIPFBQUSHOWRK-MRVPVSSYSA-N 0 3 285.269 2.985 20 10 CFCDHN COC(=O)c1ccc(CN[C@@H](C)c2ccccc2O)o1 ZINC000877757211 643537160 /nfs/dbraw/zinc/53/71/60/643537160.db2.gz OHMKVMRMJVZFON-JTQLQIEISA-N 0 3 275.304 2.623 20 10 CFCDHN CCOC(=O)c1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])[nH]1 ZINC000877758179 643538588 /nfs/dbraw/zinc/53/85/88/643538588.db2.gz LUFKHYNVGZUVHE-NSHDSACASA-N 0 3 288.347 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000877807583 643570404 /nfs/dbraw/zinc/57/04/04/643570404.db2.gz XIILRKSNFGVBTB-WWGRRREGSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000877807579 643570455 /nfs/dbraw/zinc/57/04/55/643570455.db2.gz XIILRKSNFGVBTB-DVOMOZLQSA-N 0 3 261.365 2.748 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H]1COC(C)(C)O1)c1ccccc1[O-] ZINC000879649327 644363527 /nfs/dbraw/zinc/36/35/27/644363527.db2.gz NLBZVBFLRHQHIN-VXGBXAGGSA-N 0 3 265.353 2.584 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1[C@H](C)CCC[C@@H]1C)c1ccccc1[O-] ZINC000879652227 644365817 /nfs/dbraw/zinc/36/58/17/644365817.db2.gz BIHOXIXJKFIEED-MJBXVCDLSA-N 0 3 290.407 2.832 20 10 CFCDHN CCCCCCNC(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879653885 644366073 /nfs/dbraw/zinc/36/60/73/644366073.db2.gz XCKOPQVWQFPNKF-ZDUSSCGKSA-N 0 3 278.396 2.739 20 10 CFCDHN C[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644257 650943820 /nfs/dbraw/zinc/94/38/20/650943820.db2.gz BTZDCOSOFDEULL-BXUZGUMPSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644257 650943822 /nfs/dbraw/zinc/94/38/22/650943822.db2.gz BTZDCOSOFDEULL-BXUZGUMPSA-N 0 3 282.815 2.960 20 10 CFCDHN Cc1cc(CN2CC=C[C@H]2CO)ccc1N1CCCCC1 ZINC000880493021 644735439 /nfs/dbraw/zinc/73/54/39/644735439.db2.gz XUJIIWSUJJZEJG-KRWDZBQOSA-N 0 3 286.419 2.718 20 10 CFCDHN COc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])ccn1 ZINC000094618155 650960016 /nfs/dbraw/zinc/96/00/16/650960016.db2.gz FAOZUHDJMTVBDW-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN COc1cc(C[NH2+][C@H](C)c2cc(F)ccc2[O-])ccn1 ZINC000094618156 650960193 /nfs/dbraw/zinc/96/01/93/650960193.db2.gz FAOZUHDJMTVBDW-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1cc(F)ccc1[O-] ZINC000094617964 650960371 /nfs/dbraw/zinc/96/03/71/650960371.db2.gz OHEQNRNEEQWOQC-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC[C@H]2CCO)c1 ZINC000249979563 650970030 /nfs/dbraw/zinc/97/00/30/650970030.db2.gz LEZUUIMRMWXCLX-KCQAQPDRSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC[C@H]2CCO)c1 ZINC000249979567 650970136 /nfs/dbraw/zinc/97/01/36/650970136.db2.gz LEZUUIMRMWXCLX-YDHLFZDLSA-N 0 3 263.381 2.902 20 10 CFCDHN [O-]c1c(F)cc(F)cc1C[NH2+]C1CCN(CC2CC2)CC1 ZINC000882903667 645503870 /nfs/dbraw/zinc/50/38/70/645503870.db2.gz HLNJSESHEXMIFJ-UHFFFAOYSA-N 0 3 296.361 2.634 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1c([O-])cccc1F ZINC000886501678 647020781 /nfs/dbraw/zinc/02/07/81/647020781.db2.gz TYDRPUWTIPCFMN-RYUDHWBXSA-N 0 3 278.371 2.666 20 10 CFCDHN CC(C)[C@H](NCc1ccc2c(c1)CCO2)c1cnn(C)c1 ZINC000886520491 647027025 /nfs/dbraw/zinc/02/70/25/647027025.db2.gz GEBLVHXVKPZGNG-KRWDZBQOSA-N 0 3 285.391 2.842 20 10 CFCDHN CC(C)N(C)C[C@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886612671 647067313 /nfs/dbraw/zinc/06/73/13/647067313.db2.gz QZLVEFBXJSFEKM-RYUDHWBXSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@H+](C)C[C@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886612671 647067316 /nfs/dbraw/zinc/06/73/16/647067316.db2.gz QZLVEFBXJSFEKM-RYUDHWBXSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@@H+](C)C[C@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886612671 647067322 /nfs/dbraw/zinc/06/73/22/647067322.db2.gz QZLVEFBXJSFEKM-RYUDHWBXSA-N 0 3 268.376 2.911 20 10 CFCDHN C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1c([O-])cccc1F ZINC000886620519 647071620 /nfs/dbraw/zinc/07/16/20/647071620.db2.gz MBOMXVSDBXALHT-WODVXLOZSA-N 0 3 278.371 2.807 20 10 CFCDHN C[C@@H](NCc1ccc(N2CCCC2)cc1)c1ccnnc1 ZINC000924647512 648018338 /nfs/dbraw/zinc/01/83/38/648018338.db2.gz HJEFUFNSBIBKBD-CQSZACIVSA-N 0 3 282.391 2.928 20 10 CFCDHN Nc1ccc2c(c1)C[N@H+]([C@@H]1CCc3cccc([O-])c31)CCO2 ZINC000925753861 648309312 /nfs/dbraw/zinc/30/93/12/648309312.db2.gz KCZNDWBMMRYRMB-OAHLLOKOSA-N 0 3 296.370 2.856 20 10 CFCDHN Nc1ccc2c(c1)C[N@@H+]([C@@H]1CCc3cccc([O-])c31)CCO2 ZINC000925753861 648309315 /nfs/dbraw/zinc/30/93/15/648309315.db2.gz KCZNDWBMMRYRMB-OAHLLOKOSA-N 0 3 296.370 2.856 20 10 CFCDHN CC[C@H](N[C@@H]1C[NH2+]C[C@H]1C)c1cc(Cl)ccc1[O-] ZINC000925785751 648323148 /nfs/dbraw/zinc/32/31/48/648323148.db2.gz QOKDHJJDCPVMNR-JIMOISOXSA-N 0 3 268.788 2.694 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cc(C)n(C)n1)c1ccccc1[O-] ZINC000926912361 648654756 /nfs/dbraw/zinc/65/47/56/648654756.db2.gz WCYFRUPVNCXVLR-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCO[C@@H]2CCOC2)c1[O-] ZINC000927081039 648701212 /nfs/dbraw/zinc/70/12/12/648701212.db2.gz MVLQARPCEBMAKN-WCQYABFASA-N 0 3 299.798 2.810 20 10 CFCDHN CC[C@@H]([NH2+]CCO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000927081669 648702210 /nfs/dbraw/zinc/70/22/10/648702210.db2.gz RAILVNBFCSNATR-DZGCQCFKSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@H]([NH2+]CCO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000927081671 648702634 /nfs/dbraw/zinc/70/26/34/648702634.db2.gz RAILVNBFCSNATR-HIFRSBDPSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1cccc([C@@H](O)C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000929975684 649158106 /nfs/dbraw/zinc/15/81/06/649158106.db2.gz IEZLSZBTYCOXGO-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc([C@@H](O)C[N@H+](C)Cc2ccccc2[O-])c1 ZINC000929975684 649158107 /nfs/dbraw/zinc/15/81/07/649158107.db2.gz IEZLSZBTYCOXGO-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN CC[C@@](O)(CN(C)Cc1ccccc1O)C(F)(F)F ZINC000929977514 649159216 /nfs/dbraw/zinc/15/92/16/649159216.db2.gz VQEPJDAGRMOPQJ-GFCCVEGCSA-N 0 3 277.286 2.527 20 10 CFCDHN Cc1nnsc1[C@@H](C)N[C@@H](C)c1ccccc1O ZINC000931555389 649453800 /nfs/dbraw/zinc/45/38/00/649453800.db2.gz YNMJWBNNBMPGKI-DTWKUNHWSA-N 0 3 263.366 2.964 20 10 CFCDHN CN(CC[N@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000272650925 651228187 /nfs/dbraw/zinc/22/81/87/651228187.db2.gz MZBGAVPGVCGGTM-UHFFFAOYSA-N 0 3 294.395 2.691 20 10 CFCDHN CN(CC[N@@H+](C)Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000272650925 651228188 /nfs/dbraw/zinc/22/81/88/651228188.db2.gz MZBGAVPGVCGGTM-UHFFFAOYSA-N 0 3 294.395 2.691 20 10 CFCDHN Oc1cccc2c1CN(Cc1n[nH]c3cc(F)ccc31)CC2 ZINC001233126726 777804127 /nfs/dbraw/zinc/80/41/27/777804127.db2.gz NXVGDCWABDGBJF-UHFFFAOYSA-N 0 3 297.333 2.966 20 10 CFCDHN CC1(C)OCC[C@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000693070702 770215819 /nfs/dbraw/zinc/21/58/19/770215819.db2.gz IIEOUQWRCVMBGG-STQMWFEESA-N 0 3 261.365 2.784 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@H]2COCC[C@@H]2C1 ZINC000723661168 770643838 /nfs/dbraw/zinc/64/38/38/770643838.db2.gz RAHKURLKUZVHTI-VHDGCEQUSA-N 0 3 261.365 2.687 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H]3COC[C@H]3C2)c1[O-] ZINC000690800628 775674927 /nfs/dbraw/zinc/67/49/27/775674927.db2.gz ZWCJUEHJZBJMEY-CMPLNLGQSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c1[O-] ZINC000690800628 775674931 /nfs/dbraw/zinc/67/49/31/775674931.db2.gz ZWCJUEHJZBJMEY-CMPLNLGQSA-N 0 3 297.782 2.523 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CCC[C@@]12CCC[NH2+]C2 ZINC001222243145 776042573 /nfs/dbraw/zinc/04/25/73/776042573.db2.gz IWIQYSAJNZNRRR-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000722401025 776617149 /nfs/dbraw/zinc/61/71/49/776617149.db2.gz MLSBKOIFHLTPDA-JQWIXIFHSA-N 0 3 293.260 2.731 20 10 CFCDHN C[C@H]([NH2+]CC1SCCS1)c1cc(F)ccc1[O-] ZINC000692910338 776650159 /nfs/dbraw/zinc/65/01/59/776650159.db2.gz PKHKKEUDKJDAGQ-QMMMGPOBSA-N 0 3 273.398 2.988 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589355 777268223 /nfs/dbraw/zinc/26/82/23/777268223.db2.gz HABUPTJRQYAZPZ-OAHLLOKOSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589355 777268229 /nfs/dbraw/zinc/26/82/29/777268229.db2.gz HABUPTJRQYAZPZ-OAHLLOKOSA-N 0 3 298.386 2.598 20 10 CFCDHN COc1cc(CN2CC(c3ccccc3)C2)c(O)cc1O ZINC001231637160 777286458 /nfs/dbraw/zinc/28/64/58/777286458.db2.gz GSHZWTJODJFNCY-UHFFFAOYSA-N 0 3 285.343 2.706 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1Cl ZINC001231871083 777359378 /nfs/dbraw/zinc/35/93/78/777359378.db2.gz XZJLPHMIEIASSC-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]3C[N@H+](C)C[C@@H]32)cc1Cl ZINC001231871083 777359386 /nfs/dbraw/zinc/35/93/86/777359386.db2.gz XZJLPHMIEIASSC-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3C[C@@]3(C[NH+](C)C)C2)cc1Cl ZINC001231870090 777359823 /nfs/dbraw/zinc/35/98/23/777359823.db2.gz IZQQWSRFZIUNIJ-CZUORRHYSA-N 0 3 294.826 2.738 20 10 CFCDHN Oc1cccc2c1CN(Cc1cc3ncccc3[nH]1)CC2 ZINC001232066343 777428981 /nfs/dbraw/zinc/42/89/81/777428981.db2.gz VBNMRLLEAYJPBF-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN CC[N@@H+]1CCCN(Cc2cc(Cl)c(OC)cc2[O-])CC1 ZINC001232266389 777499849 /nfs/dbraw/zinc/49/98/49/777499849.db2.gz NDOJYXATAIEKMH-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN CC[N@H+]1CCCN(Cc2cc(Cl)c(OC)cc2[O-])CC1 ZINC001232266389 777499855 /nfs/dbraw/zinc/49/98/55/777499855.db2.gz NDOJYXATAIEKMH-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN C[C@@H]1CCN(Cc2ccc(N(C)C)cc2O)C[C@H]1F ZINC001232834845 777686659 /nfs/dbraw/zinc/68/66/59/777686659.db2.gz OAEJVLDSJNEPPS-BXUZGUMPSA-N 0 3 266.360 2.638 20 10 CFCDHN Oc1cc(CN2CCC[C@H]3CCC[C@@H]32)cc(O)c1O ZINC001233017022 777765321 /nfs/dbraw/zinc/76/53/21/777765321.db2.gz QOHPKNJPDPUZLP-NEPJUHHUSA-N 0 3 263.337 2.568 20 10 CFCDHN CC(C)(C)c1ccc(O)c(CN2CC3(CC(O)C3)C2)c1 ZINC001233284369 777865760 /nfs/dbraw/zinc/86/57/60/777865760.db2.gz RSQXQEBZJCVGKZ-UHFFFAOYSA-N 0 3 275.392 2.646 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCC[C@](C)(O)C2)c1[O-] ZINC001233287905 777868880 /nfs/dbraw/zinc/86/88/80/777868880.db2.gz MSIOIYHXCGEPEO-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCC[C@](C)(O)C2)c1[O-] ZINC001233287905 777868891 /nfs/dbraw/zinc/86/88/91/777868891.db2.gz MSIOIYHXCGEPEO-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c1[O-] ZINC001233287724 777868974 /nfs/dbraw/zinc/86/89/74/777868974.db2.gz FFNITLRPOAMJEC-MEBBXXQBSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@](C)(O)C2)c1[O-] ZINC001233287724 777868985 /nfs/dbraw/zinc/86/89/85/777868985.db2.gz FFNITLRPOAMJEC-MEBBXXQBSA-N 0 3 299.798 2.647 20 10 CFCDHN Oc1cc(O)c(CN2CC3(C2)CCCCC3)cc1O ZINC001233486655 777963712 /nfs/dbraw/zinc/96/37/12/777963712.db2.gz WVWATOUZWQNUPH-UHFFFAOYSA-N 0 3 263.337 2.570 20 10 CFCDHN COC(=O)C1C[NH+](Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001234997617 778348115 /nfs/dbraw/zinc/34/81/15/778348115.db2.gz CSOAZAPPHRCJKK-UHFFFAOYSA-N 0 3 297.354 2.664 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[C@@]3([NH3+])C2)cc1Cl ZINC001235244451 778428854 /nfs/dbraw/zinc/42/88/54/778428854.db2.gz BZVDEFGOQMOARP-IUODEOHRSA-N 0 3 280.799 2.667 20 10 CFCDHN CCc1cccc(CN(C)Cc2ccccc2O)n1 ZINC001235263540 778438062 /nfs/dbraw/zinc/43/80/62/778438062.db2.gz IXWORBQKADAQEY-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001235682875 778535126 /nfs/dbraw/zinc/53/51/26/778535126.db2.gz QXUDWZGRFYDERW-OKILXGFUSA-N 0 3 275.392 2.768 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001235682875 778535129 /nfs/dbraw/zinc/53/51/29/778535129.db2.gz QXUDWZGRFYDERW-OKILXGFUSA-N 0 3 275.392 2.768 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@]2(C)CCC[NH2+]C2)cc1Cl ZINC001236207040 778735770 /nfs/dbraw/zinc/73/57/70/778735770.db2.gz NGZPBJOOYOENRL-OAHLLOKOSA-N 0 3 298.814 2.628 20 10 CFCDHN CCO[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000226561133 778840135 /nfs/dbraw/zinc/84/01/35/778840135.db2.gz MWRNSIRIUGFUTP-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CCO[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000226561133 778840142 /nfs/dbraw/zinc/84/01/42/778840142.db2.gz MWRNSIRIUGFUTP-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CCC[N@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236773705 778931785 /nfs/dbraw/zinc/93/17/85/778931785.db2.gz SHBSKPGVUOXVAY-UHFFFAOYSA-N 0 3 274.158 2.702 20 10 CFCDHN CCC[N@@H+](C)Cc1cc(O)c(Br)cc1[O-] ZINC001236773705 778931787 /nfs/dbraw/zinc/93/17/87/778931787.db2.gz SHBSKPGVUOXVAY-UHFFFAOYSA-N 0 3 274.158 2.702 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236782843 778933402 /nfs/dbraw/zinc/93/34/02/778933402.db2.gz FNTXOKQPAOSTND-GUYCJALGSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236782843 778933406 /nfs/dbraw/zinc/93/34/06/778933406.db2.gz FNTXOKQPAOSTND-GUYCJALGSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236782845 778934172 /nfs/dbraw/zinc/93/41/72/778934172.db2.gz FNTXOKQPAOSTND-SUMWQHHRSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236782845 778934175 /nfs/dbraw/zinc/93/41/75/778934175.db2.gz FNTXOKQPAOSTND-SUMWQHHRSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[NH+]2CC3(C2)CCOCC3)c([O-])c1 ZINC001236785805 778934808 /nfs/dbraw/zinc/93/48/08/778934808.db2.gz AFMVSYFGVIHAIL-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](O)CC2)c([O-])c1 ZINC001236784674 778935451 /nfs/dbraw/zinc/93/54/51/778935451.db2.gz YCWNXUWBPULXLA-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](C)[C@@H](O)CC2)c([O-])c1 ZINC001236784674 778935458 /nfs/dbraw/zinc/93/54/58/778935458.db2.gz YCWNXUWBPULXLA-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236786943 778936745 /nfs/dbraw/zinc/93/67/45/778936745.db2.gz SLLUFHXFEDYFBV-WMLDXEAASA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236786943 778936749 /nfs/dbraw/zinc/93/67/49/778936749.db2.gz SLLUFHXFEDYFBV-WMLDXEAASA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(C[C@@H]3CCO)CC2)c([O-])c1 ZINC001236787384 778937446 /nfs/dbraw/zinc/93/74/46/778937446.db2.gz UEGIXCUINARQCP-INIZCTEOSA-N 0 3 289.419 2.939 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@]3(C2)CC(F)(F)CO3)c([O-])c1 ZINC001236793021 778939840 /nfs/dbraw/zinc/93/98/40/778939840.db2.gz VHJOQIASCDPTSG-HNNXBMFYSA-N 0 3 297.345 2.955 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@]3(C2)CC(F)(F)CO3)c([O-])c1 ZINC001236793021 778939857 /nfs/dbraw/zinc/93/98/57/778939857.db2.gz VHJOQIASCDPTSG-HNNXBMFYSA-N 0 3 297.345 2.955 20 10 CFCDHN COCC1CC[NH+](Cc2c(C)cc(OC)cc2[O-])CC1 ZINC001236812636 778947004 /nfs/dbraw/zinc/94/70/04/778947004.db2.gz AHJBBLYWGHAZFO-UHFFFAOYSA-N 0 3 279.380 2.568 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC001236814171 778950525 /nfs/dbraw/zinc/95/05/25/778950525.db2.gz PYEGOTZNYPQIPT-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC001236814171 778950528 /nfs/dbraw/zinc/95/05/28/778950528.db2.gz PYEGOTZNYPQIPT-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN CCCO[C@H]1CC[N@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814189 778951125 /nfs/dbraw/zinc/95/11/25/778951125.db2.gz QHTPXXNKMVYBDK-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN CCCO[C@H]1CC[N@@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814189 778951128 /nfs/dbraw/zinc/95/11/28/778951128.db2.gz QHTPXXNKMVYBDK-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN CC1(O)CC[NH+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236827403 778956137 /nfs/dbraw/zinc/95/61/37/778956137.db2.gz RPOVCZDWWABBKS-UHFFFAOYSA-N 0 3 271.360 2.892 20 10 CFCDHN CC(=O)NC1CC[NH+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236834975 778958949 /nfs/dbraw/zinc/95/89/49/778958949.db2.gz BSIRYVGCKBKWHQ-UHFFFAOYSA-N 0 3 298.386 2.646 20 10 CFCDHN CC[N@H+](CCC(=O)OC)Cc1cc2ccccc2cc1[O-] ZINC001236837729 778960198 /nfs/dbraw/zinc/96/01/98/778960198.db2.gz UAJNSCFUQIXXIQ-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CC[N@@H+](CCC(=O)OC)Cc1cc2ccccc2cc1[O-] ZINC001236837729 778960201 /nfs/dbraw/zinc/96/02/01/778960201.db2.gz UAJNSCFUQIXXIQ-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CC(=O)N1CCN(Cc2cc3ccccc3cc2O)C[C@@H]1C ZINC001236836613 778961022 /nfs/dbraw/zinc/96/10/22/778961022.db2.gz LPLZKVGYQOHWGX-ZDUSSCGKSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236838693 778962076 /nfs/dbraw/zinc/96/20/76/778962076.db2.gz ZKWKNHKOENYMDG-QGZVFWFLSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236838693 778962079 /nfs/dbraw/zinc/96/20/79/778962079.db2.gz ZKWKNHKOENYMDG-QGZVFWFLSA-N 0 3 298.386 2.598 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(CF)CC2)c([O-])c1 ZINC001237041862 778996476 /nfs/dbraw/zinc/99/64/76/778996476.db2.gz NVMDRKKTZIJLQV-UHFFFAOYSA-N 0 3 267.344 2.972 20 10 CFCDHN COC[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044968 778997299 /nfs/dbraw/zinc/99/72/99/778997299.db2.gz GGYUULYUQVRLPZ-ZDUSSCGKSA-N 0 3 263.381 2.984 20 10 CFCDHN COC[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044968 778997303 /nfs/dbraw/zinc/99/73/03/778997303.db2.gz GGYUULYUQVRLPZ-ZDUSSCGKSA-N 0 3 263.381 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c([O-])c1 ZINC001237048128 778998528 /nfs/dbraw/zinc/99/85/28/778998528.db2.gz DFAMCDKWVHOVOD-SRCQZFHVSA-N 0 3 275.392 2.982 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c([O-])c1 ZINC001237048128 778998533 /nfs/dbraw/zinc/99/85/33/778998533.db2.gz DFAMCDKWVHOVOD-SRCQZFHVSA-N 0 3 275.392 2.982 20 10 CFCDHN Oc1cc(CN2CCC3(C2)CCCCC3)cc(O)c1O ZINC001233018366 779007873 /nfs/dbraw/zinc/00/78/73/779007873.db2.gz VGBWKCZEEWQIAR-UHFFFAOYSA-N 0 3 277.364 2.960 20 10 CFCDHN Nc1cccc(C[N@@H+]2CCc3cccc([O-])c3C2)c1 ZINC001237218729 779049625 /nfs/dbraw/zinc/04/96/25/779049625.db2.gz CQODUSVTBRXJHS-UHFFFAOYSA-N 0 3 254.333 2.533 20 10 CFCDHN Nc1cccc(C[N@H+]2CCc3cccc([O-])c3C2)c1 ZINC001237218729 779049630 /nfs/dbraw/zinc/04/96/30/779049630.db2.gz CQODUSVTBRXJHS-UHFFFAOYSA-N 0 3 254.333 2.533 20 10 CFCDHN CC[N@H+](Cc1cccc(N)c1)Cc1ccccc1[O-] ZINC001237220626 779051785 /nfs/dbraw/zinc/05/17/85/779051785.db2.gz UTKXMOSUNKVWHH-UHFFFAOYSA-N 0 3 256.349 2.997 20 10 CFCDHN CC[N@@H+](Cc1cccc(N)c1)Cc1ccccc1[O-] ZINC001237220626 779051790 /nfs/dbraw/zinc/05/17/90/779051790.db2.gz UTKXMOSUNKVWHH-UHFFFAOYSA-N 0 3 256.349 2.997 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237404118 779097745 /nfs/dbraw/zinc/09/77/45/779097745.db2.gz NFYNCJBLHROBPT-SMDDNHRTSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2ncccc2C1 ZINC001237489902 779119445 /nfs/dbraw/zinc/11/94/45/779119445.db2.gz NEUJLBPDZIDJTE-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN COC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC001237680899 779159651 /nfs/dbraw/zinc/15/96/51/779159651.db2.gz JLQHZIMMDMPUBE-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN COC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC001237680899 779159654 /nfs/dbraw/zinc/15/96/54/779159654.db2.gz JLQHZIMMDMPUBE-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CO)c1[O-] ZINC001237682083 779160602 /nfs/dbraw/zinc/16/06/02/779160602.db2.gz XNWMQZXIMOWGLC-QMTHXVAHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@H]2CO)c1[O-] ZINC001237682083 779160597 /nfs/dbraw/zinc/16/05/97/779160597.db2.gz XNWMQZXIMOWGLC-QMTHXVAHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(CO)C2)c1[O-] ZINC001237681842 779161761 /nfs/dbraw/zinc/16/17/61/779161761.db2.gz UDCJTROPWNUSHU-AWEZNQCLSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@](C)(CO)C2)c1[O-] ZINC001237681842 779161765 /nfs/dbraw/zinc/16/17/65/779161765.db2.gz UDCJTROPWNUSHU-AWEZNQCLSA-N 0 3 269.772 2.558 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237680645 779706183 /nfs/dbraw/zinc/70/61/83/779706183.db2.gz FIAKTWBPDRSMLC-GFCCVEGCSA-N 0 3 255.745 2.575 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237680645 779706189 /nfs/dbraw/zinc/70/61/89/779706189.db2.gz FIAKTWBPDRSMLC-GFCCVEGCSA-N 0 3 255.745 2.575 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000703109214 780986423 /nfs/dbraw/zinc/98/64/23/780986423.db2.gz ZCTZSTRGBXCYJT-QWRGUYRKSA-N 0 3 267.344 2.997 20 10 CFCDHN C[C@H](Cc1ccccn1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000703254742 781004574 /nfs/dbraw/zinc/00/45/74/781004574.db2.gz DUQWAMRJGHYKEE-LLVKDONJSA-N 0 3 260.312 2.647 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CCCC13CC3)OCO2 ZINC000706270942 781165603 /nfs/dbraw/zinc/16/56/03/781165603.db2.gz WFSAKOGPIDHGDH-LBPRGKRZSA-N 0 3 275.348 2.791 20 10 CFCDHN CCc1cccc(CNCc2cccnc2OC)c1O ZINC000709461022 781311741 /nfs/dbraw/zinc/31/17/41/781311741.db2.gz ZCWORTWCQOKOMG-UHFFFAOYSA-N 0 3 272.348 2.648 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CCC1)[C@@H]1CCOC1 ZINC000711832337 781474364 /nfs/dbraw/zinc/47/43/64/781474364.db2.gz GQNGGHKLXLPGKS-GDBMZVCRSA-N 0 3 261.365 2.687 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185425039 282242364 /nfs/dbraw/zinc/24/23/64/282242364.db2.gz BYPIHYGMBHZUGK-BMIGLBTASA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H](CO)c2ccccc2)c1[O-] ZINC000295034712 199312799 /nfs/dbraw/zinc/31/27/99/199312799.db2.gz MAQKJFIFUFVARO-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H](CO)c2ccccc2)c1[O-] ZINC000295034712 199312800 /nfs/dbraw/zinc/31/28/00/199312800.db2.gz MAQKJFIFUFVARO-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc(CN(C)[C@@H](CO)c2ccccc2)c1O ZINC000295034712 199312802 /nfs/dbraw/zinc/31/28/02/199312802.db2.gz MAQKJFIFUFVARO-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](OC)C(C)C)c1[O-] ZINC000072924655 346948490 /nfs/dbraw/zinc/94/84/90/346948490.db2.gz BKQAUNGIVSHQCC-AWEZNQCLSA-N 0 3 267.369 2.552 20 10 CFCDHN C[C@](O)(CNCc1ccc2c(c1)CCO2)c1ccsc1 ZINC000077461181 347193153 /nfs/dbraw/zinc/19/31/53/347193153.db2.gz ZBEIDNHGIJYTNE-INIZCTEOSA-N 0 3 289.400 2.680 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cc1C ZINC000083113675 347447983 /nfs/dbraw/zinc/44/79/83/347447983.db2.gz WXSHIJYURAHZOB-HNNXBMFYSA-N 0 3 299.418 2.807 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cc1C ZINC000083113675 347447986 /nfs/dbraw/zinc/44/79/86/347447986.db2.gz WXSHIJYURAHZOB-HNNXBMFYSA-N 0 3 299.418 2.807 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c1[O-] ZINC000092073095 347609295 /nfs/dbraw/zinc/60/92/95/347609295.db2.gz RUNNUDQVTTZVIK-ZDUSSCGKSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c1[O-] ZINC000092073095 347609296 /nfs/dbraw/zinc/60/92/96/347609296.db2.gz RUNNUDQVTTZVIK-ZDUSSCGKSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCOC2(C)C)c1[O-] ZINC000294687749 199134502 /nfs/dbraw/zinc/13/45/02/199134502.db2.gz CAIOXGYXYDRPMY-GFCCVEGCSA-N 0 3 285.771 2.711 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC(C)(C)CO)c1[O-] ZINC000294715871 199149510 /nfs/dbraw/zinc/14/95/10/199149510.db2.gz DZUSIRMAIWYBMU-UHFFFAOYSA-N 0 3 271.788 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC(C)(C)CO)c1[O-] ZINC000294715871 199149511 /nfs/dbraw/zinc/14/95/11/199149511.db2.gz DZUSIRMAIWYBMU-UHFFFAOYSA-N 0 3 271.788 2.804 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1 ZINC000294703754 199143181 /nfs/dbraw/zinc/14/31/81/199143181.db2.gz BADJWPWWUKRLAH-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c1 ZINC000294703754 199143183 /nfs/dbraw/zinc/14/31/83/199143183.db2.gz BADJWPWWUKRLAH-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC[C@@H](C)CCO)c1 ZINC000297350430 200157988 /nfs/dbraw/zinc/15/79/88/200157988.db2.gz PCLAXZDCHRYLPQ-YPMHNXCESA-N 0 3 251.370 2.760 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)C1CCCCC1)CC2 ZINC000297531871 200220054 /nfs/dbraw/zinc/22/00/54/200220054.db2.gz DOQUMIRYMROTLD-GDBMZVCRSA-N 0 3 275.392 2.910 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)c1ccsc1)CC2 ZINC000297628907 200246355 /nfs/dbraw/zinc/24/63/55/200246355.db2.gz JFBFMFLOGDDQCN-JSGCOSHPSA-N 0 3 275.373 2.764 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)CC2 ZINC000297631827 200247394 /nfs/dbraw/zinc/24/73/94/200247394.db2.gz JIQFVWWKOOVWBM-MCIONIFRSA-N 0 3 261.365 2.520 20 10 CFCDHN CN(C)[C@H](C[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000020093915 372230296 /nfs/dbraw/zinc/23/02/96/372230296.db2.gz QQLRFCOTLCSQTC-MRXNPFEDSA-N 0 3 270.376 2.785 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccccc2C)c1[O-] ZINC000037718871 372694544 /nfs/dbraw/zinc/69/45/44/372694544.db2.gz YCOVKCOAUBOSRG-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H]2CCCCO2)c1 ZINC000042812483 372958068 /nfs/dbraw/zinc/95/80/68/372958068.db2.gz KZXZODTWLCKMKH-YPMHNXCESA-N 0 3 265.353 2.621 20 10 CFCDHN COc1ccc(N2CCCN(Cc3cc[nH]c3)CC2)cc1 ZINC000092380770 375106653 /nfs/dbraw/zinc/10/66/53/375106653.db2.gz DODJZALMAGQQNC-UHFFFAOYSA-N 0 3 285.391 2.736 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H](n3cccn3)C2)cc1 ZINC000092966921 375169384 /nfs/dbraw/zinc/16/93/84/375169384.db2.gz GQBMHCUUPDFRLB-KRWDZBQOSA-N 0 3 284.407 2.786 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H](COC)C2)c1[O-] ZINC000093337670 375215855 /nfs/dbraw/zinc/21/58/55/375215855.db2.gz XTIHWUASAMDKLD-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H](COC)C2)c1[O-] ZINC000093337670 375215860 /nfs/dbraw/zinc/21/58/60/375215860.db2.gz XTIHWUASAMDKLD-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@](C)(O)c2ccccc2)c1 ZINC000114508234 376073157 /nfs/dbraw/zinc/07/31/57/376073157.db2.gz ZPPMMYPPEYAUKS-KRWDZBQOSA-N 0 3 271.360 2.698 20 10 CFCDHN CN1CCC(C[N@H+](C)Cc2cccc(Cl)c2[O-])CC1 ZINC000124590777 377067698 /nfs/dbraw/zinc/06/76/98/377067698.db2.gz UQZYIHYTRNGPTQ-UHFFFAOYSA-N 0 3 282.815 2.819 20 10 CFCDHN CN1CCC(C[N@@H+](C)Cc2cccc(Cl)c2[O-])CC1 ZINC000124590777 377067705 /nfs/dbraw/zinc/06/77/05/377067705.db2.gz UQZYIHYTRNGPTQ-UHFFFAOYSA-N 0 3 282.815 2.819 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@]2(C)CCCS2)c1[O-] ZINC000126491536 377230876 /nfs/dbraw/zinc/23/08/76/377230876.db2.gz QDCGTTVZKHGIBF-CQSZACIVSA-N 0 3 267.394 2.776 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1cc(OCC)ccc1[O-] ZINC000126892587 377252253 /nfs/dbraw/zinc/25/22/53/377252253.db2.gz AOLFUQSCSIXPPK-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1cc(OCC)ccc1[O-] ZINC000126892587 377252263 /nfs/dbraw/zinc/25/22/63/377252263.db2.gz AOLFUQSCSIXPPK-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN C[C@@H](CO)N[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000127530710 377288487 /nfs/dbraw/zinc/28/84/87/377288487.db2.gz LYSNFEQSXMFSIV-STQMWFEESA-N 0 3 280.387 2.847 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@H]2CCSC2)cc1F ZINC000130534823 377572200 /nfs/dbraw/zinc/57/22/00/377572200.db2.gz OVPVFCSUTRGYCK-LBPRGKRZSA-N 0 3 268.401 2.829 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@H]([NH+]2CCCC2)C1 ZINC000133942580 377970217 /nfs/dbraw/zinc/97/02/17/377970217.db2.gz GRHPIBPFEKUBOK-AWEZNQCLSA-N 0 3 280.799 2.716 20 10 CFCDHN COc1cccc(CNCc2ccccc2O)c1OC ZINC000134226864 377995147 /nfs/dbraw/zinc/99/51/47/377995147.db2.gz HCUJOWSPGORSDO-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)C(=O)NC(C)(C)C)c1ccccc1[O-] ZINC000135733678 378161322 /nfs/dbraw/zinc/16/13/22/378161322.db2.gz HDXKOYNSEMNGBA-DGCLKSJQSA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CC[C@H](CO)CC2)cc1C ZINC000153112654 378473885 /nfs/dbraw/zinc/47/38/85/378473885.db2.gz NYIMYAFLJSZURO-OTVXOJSOSA-N 0 3 263.381 2.650 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)C2CC(F)(F)C2)c1[O-] ZINC000529566818 383730652 /nfs/dbraw/zinc/73/06/52/383730652.db2.gz HDRSECZWQOFQBO-SECBINFHSA-N 0 3 271.307 2.924 20 10 CFCDHN COc1cccc(CN2CC(Cc3ccco3)C2)c1O ZINC000529648718 383741810 /nfs/dbraw/zinc/74/18/10/383741810.db2.gz IIACTCUSIKDPIO-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC23CC(C2)CO3)c1[O-] ZINC000529664743 383743637 /nfs/dbraw/zinc/74/36/37/383743637.db2.gz XNKKSJJSOXLIDU-UHFFFAOYSA-N 0 3 267.756 2.623 20 10 CFCDHN C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1ccccc1[O-] ZINC000178439114 380452267 /nfs/dbraw/zinc/45/22/67/380452267.db2.gz JMGXMHLSBCWUOK-MZPVMMEZSA-N 0 3 269.344 2.701 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(OC[C@H]2CCCO2)CC1 ZINC000179565025 380556572 /nfs/dbraw/zinc/55/65/72/380556572.db2.gz SKJPNXIIBGKUBW-MRXNPFEDSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(OC[C@@H]2CCCO2)CC1 ZINC000179565015 380557212 /nfs/dbraw/zinc/55/72/12/380557212.db2.gz SKJPNXIIBGKUBW-INIZCTEOSA-N 0 3 291.391 2.552 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCC2(C)OCCO2)cc1 ZINC000179575900 380561555 /nfs/dbraw/zinc/56/15/55/380561555.db2.gz AYOMJSVHEVKFAQ-CYBMUJFWSA-N 0 3 278.396 2.556 20 10 CFCDHN CC[N@H+](Cc1cc(OC)c(OC)cc1[O-])C(C)C ZINC000179666568 380569124 /nfs/dbraw/zinc/56/91/24/380569124.db2.gz MLMQRBIHUNTNMY-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN CC[N@@H+](Cc1cc(OC)c(OC)cc1[O-])C(C)C ZINC000179666568 380569129 /nfs/dbraw/zinc/56/91/29/380569129.db2.gz MLMQRBIHUNTNMY-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC(C)(C)O)c1[O-] ZINC000180252501 380640158 /nfs/dbraw/zinc/64/01/58/380640158.db2.gz HACZIGSZBQOVPM-UHFFFAOYSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC(C)(C)O)c1[O-] ZINC000180252501 380640163 /nfs/dbraw/zinc/64/01/63/380640163.db2.gz HACZIGSZBQOVPM-UHFFFAOYSA-N 0 3 257.761 2.557 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@@H]1n1ccnc1 ZINC000180271772 380642119 /nfs/dbraw/zinc/64/21/19/380642119.db2.gz GRBNEPKIYCUAFB-DOMZBBRYSA-N 0 3 289.354 2.811 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@@H]1n1ccnc1 ZINC000180271772 380642124 /nfs/dbraw/zinc/64/21/24/380642124.db2.gz GRBNEPKIYCUAFB-DOMZBBRYSA-N 0 3 289.354 2.811 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000180027830 380610681 /nfs/dbraw/zinc/61/06/81/380610681.db2.gz HPJDYQYLSKXRCR-MRXNPFEDSA-N 0 3 292.398 2.982 20 10 CFCDHN Cc1cccc(C[N@H+](CCCO)CC(C)(C)C)c1[O-] ZINC000180074241 380618322 /nfs/dbraw/zinc/61/83/22/380618322.db2.gz WDPPILCLKGRGRE-UHFFFAOYSA-N 0 3 265.397 2.931 20 10 CFCDHN Cc1cccc(C[N@@H+](CCCO)CC(C)(C)C)c1[O-] ZINC000180074241 380618330 /nfs/dbraw/zinc/61/83/30/380618330.db2.gz WDPPILCLKGRGRE-UHFFFAOYSA-N 0 3 265.397 2.931 20 10 CFCDHN C[C@H]1SCC[N@H+](Cc2cc(F)ccc2[O-])[C@H]1C ZINC000180172088 380628074 /nfs/dbraw/zinc/62/80/74/380628074.db2.gz JIDDVCDTGLJGEY-VHSXEESVSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@H]1SCC[N@@H+](Cc2cc(F)ccc2[O-])[C@H]1C ZINC000180172088 380628079 /nfs/dbraw/zinc/62/80/79/380628079.db2.gz JIDDVCDTGLJGEY-VHSXEESVSA-N 0 3 255.358 2.857 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCC[C@@H]1O ZINC000181094674 380738354 /nfs/dbraw/zinc/73/83/54/380738354.db2.gz HFWDAMZKBGJLPG-RISCZKNCSA-N 0 3 267.344 2.514 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCC[C@@H]1O ZINC000181094674 380738358 /nfs/dbraw/zinc/73/83/58/380738358.db2.gz HFWDAMZKBGJLPG-RISCZKNCSA-N 0 3 267.344 2.514 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c1 ZINC000181096391 380738760 /nfs/dbraw/zinc/73/87/60/380738760.db2.gz LKHVETDWXRLALQ-BBRMVZONSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c1 ZINC000181096391 380738761 /nfs/dbraw/zinc/73/87/61/380738761.db2.gz LKHVETDWXRLALQ-BBRMVZONSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000367966813 380870761 /nfs/dbraw/zinc/87/07/61/380870761.db2.gz RHVKPVZNULEHQK-MRXNPFEDSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000367966813 380870770 /nfs/dbraw/zinc/87/07/70/380870770.db2.gz RHVKPVZNULEHQK-MRXNPFEDSA-N 0 3 263.381 2.541 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)OCCO)c1ccc(C)cc1[O-] ZINC000287479765 380842708 /nfs/dbraw/zinc/84/27/08/380842708.db2.gz XAMJKWXUILFNTK-AWEZNQCLSA-N 0 3 281.396 2.529 20 10 CFCDHN CCOCc1cc(CN[C@H]2CCCOC2)ccc1OC ZINC000288352210 381011226 /nfs/dbraw/zinc/01/12/26/381011226.db2.gz CCJHKRAGWIURGW-HNNXBMFYSA-N 0 3 279.380 2.500 20 10 CFCDHN COCCCCC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000182322955 381061866 /nfs/dbraw/zinc/06/18/66/381061866.db2.gz OMHBBYUEQZTPDP-GFCCVEGCSA-N 0 3 267.369 2.868 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000295926089 381160934 /nfs/dbraw/zinc/16/09/34/381160934.db2.gz JZRHLVJJVUQPML-WBVHZDCISA-N 0 3 299.370 2.711 20 10 CFCDHN CCn1cc([C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000295879835 381134407 /nfs/dbraw/zinc/13/44/07/381134407.db2.gz GXWAHYREPQDZMN-BXUZGUMPSA-N 0 3 271.364 2.947 20 10 CFCDHN CCn1cc([C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000295879844 381134503 /nfs/dbraw/zinc/13/45/03/381134503.db2.gz GXWAHYREPQDZMN-RISCZKNCSA-N 0 3 271.364 2.947 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(OC)CCCC2)c1[O-] ZINC000295965636 381185862 /nfs/dbraw/zinc/18/58/62/381185862.db2.gz IDIHIRLVUPFTRC-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccc(O)cc1)CC2 ZINC000295969483 381188268 /nfs/dbraw/zinc/18/82/68/381188268.db2.gz MNNRENVNBYOXKH-OAHLLOKOSA-N 0 3 269.344 2.917 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])[nH]n1 ZINC000183621624 381295436 /nfs/dbraw/zinc/29/54/36/381295436.db2.gz ANEPZKSBWRDJBH-ZYHUDNBSSA-N 0 3 259.353 2.706 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])n[nH]1 ZINC000183621624 381295441 /nfs/dbraw/zinc/29/54/41/381295441.db2.gz ANEPZKSBWRDJBH-ZYHUDNBSSA-N 0 3 259.353 2.706 20 10 CFCDHN C[C@@H]([NH2+]C[C@]1(O)CCc2ccccc21)c1ccccc1[O-] ZINC000183628101 381296846 /nfs/dbraw/zinc/29/68/46/381296846.db2.gz HGUMBAOKUXDWMZ-FZKQIMNGSA-N 0 3 283.371 2.877 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183484908 381276942 /nfs/dbraw/zinc/27/69/42/381276942.db2.gz FTILQOTUKNTJDM-OLZOCXBDSA-N 0 3 250.386 2.773 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CC(C)(C)O)c([O-])c1 ZINC000296281725 381331535 /nfs/dbraw/zinc/33/15/35/381331535.db2.gz FCHZQJUFUPGKHK-RYUDHWBXSA-N 0 3 251.370 2.901 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1cccc(CO)c1)CC2 ZINC000296229634 381311325 /nfs/dbraw/zinc/31/13/25/381311325.db2.gz AKCZZKIYYCHDBD-HNNXBMFYSA-N 0 3 269.344 2.662 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000296369692 381366394 /nfs/dbraw/zinc/36/63/94/381366394.db2.gz JEAUQVFTDSOMBX-AVOUXACISA-N 0 3 274.408 2.976 20 10 CFCDHN Cc1cc(O)c(CN[C@H](CCO)c2ccco2)cc1C ZINC000184505803 381424678 /nfs/dbraw/zinc/42/46/78/381424678.db2.gz MRFQQLZEZKGEQC-CQSZACIVSA-N 0 3 275.348 2.815 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000296531073 381436375 /nfs/dbraw/zinc/43/63/75/381436375.db2.gz QLSATTLUKGTJGO-NHYWBVRUSA-N 0 3 296.386 2.685 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)CC2 ZINC000296490798 381418411 /nfs/dbraw/zinc/41/84/11/381418411.db2.gz PPSXHMBLWOZYRK-CVEARBPZSA-N 0 3 283.371 2.573 20 10 CFCDHN Cn1ccnc1C[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000184730756 381471975 /nfs/dbraw/zinc/47/19/75/381471975.db2.gz SLFNJUBDQNEPAN-CQSZACIVSA-N 0 3 285.391 2.580 20 10 CFCDHN Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000184730756 381471981 /nfs/dbraw/zinc/47/19/81/381471981.db2.gz SLFNJUBDQNEPAN-CQSZACIVSA-N 0 3 285.391 2.580 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@H]1CCCCO1)CC2 ZINC000296574948 381455470 /nfs/dbraw/zinc/45/54/70/381455470.db2.gz VJPGWAJWVQHBQZ-ZIAGYGMSSA-N 0 3 261.365 2.928 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCNc1ccccn1)CC2 ZINC000297853761 381573546 /nfs/dbraw/zinc/57/35/46/381573546.db2.gz SZEDNWFMMUEIKH-AWEZNQCLSA-N 0 3 283.375 2.866 20 10 CFCDHN CCCC[N@H+](CCc1cncn1C)Cc1ccccc1[O-] ZINC000297665872 381569118 /nfs/dbraw/zinc/56/91/18/381569118.db2.gz OEEAGHOKNFVCRY-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN CCCC[N@@H+](CCc1cncn1C)Cc1ccccc1[O-] ZINC000297665872 381569126 /nfs/dbraw/zinc/56/91/26/381569126.db2.gz OEEAGHOKNFVCRY-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)C2CCCCC2)c1 ZINC000185328043 381599523 /nfs/dbraw/zinc/59/95/23/381599523.db2.gz BCYDEWAGAJVANW-SJKOYZFVSA-N 0 3 293.407 2.993 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000371313472 381588392 /nfs/dbraw/zinc/58/83/92/381588392.db2.gz HQHZVPVFZNGSBH-KBPBESRZSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000371313472 381588396 /nfs/dbraw/zinc/58/83/96/381588396.db2.gz HQHZVPVFZNGSBH-KBPBESRZSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccc(O)c2)c1 ZINC000185300111 381589667 /nfs/dbraw/zinc/58/96/67/381589667.db2.gz QVTJZSSTRAIEAP-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000371469081 381634473 /nfs/dbraw/zinc/63/44/73/381634473.db2.gz CYEXEZWVCCBBIA-FVQBIDKESA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000371469081 381634481 /nfs/dbraw/zinc/63/44/81/381634481.db2.gz CYEXEZWVCCBBIA-FVQBIDKESA-N 0 3 275.392 2.946 20 10 CFCDHN CC[C@H](C)[C@@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185439560 381631638 /nfs/dbraw/zinc/63/16/38/381631638.db2.gz ODQNKYGDVUFTLX-BHDSKKPTSA-N 0 3 255.333 2.589 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c1[O-] ZINC000371488986 381642920 /nfs/dbraw/zinc/64/29/20/381642920.db2.gz MMPWAYXZSSCXGI-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@H]3CC[N@H+](C)[C@H]3C2)c1[O-] ZINC000371488986 381642927 /nfs/dbraw/zinc/64/29/27/381642927.db2.gz MMPWAYXZSSCXGI-DOMZBBRYSA-N 0 3 294.826 2.880 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)CC(C)(C)C)c1 ZINC000185482031 381646601 /nfs/dbraw/zinc/64/66/01/381646601.db2.gz XRTRTSLBXBZTOT-VXGBXAGGSA-N 0 3 281.396 2.849 20 10 CFCDHN CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)[C@@H]1SC ZINC000298538353 381666112 /nfs/dbraw/zinc/66/61/12/381666112.db2.gz SUKDUZPRZMJDLG-XHSDSOJGSA-N 0 3 294.464 2.751 20 10 CFCDHN CC(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000185579594 381671305 /nfs/dbraw/zinc/67/13/05/381671305.db2.gz IXKCBEDRPXLRKJ-CQSZACIVSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000185579594 381671310 /nfs/dbraw/zinc/67/13/10/381671310.db2.gz IXKCBEDRPXLRKJ-CQSZACIVSA-N 0 3 291.391 2.946 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCO[C@@H]2CCOC2)c([O-])c1 ZINC000185705036 381709771 /nfs/dbraw/zinc/70/97/71/381709771.db2.gz CDWFXFYTDJPQNA-ZIAGYGMSSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CO[C@@H]2CCOC2)c([O-])c1 ZINC000185673797 381701896 /nfs/dbraw/zinc/70/18/96/381701896.db2.gz NGKKNCKVCXHJKE-HZSPNIEDSA-N 0 3 279.380 2.545 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1CO ZINC000372773181 381865533 /nfs/dbraw/zinc/86/55/33/381865533.db2.gz QMDBZNGGVTZNJV-YJBOKZPZSA-N 0 3 283.371 2.778 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000373253420 381959876 /nfs/dbraw/zinc/95/98/76/381959876.db2.gz UPZFOAFBHVECLS-CYBMUJFWSA-N 0 3 279.355 2.780 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c([O-])c1C ZINC000373266195 381964410 /nfs/dbraw/zinc/96/44/10/381964410.db2.gz LXKUVQWZEWCLOO-GXTWGEPZSA-N 0 3 285.391 2.940 20 10 CFCDHN C[C@@H](C[S@](C)=O)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000186540684 381941869 /nfs/dbraw/zinc/94/18/69/381941869.db2.gz CBFBCQGSPAZHES-PVUDRZGPSA-N 0 3 295.448 2.689 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])[C@H]2CCCO[C@H]21 ZINC000374904667 382059144 /nfs/dbraw/zinc/05/91/44/382059144.db2.gz UNTAJUFXRCCCPS-BPLDGKMQSA-N 0 3 279.355 2.825 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCCOCC2)c1O ZINC000375018858 382065808 /nfs/dbraw/zinc/06/58/08/382065808.db2.gz JYWDQLUDHVVQMI-UHFFFAOYSA-N 0 3 255.745 2.576 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000373569295 382020789 /nfs/dbraw/zinc/02/07/89/382020789.db2.gz QOFIKLDRQAUGJV-UHFFFAOYSA-N 0 3 261.365 2.785 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000373569295 382020795 /nfs/dbraw/zinc/02/07/95/382020795.db2.gz QOFIKLDRQAUGJV-UHFFFAOYSA-N 0 3 261.365 2.785 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2CCc3ccccc3OC2)c1 ZINC000376081374 382119069 /nfs/dbraw/zinc/11/90/69/382119069.db2.gz JVVSBHZBSUUAQC-HNNXBMFYSA-N 0 3 299.370 2.884 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC3(CCOCC3)[C@@H]2C)c1 ZINC000375235655 382073049 /nfs/dbraw/zinc/07/30/49/382073049.db2.gz BEVPYIGQSNYFJJ-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC3(CCOCC3)[C@@H]2C)c1 ZINC000375235655 382073053 /nfs/dbraw/zinc/07/30/53/382073053.db2.gz BEVPYIGQSNYFJJ-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000375243349 382073498 /nfs/dbraw/zinc/07/34/98/382073498.db2.gz XIMYGELXAAEYRQ-QGZVFWFLSA-N 0 3 287.334 2.971 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000375243349 382073502 /nfs/dbraw/zinc/07/35/02/382073502.db2.gz XIMYGELXAAEYRQ-QGZVFWFLSA-N 0 3 287.334 2.971 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC23CCOCC3)c1 ZINC000375728745 382098475 /nfs/dbraw/zinc/09/84/75/382098475.db2.gz CWNOKNCJOPJYTL-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC23CCOCC3)c1 ZINC000375728745 382098482 /nfs/dbraw/zinc/09/84/82/382098482.db2.gz CWNOKNCJOPJYTL-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN COC(=O)c1ccccc1CC[N@H+](C)Cc1ccccc1[O-] ZINC000187246182 382137477 /nfs/dbraw/zinc/13/74/77/382137477.db2.gz XYVUDYVQSYLWBC-UHFFFAOYSA-N 0 3 299.370 2.853 20 10 CFCDHN COC(=O)c1ccccc1CC[N@@H+](C)Cc1ccccc1[O-] ZINC000187246182 382137485 /nfs/dbraw/zinc/13/74/85/382137485.db2.gz XYVUDYVQSYLWBC-UHFFFAOYSA-N 0 3 299.370 2.853 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000293546067 382168126 /nfs/dbraw/zinc/16/81/26/382168126.db2.gz DKRKQCQSXHZRPE-CQSZACIVSA-N 0 3 281.371 2.810 20 10 CFCDHN CS[C@H](CO)[C@@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000293666040 382222337 /nfs/dbraw/zinc/22/23/37/382222337.db2.gz JLOTYRNRURMSLG-YRGRVCCFSA-N 0 3 283.437 2.772 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293666037 382222633 /nfs/dbraw/zinc/22/26/33/382222633.db2.gz JLOTYRNRURMSLG-SGMGOOAPSA-N 0 3 283.437 2.772 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000363843118 382247606 /nfs/dbraw/zinc/24/76/06/382247606.db2.gz FBRJNJFCQQCNJR-OAHLLOKOSA-N 0 3 261.365 2.641 20 10 CFCDHN Cc1cccc(C[NH+]2CCC([C@H]3CCOC3)CC2)c1[O-] ZINC000363841877 382247987 /nfs/dbraw/zinc/24/79/87/382247987.db2.gz ASGZEPHVJCROLJ-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2(O)Cc3ccccc3C2)c1 ZINC000363862458 382249333 /nfs/dbraw/zinc/24/93/33/382249333.db2.gz JDIGKEJEBXYWOG-AWEZNQCLSA-N 0 3 297.398 2.881 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2ccccc2[O-])CCO[C@@H]1C1CC1 ZINC000364070131 382257517 /nfs/dbraw/zinc/25/75/17/382257517.db2.gz BGJORNHCPDBMCQ-CVEARBPZSA-N 0 3 261.365 2.687 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCN(C)C)c([O-])c1 ZINC000293773039 382273586 /nfs/dbraw/zinc/27/35/86/382273586.db2.gz PRJLDENOBMQTDZ-ZDUSSCGKSA-N 0 3 250.386 2.611 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@@]23CCOC3)c1 ZINC000377685330 382320318 /nfs/dbraw/zinc/32/03/18/382320318.db2.gz ZTMCOQXZCUIRMV-WBMJQRKESA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@@]23CCOC3)c1 ZINC000377685330 382320319 /nfs/dbraw/zinc/32/03/19/382320319.db2.gz ZTMCOQXZCUIRMV-WBMJQRKESA-N 0 3 277.364 2.717 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOCC2(CC2)C1 ZINC000377702981 382325488 /nfs/dbraw/zinc/32/54/88/382325488.db2.gz QBNKQWOJVPAFBU-CQSZACIVSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOCC2(CC2)C1 ZINC000377702981 382325491 /nfs/dbraw/zinc/32/54/91/382325491.db2.gz QBNKQWOJVPAFBU-CQSZACIVSA-N 0 3 261.365 2.956 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000188035954 382330655 /nfs/dbraw/zinc/33/06/55/382330655.db2.gz BSQAYNASGPQHJT-UMVBOHGHSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1[O-] ZINC000294076883 382407095 /nfs/dbraw/zinc/40/70/95/382407095.db2.gz QUXAKEHHBIYWAK-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@H](C(C)C)C2)c1[O-] ZINC000294076883 382407099 /nfs/dbraw/zinc/40/70/99/382407099.db2.gz QUXAKEHHBIYWAK-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000294105929 382418223 /nfs/dbraw/zinc/41/82/23/382418223.db2.gz SJZOCHLLACXIBQ-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@](CO)(C(C)C)C2)c1[O-] ZINC000294105929 382418227 /nfs/dbraw/zinc/41/82/27/382418227.db2.gz SJZOCHLLACXIBQ-QGZVFWFLSA-N 0 3 277.408 2.931 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000378626944 382492932 /nfs/dbraw/zinc/49/29/32/382492932.db2.gz AFMWUNJQSUZESB-OAHLLOKOSA-N 0 3 268.360 2.852 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000378626944 382492936 /nfs/dbraw/zinc/49/29/36/382492936.db2.gz AFMWUNJQSUZESB-OAHLLOKOSA-N 0 3 268.360 2.852 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cc(OC)ccc1[O-])OC ZINC000294269893 382488144 /nfs/dbraw/zinc/48/81/44/382488144.db2.gz RSQWYKRPVKZGCX-IAQYHMDHSA-N 0 3 267.369 2.552 20 10 CFCDHN Cc1noc(CCC[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])n1 ZINC000294669984 382524303 /nfs/dbraw/zinc/52/43/03/382524303.db2.gz HQWZNYGCLGSWCI-LBPRGKRZSA-N 0 3 289.379 2.984 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nccnc1C)c1ccccc1[O-] ZINC000294908880 382543217 /nfs/dbraw/zinc/54/32/17/382543217.db2.gz GBGPHJBPDLFQOH-CQSZACIVSA-N 0 3 271.364 2.774 20 10 CFCDHN CC(C)(C[NH2+]Cc1ccccc1[O-])c1ccccn1 ZINC000294909079 382543408 /nfs/dbraw/zinc/54/34/08/382543408.db2.gz XWKZXJGNNWJMJZ-UHFFFAOYSA-N 0 3 256.349 2.855 20 10 CFCDHN COC[C@@]1(C)CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000295024082 382562797 /nfs/dbraw/zinc/56/27/97/382562797.db2.gz CMHWQQKIXGRHPE-INIZCTEOSA-N 0 3 263.381 2.867 20 10 CFCDHN COC[C@@]1(C)CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000295024082 382562800 /nfs/dbraw/zinc/56/28/00/382562800.db2.gz CMHWQQKIXGRHPE-INIZCTEOSA-N 0 3 263.381 2.867 20 10 CFCDHN CCC(=O)N1CCC[N@@H+]([C@@H](CC)c2ccccc2[O-])CC1 ZINC000367322891 382564463 /nfs/dbraw/zinc/56/44/63/382564463.db2.gz WXKVMIFZDLVGCQ-HNNXBMFYSA-N 0 3 290.407 2.788 20 10 CFCDHN CCC(=O)N1CCC[N@H+]([C@@H](CC)c2ccccc2[O-])CC1 ZINC000367322891 382564468 /nfs/dbraw/zinc/56/44/68/382564468.db2.gz WXKVMIFZDLVGCQ-HNNXBMFYSA-N 0 3 290.407 2.788 20 10 CFCDHN Cc1nccnc1CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000294857962 382533832 /nfs/dbraw/zinc/53/38/32/382533832.db2.gz BULLOEOWDZQRTN-JTQLQIEISA-N 0 3 275.327 2.523 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)[C@H](C)O1 ZINC000295233692 382595488 /nfs/dbraw/zinc/59/54/88/382595488.db2.gz SECDSDFCNCIMQU-UHIISALHSA-N 0 3 266.360 2.547 20 10 CFCDHN COC[C@]1(C)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000295136124 382578219 /nfs/dbraw/zinc/57/82/19/382578219.db2.gz PFJKUEYQYWNABN-MRXNPFEDSA-N 0 3 280.387 2.750 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(Nc2nccs2)CC1 ZINC000189950147 382646821 /nfs/dbraw/zinc/64/68/21/382646821.db2.gz KKTGEAJAUCSNAW-UHFFFAOYSA-N 0 3 289.404 2.925 20 10 CFCDHN CCC(=O)CCN1CCCN(c2ccc(OC)cc2)CC1 ZINC000190195407 382656787 /nfs/dbraw/zinc/65/67/87/382656787.db2.gz HWLXCRRQZMVRDQ-UHFFFAOYSA-N 0 3 290.407 2.577 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@](CC)(CO)C2)c1 ZINC000190229014 382658122 /nfs/dbraw/zinc/65/81/22/382658122.db2.gz LFUDJQGXPZFTHB-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@](CC)(CO)C2)c1 ZINC000190229014 382658123 /nfs/dbraw/zinc/65/81/23/382658123.db2.gz LFUDJQGXPZFTHB-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190848056 382682516 /nfs/dbraw/zinc/68/25/16/382682516.db2.gz WGCCFLXAHMGACY-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190848056 382682517 /nfs/dbraw/zinc/68/25/17/382682517.db2.gz WGCCFLXAHMGACY-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCCSC2)cc1C ZINC000267196333 384321599 /nfs/dbraw/zinc/32/15/99/384321599.db2.gz NMHIHHMHRZUIEK-ZDUSSCGKSA-N 0 3 251.395 2.994 20 10 CFCDHN CCOc1cccc(CN[C@@H]2CCCc3c[nH]nc32)c1O ZINC000268813752 384666143 /nfs/dbraw/zinc/66/61/43/384666143.db2.gz FMLUCXKWYHIGKF-CYBMUJFWSA-N 0 3 287.363 2.681 20 10 CFCDHN CCC[N@H+](Cc1cnn(C)c1C)Cc1ccccc1[O-] ZINC000269039539 384717052 /nfs/dbraw/zinc/71/70/52/384717052.db2.gz UVWNTJIGJPQFOH-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN CCC[N@@H+](Cc1cnn(C)c1C)Cc1ccccc1[O-] ZINC000269039539 384717056 /nfs/dbraw/zinc/71/70/56/384717056.db2.gz UVWNTJIGJPQFOH-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN CC(C)[C@H](C(=O)NCc1ccccc1O)N1CCCCC1 ZINC000269145215 384730391 /nfs/dbraw/zinc/73/03/91/384730391.db2.gz NVEAIBVYIGWMLV-MRXNPFEDSA-N 0 3 290.407 2.519 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC[C@H](CO)C2)cc1F ZINC000269347035 384750236 /nfs/dbraw/zinc/75/02/36/384750236.db2.gz INSJIHRUWJFWCQ-HNNXBMFYSA-N 0 3 294.414 2.876 20 10 CFCDHN CC(=O)CCN(Cc1ccc(N(C)C)cc1)C1CC1 ZINC000269471158 384761733 /nfs/dbraw/zinc/76/17/33/384761733.db2.gz JFYHXDWPPOZCDJ-UHFFFAOYSA-N 0 3 260.381 2.696 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)CC1CCC1)c1ccccc1[O-] ZINC000281312043 385189048 /nfs/dbraw/zinc/18/90/48/385189048.db2.gz ZEVFFEDBXVEAJH-DZGCQCFKSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1ccccc1[O-] ZINC000281312047 385189146 /nfs/dbraw/zinc/18/91/46/385189146.db2.gz ZEVFFEDBXVEAJH-UKRRQHHQSA-N 0 3 263.381 2.984 20 10 CFCDHN COC1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000271031120 385310692 /nfs/dbraw/zinc/31/06/92/385310692.db2.gz GTMLXVQMLBWCSX-UHFFFAOYSA-N 0 3 266.360 2.503 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CCOCC ZINC000282463677 385317669 /nfs/dbraw/zinc/31/76/69/385317669.db2.gz NCLSNTJRFWCAQD-MRXNPFEDSA-N 0 3 295.423 2.782 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CCOCC ZINC000282463677 385317673 /nfs/dbraw/zinc/31/76/73/385317673.db2.gz NCLSNTJRFWCAQD-MRXNPFEDSA-N 0 3 295.423 2.782 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCC2([S@](C)=O)CC2)cc1 ZINC000282278997 385268561 /nfs/dbraw/zinc/26/85/61/385268561.db2.gz KVZPXQAWRRRCGK-XCLFUZPHSA-N 0 3 294.464 2.704 20 10 CFCDHN CCCCN(CC(=O)NCC1CC1)Cc1ccccc1O ZINC000282351434 385290746 /nfs/dbraw/zinc/29/07/46/385290746.db2.gz CMZWBWAEVZFMML-UHFFFAOYSA-N 0 3 290.407 2.521 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000271715247 385388790 /nfs/dbraw/zinc/38/87/90/385388790.db2.gz WPGMXBLTTUXXSX-GFCCVEGCSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[N@H+](C)C[C@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000271169528 385360827 /nfs/dbraw/zinc/36/08/27/385360827.db2.gz DOZPHXAIMRSPMW-GFCCVEGCSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[N@@H+](C)C[C@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000271169528 385360830 /nfs/dbraw/zinc/36/08/30/385360830.db2.gz DOZPHXAIMRSPMW-GFCCVEGCSA-N 0 3 282.815 2.819 20 10 CFCDHN Cc1cccc(CN2CCC[C@@H]2[C@@H](O)C(F)(F)F)c1O ZINC000271751029 385390325 /nfs/dbraw/zinc/39/03/25/385390325.db2.gz VIGGXKVFJCYMGW-DGCLKSJQSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H](O)C(F)(F)F)c1[O-] ZINC000271751029 385390328 /nfs/dbraw/zinc/39/03/28/385390328.db2.gz VIGGXKVFJCYMGW-DGCLKSJQSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H]2[C@@H](O)C(F)(F)F)c1[O-] ZINC000271751029 385390331 /nfs/dbraw/zinc/39/03/31/385390331.db2.gz VIGGXKVFJCYMGW-DGCLKSJQSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)c1 ZINC000271228903 385378041 /nfs/dbraw/zinc/37/80/41/385378041.db2.gz PRWLYJAPABTZHX-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H](NC[C@@](C)(O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000271450040 385382911 /nfs/dbraw/zinc/38/29/11/385382911.db2.gz FZXJNABFYGSSFJ-GXFFZTMASA-N 0 3 290.329 2.717 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CSC2(C)C)cc1C ZINC000282911813 385408880 /nfs/dbraw/zinc/40/88/80/385408880.db2.gz VDFUMVNRRCBPLW-ZDUSSCGKSA-N 0 3 251.395 2.993 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H]2CCCc3nn(C)cc32)c1 ZINC000282915613 385410479 /nfs/dbraw/zinc/41/04/79/385410479.db2.gz GVQFLSFRLCKWJS-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCCc3nn(C)cc32)c1 ZINC000282915613 385410484 /nfs/dbraw/zinc/41/04/84/385410484.db2.gz GVQFLSFRLCKWJS-CQSZACIVSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCC(=O)NC23CCC3)c1 ZINC000283346693 385458274 /nfs/dbraw/zinc/45/82/74/385458274.db2.gz MCHKZEFLAYQPIF-DOMZBBRYSA-N 0 3 288.391 2.553 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@H+](Cc3ccccc3[O-])C2)[nH]n1 ZINC000283090691 385435209 /nfs/dbraw/zinc/43/52/09/385435209.db2.gz SDEHQAYMORRASU-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)[nH]n1 ZINC000283090691 385435213 /nfs/dbraw/zinc/43/52/13/385435213.db2.gz SDEHQAYMORRASU-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@H+](Cc3ccccc3[O-])C2)n[nH]1 ZINC000283090691 385435216 /nfs/dbraw/zinc/43/52/16/385435216.db2.gz SDEHQAYMORRASU-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)n[nH]1 ZINC000283090691 385435219 /nfs/dbraw/zinc/43/52/19/385435219.db2.gz SDEHQAYMORRASU-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000272301604 385504157 /nfs/dbraw/zinc/50/41/57/385504157.db2.gz PRXHPEUMRWQNPA-UHFFFAOYSA-N 0 3 279.355 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000272301604 385504160 /nfs/dbraw/zinc/50/41/60/385504160.db2.gz PRXHPEUMRWQNPA-UHFFFAOYSA-N 0 3 279.355 2.924 20 10 CFCDHN COCCN(C)CCC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284201903 385546293 /nfs/dbraw/zinc/54/62/93/385546293.db2.gz SFNJVIOWNMJGKL-HNNXBMFYSA-N 0 3 294.439 2.628 20 10 CFCDHN COCCN(C)CCC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284201910 385546421 /nfs/dbraw/zinc/54/64/21/385546421.db2.gz SFNJVIOWNMJGKL-OAHLLOKOSA-N 0 3 294.439 2.628 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284301567 385547132 /nfs/dbraw/zinc/54/71/32/385547132.db2.gz BORBAIMIUCYXFG-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000284301567 385547135 /nfs/dbraw/zinc/54/71/35/385547135.db2.gz BORBAIMIUCYXFG-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)C(C)C)c([O-])c1 ZINC000285248835 385554699 /nfs/dbraw/zinc/55/46/99/385554699.db2.gz PWRVNIMNMIGZHI-TZMCWYRMSA-N 0 3 251.370 2.677 20 10 CFCDHN C[N@H+](CC[C@@H](O)c1ccccc1)Cc1ccccc1[O-] ZINC000285813160 385558175 /nfs/dbraw/zinc/55/81/75/385558175.db2.gz ZIIABQHKUWBHRA-QGZVFWFLSA-N 0 3 271.360 2.948 20 10 CFCDHN C[N@@H+](CC[C@@H](O)c1ccccc1)Cc1ccccc1[O-] ZINC000285813160 385558178 /nfs/dbraw/zinc/55/81/78/385558178.db2.gz ZIIABQHKUWBHRA-QGZVFWFLSA-N 0 3 271.360 2.948 20 10 CFCDHN COCC[C@H](NCc1cc(OC)ccc1O)c1ccco1 ZINC000272525928 385558442 /nfs/dbraw/zinc/55/84/42/385558442.db2.gz LYYVJMQBKNCARE-AWEZNQCLSA-N 0 3 291.347 2.861 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@H]2CCCC[C@H]2O)c1 ZINC000272593353 385571886 /nfs/dbraw/zinc/57/18/86/385571886.db2.gz ICFHSEATBLFFAZ-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c1 ZINC000272593353 385571888 /nfs/dbraw/zinc/57/18/88/385571888.db2.gz ICFHSEATBLFFAZ-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000272653187 385582464 /nfs/dbraw/zinc/58/24/64/385582464.db2.gz QEVPLZKOJLQLGR-DZGCQCFKSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000272653187 385582468 /nfs/dbraw/zinc/58/24/68/385582468.db2.gz QEVPLZKOJLQLGR-DZGCQCFKSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1[O-] ZINC000272824583 385625197 /nfs/dbraw/zinc/62/51/97/385625197.db2.gz GLEKJVDOQWZJSL-SLEUVZQESA-N 0 3 260.381 2.526 20 10 CFCDHN CN(C)c1ccc(CN(C)CCc2ccncc2)cc1F ZINC000273350292 385677520 /nfs/dbraw/zinc/67/75/20/385677520.db2.gz AVGZJVKZZUCGDI-UHFFFAOYSA-N 0 3 287.382 2.961 20 10 CFCDHN CCN(C)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273375860 385678923 /nfs/dbraw/zinc/67/89/23/385678923.db2.gz HEIXBFMAMNPCNZ-CYBMUJFWSA-N 0 3 250.386 2.611 20 10 CFCDHN CCn1cc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])cn1 ZINC000273356889 385679660 /nfs/dbraw/zinc/67/96/60/385679660.db2.gz CWADLDLVJBOKJL-LBPRGKRZSA-N 0 3 259.353 2.768 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(N(C)C)nc1)c1cc(F)ccc1[O-] ZINC000273437672 385682569 /nfs/dbraw/zinc/68/25/69/385682569.db2.gz XPADKGQBANSQHG-LLVKDONJSA-N 0 3 289.354 2.843 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCn2cccn2)c([O-])c1C ZINC000273432207 385683367 /nfs/dbraw/zinc/68/33/67/385683367.db2.gz VZAFDODDHJIYSQ-CQSZACIVSA-N 0 3 273.380 2.946 20 10 CFCDHN CNC(=O)C1CCC([NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1 ZINC000273556374 385687586 /nfs/dbraw/zinc/68/75/86/385687586.db2.gz HACCXKJQPKJMOY-HSBZDZAISA-N 0 3 290.407 2.656 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CCO)c([O-])c1C ZINC000273588484 385689067 /nfs/dbraw/zinc/68/90/67/385689067.db2.gz ONVWQFXOLNRVAJ-GWCFXTLKSA-N 0 3 251.370 2.678 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)CCO)c([O-])c1C ZINC000273588487 385689189 /nfs/dbraw/zinc/68/91/89/385689189.db2.gz ONVWQFXOLNRVAJ-MFKMUULPSA-N 0 3 251.370 2.678 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCO)c([O-])c1C ZINC000273579219 385689423 /nfs/dbraw/zinc/68/94/23/385689423.db2.gz MFTADGBKAJIRDQ-WCQYABFASA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2cc(F)ccc2[O-])o1 ZINC000273619850 385692758 /nfs/dbraw/zinc/69/27/58/385692758.db2.gz YQXMNPZRKUDQNO-YGRLFVJLSA-N 0 3 279.311 2.817 20 10 CFCDHN OC[C@@H]1c2ccccc2CCN1Cc1cc(F)ccc1O ZINC000180163900 285281747 /nfs/dbraw/zinc/28/17/47/285281747.db2.gz KUSSYTFMSGOAOP-MRXNPFEDSA-N 0 3 287.334 2.623 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCCN1C1CC1)CC2 ZINC000296249868 285396899 /nfs/dbraw/zinc/39/68/99/285396899.db2.gz BFKAAKJLKVGQPL-HOTGVXAUSA-N 0 3 286.419 2.986 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCO[C@]2(CCOC2)C1)c1ccccc1[O-] ZINC000372470889 393450227 /nfs/dbraw/zinc/45/02/27/393450227.db2.gz GVEUYLRVLYDEAJ-UKPHBRMFSA-N 0 3 291.391 2.771 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC000180316219 393478806 /nfs/dbraw/zinc/47/88/06/393478806.db2.gz WHIDAULZJSYJJB-HIFRSBDPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC000180316219 393478811 /nfs/dbraw/zinc/47/88/11/393478811.db2.gz WHIDAULZJSYJJB-HIFRSBDPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC23CCOCC3)c1 ZINC000374282884 393491168 /nfs/dbraw/zinc/49/11/68/393491168.db2.gz HXHJMEQGKPYPKJ-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC23CCOCC3)c1 ZINC000374282884 393491172 /nfs/dbraw/zinc/49/11/72/393491172.db2.gz HXHJMEQGKPYPKJ-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC(=O)N2CCCC[C@@H]12)c1ccccc1[O-] ZINC000374508101 393498385 /nfs/dbraw/zinc/49/83/85/393498385.db2.gz UFWHBEDPCIXKDO-ZNMIVQPWSA-N 0 3 288.391 2.586 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183507862 393521516 /nfs/dbraw/zinc/52/15/16/393521516.db2.gz RKMOOZRHVWCONV-NHYWBVRUSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](NCC1(C)OCCCO1)c1ccc(N(C)C)cc1 ZINC000190651677 393582676 /nfs/dbraw/zinc/58/26/76/393582676.db2.gz IQLKKOKEHJPGPR-INIZCTEOSA-N 0 3 292.423 2.946 20 10 CFCDHN CC[C@H]([NH2+]CCCc1nc(C)no1)c1ccccc1[O-] ZINC000271723733 394022829 /nfs/dbraw/zinc/02/28/29/394022829.db2.gz QTOOZYPNMROZQW-ZDUSSCGKSA-N 0 3 275.352 2.757 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H](n2cncn2)C1 ZINC000364622235 394223192 /nfs/dbraw/zinc/22/31/92/394223192.db2.gz JTZUYYLMNKPRGM-HIFRSBDPSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@H](n2cncn2)C1 ZINC000364622235 394223199 /nfs/dbraw/zinc/22/31/99/394223199.db2.gz JTZUYYLMNKPRGM-HIFRSBDPSA-N 0 3 286.379 2.772 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCSC[C@H]2C)cc1C ZINC000172513492 394373425 /nfs/dbraw/zinc/37/34/25/394373425.db2.gz IPDTWSNVNZVEGC-GFCCVEGCSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCSC[C@H]2C)cc1C ZINC000172513492 394373427 /nfs/dbraw/zinc/37/34/27/394373427.db2.gz IPDTWSNVNZVEGC-GFCCVEGCSA-N 0 3 251.395 2.946 20 10 CFCDHN COc1cccc([C@H](C)[NH2+]CC[C@@H]2CCCOC2)c1[O-] ZINC000527925212 394426747 /nfs/dbraw/zinc/42/67/47/394426747.db2.gz LIYSLGFHBSXQTO-STQMWFEESA-N 0 3 279.380 2.868 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCn2ccnc2)c([O-])c1 ZINC000020506099 171228410 /nfs/dbraw/zinc/22/84/10/171228410.db2.gz CCVRWVJFWITVSG-CYBMUJFWSA-N 0 3 259.353 2.638 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccccc1[O-] ZINC000035601324 172289838 /nfs/dbraw/zinc/28/98/38/172289838.db2.gz SQUHBMZFXDKRAO-MLGOLLRUSA-N 0 3 257.333 2.776 20 10 CFCDHN Cc1csc(CC[NH2+]Cc2cc(C)ccc2[O-])n1 ZINC000071409385 176156766 /nfs/dbraw/zinc/15/67/66/176156766.db2.gz HCSDTPLVCAKKLJ-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N2CCOCC3(CC3)C2)c1 ZINC000368465235 261318056 /nfs/dbraw/zinc/31/80/56/261318056.db2.gz KAZUDZCBWSYIOC-GFCCVEGCSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCOCC3(CC3)C2)c1 ZINC000368465235 261318057 /nfs/dbraw/zinc/31/80/57/261318057.db2.gz KAZUDZCBWSYIOC-GFCCVEGCSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCOCC3(CC3)C2)c1 ZINC000368465235 261318059 /nfs/dbraw/zinc/31/80/59/261318059.db2.gz KAZUDZCBWSYIOC-GFCCVEGCSA-N 0 3 277.364 2.574 20 10 CFCDHN Oc1ccccc1CNc1ccncc1-c1cccnc1 ZINC000368600279 267190308 /nfs/dbraw/zinc/19/03/08/267190308.db2.gz BLVWSAHNIXLTQY-UHFFFAOYSA-N 0 3 277.327 2.883 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000368593393 267190354 /nfs/dbraw/zinc/19/03/54/267190354.db2.gz SRXDCJYRCIERMZ-CYBMUJFWSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000368593393 267190359 /nfs/dbraw/zinc/19/03/59/267190359.db2.gz SRXDCJYRCIERMZ-CYBMUJFWSA-N 0 3 279.355 2.780 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000368667200 267195809 /nfs/dbraw/zinc/19/58/09/267195809.db2.gz QDGXCLZSISPYTE-DYVFJYSZSA-N 0 3 293.407 2.802 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000368667200 267195812 /nfs/dbraw/zinc/19/58/12/267195812.db2.gz QDGXCLZSISPYTE-DYVFJYSZSA-N 0 3 293.407 2.802 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2cc(OC)ccc2[O-])C1 ZINC000368666401 267195971 /nfs/dbraw/zinc/19/59/71/267195971.db2.gz LOZLFKBQMGXCFB-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2cc(OC)ccc2[O-])C1 ZINC000368666401 267195975 /nfs/dbraw/zinc/19/59/75/267195975.db2.gz LOZLFKBQMGXCFB-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@](CO)(C(C)C)C2)c1[O-] ZINC000368665082 267196194 /nfs/dbraw/zinc/19/61/94/267196194.db2.gz AWFBTGLKSFQMJL-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@](CO)(C(C)C)C2)c1[O-] ZINC000368665082 267196195 /nfs/dbraw/zinc/19/61/95/267196195.db2.gz AWFBTGLKSFQMJL-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H]2CCN(C)[C@H]2C1 ZINC000369930740 267277193 /nfs/dbraw/zinc/27/71/93/267277193.db2.gz OOYBWGVBOWVQER-IMJJTQAJSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H]2CCN(C)[C@H]2C1 ZINC000369930740 267277194 /nfs/dbraw/zinc/27/71/94/267277194.db2.gz OOYBWGVBOWVQER-IMJJTQAJSA-N 0 3 274.408 2.869 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1[O-] ZINC000370725681 267341933 /nfs/dbraw/zinc/34/19/33/267341933.db2.gz UZLDZODBJDPYMB-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1[O-] ZINC000370725681 267341934 /nfs/dbraw/zinc/34/19/34/267341934.db2.gz UZLDZODBJDPYMB-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](c3ccco3)C2)c1[O-] ZINC000371331519 267392300 /nfs/dbraw/zinc/39/23/00/267392300.db2.gz IOEQVJAMUZPOQE-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](c3ccco3)C2)c1[O-] ZINC000371331519 267392303 /nfs/dbraw/zinc/39/23/03/267392303.db2.gz IOEQVJAMUZPOQE-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H](CO)CC(C)C)c1[O-] ZINC000290486734 276379757 /nfs/dbraw/zinc/37/97/57/276379757.db2.gz OIBMHDZBJAEVPV-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H](CO)CC(C)C)c1[O-] ZINC000290486734 276379759 /nfs/dbraw/zinc/37/97/59/276379759.db2.gz OIBMHDZBJAEVPV-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN COC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCO1 ZINC000278623342 277599984 /nfs/dbraw/zinc/59/99/84/277599984.db2.gz CGOIIRWZCWZTSA-XOKHGSTOSA-N 0 3 292.423 2.597 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(F)cc1[O-] ZINC000293670315 288043166 /nfs/dbraw/zinc/04/31/66/288043166.db2.gz MNCRUTDPEHHLFN-RISCZKNCSA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@@H]1CCCCO1 ZINC000294864627 279520744 /nfs/dbraw/zinc/52/07/44/279520744.db2.gz YIMPDWZNAAAGPJ-LNSITVRQSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[C@@H](N[C@H](C)C[S@](C)=O)c1ccc(N(C)C)cc1 ZINC000184297970 280196275 /nfs/dbraw/zinc/19/62/75/280196275.db2.gz XGCCFZBYUUZGNK-PEELUZDISA-N 0 3 282.453 2.560 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@]2(CCCOC2)C1 ZINC000368052471 281025427 /nfs/dbraw/zinc/02/54/27/281025427.db2.gz WDOVNGZKCWIWSH-WBVHZDCISA-N 0 3 291.391 2.725 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@]2(CCCOC2)C1 ZINC000368052471 281025429 /nfs/dbraw/zinc/02/54/29/281025429.db2.gz WDOVNGZKCWIWSH-WBVHZDCISA-N 0 3 291.391 2.725 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c1 ZINC000185368644 301655107 /nfs/dbraw/zinc/65/51/07/301655107.db2.gz WSHQMRZQUVIDCM-STQMWFEESA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1n[nH]cc1C1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000375267559 329002050 /nfs/dbraw/zinc/00/20/50/329002050.db2.gz KFOQFSTWPLBXGL-UHFFFAOYSA-N 0 3 289.354 2.942 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000181965802 329238425 /nfs/dbraw/zinc/23/84/25/329238425.db2.gz KQEFDHLZFSHDOW-BMFZPTHFSA-N 0 3 291.391 2.694 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@]23C[C@H]2COC3(C)C)cc1C ZINC000527767333 330281771 /nfs/dbraw/zinc/28/17/71/330281771.db2.gz UOOSVYICFKEMOH-XJKSGUPXSA-N 0 3 261.365 2.666 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2cccnc2C)c([O-])c1 ZINC000527791509 330283627 /nfs/dbraw/zinc/28/36/27/330283627.db2.gz NPKJINXQNVAKHX-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H]2c3ccccc3C(=O)N2C)c1 ZINC000527804549 330284407 /nfs/dbraw/zinc/28/44/07/330284407.db2.gz FEEHGABFNILJPY-MRXNPFEDSA-N 0 3 296.370 2.617 20 10 CFCDHN CCn1nncc1CN[C@@H](C)c1cc(Cl)cc(C)c1O ZINC000527914074 330294975 /nfs/dbraw/zinc/29/49/75/330294975.db2.gz IRIKMIULQGCTSX-JTQLQIEISA-N 0 3 294.786 2.816 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC23CC(C2)CO3)c2c1c(F)ccc2[O-] ZINC000527983005 330298468 /nfs/dbraw/zinc/29/84/68/330298468.db2.gz RVKGYTDZGXSYQP-IUBWYBMYSA-N 0 3 277.339 2.848 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC23CC(C2)CO3)c([O-])c1C ZINC000527985142 330298580 /nfs/dbraw/zinc/29/85/80/330298580.db2.gz YVGHEKHLTWEIBY-VEAWUBTESA-N 0 3 261.365 2.839 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000230661783 520938291 /nfs/dbraw/zinc/93/82/91/520938291.db2.gz KYVKYNOEUAVQPA-IAQYHMDHSA-N 0 3 267.369 2.603 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000283831297 521192327 /nfs/dbraw/zinc/19/23/27/521192327.db2.gz APHDVMRPPLNQEZ-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN CCC[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000230934517 521294645 /nfs/dbraw/zinc/29/46/45/521294645.db2.gz CRHSSVNAIBKRMP-AWEZNQCLSA-N 0 3 287.787 2.695 20 10 CFCDHN CCOC(CC[NH2+][C@H](C)c1ccccc1[O-])OCC ZINC000276520592 521630102 /nfs/dbraw/zinc/63/01/02/521630102.db2.gz MFLHYJASMGREEH-GFCCVEGCSA-N 0 3 267.369 2.832 20 10 CFCDHN CCC(O)(CC)CC[NH2+]Cc1cc(C)ccc1[O-] ZINC000276276247 521651243 /nfs/dbraw/zinc/65/12/43/521651243.db2.gz VVJPKMMQXWMPQQ-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1cc(F)ccc1[O-] ZINC000290438057 521653627 /nfs/dbraw/zinc/65/36/27/521653627.db2.gz LQQWVYILPSAEEE-UHFFFAOYSA-N 0 3 268.376 2.695 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1cc(F)ccc1[O-] ZINC000290438057 521653630 /nfs/dbraw/zinc/65/36/30/521653630.db2.gz LQQWVYILPSAEEE-UHFFFAOYSA-N 0 3 268.376 2.695 20 10 CFCDHN CC(C)(C)C[C@@H](O)CNCc1ccc2c(c1)CCO2 ZINC000227372761 518681453 /nfs/dbraw/zinc/68/14/53/518681453.db2.gz NDPFNMRRPOPZLJ-CQSZACIVSA-N 0 3 263.381 2.508 20 10 CFCDHN CC(C)OCCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000168882122 519768286 /nfs/dbraw/zinc/76/82/86/519768286.db2.gz ISGDIRAAJSOSEW-ZDUSSCGKSA-N 0 3 250.386 2.828 20 10 CFCDHN CCOCc1cc(CNC[C@H](OC)C2CC2)ccc1OC ZINC000293202133 520186811 /nfs/dbraw/zinc/18/68/11/520186811.db2.gz XTFYSHBIOSSHDO-KRWDZBQOSA-N 0 3 293.407 2.746 20 10 CFCDHN CCCOc1ccc(C[NH+]2CC([C@H]3CCOC3)C2)c([O-])c1 ZINC000366243194 520347683 /nfs/dbraw/zinc/34/76/83/520347683.db2.gz DFIWOZSCQDEUPD-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)[C@H](C)OC)c([O-])c1 ZINC000289846287 520374715 /nfs/dbraw/zinc/37/47/15/520374715.db2.gz PFKIDYNEZNTHJD-NEPJUHHUSA-N 0 3 267.369 2.694 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000279994237 520858555 /nfs/dbraw/zinc/85/85/55/520858555.db2.gz FNHCVLOXAONZDY-CHWSQXEVSA-N 0 3 250.386 2.773 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000280193699 520859216 /nfs/dbraw/zinc/85/92/16/520859216.db2.gz SKIYOOUVFAHEFU-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnn(C)c2)cc1 ZINC000041066176 520909338 /nfs/dbraw/zinc/90/93/38/520909338.db2.gz UHKUVLKLPUJROJ-UHFFFAOYSA-N 0 3 272.396 2.556 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000230661774 520939334 /nfs/dbraw/zinc/93/93/34/520939334.db2.gz KYVKYNOEUAVQPA-XHDPSFHLSA-N 0 3 267.369 2.603 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cccc(C)c1[O-] ZINC000278657057 520958423 /nfs/dbraw/zinc/95/84/23/520958423.db2.gz KDEYCFQKPROYOA-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cccc(C)c1[O-] ZINC000278657057 520958432 /nfs/dbraw/zinc/95/84/32/520958432.db2.gz KDEYCFQKPROYOA-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000245796702 521147946 /nfs/dbraw/zinc/14/79/46/521147946.db2.gz XBWKGILEVKXUTQ-GUYCJALGSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000245796702 521147950 /nfs/dbraw/zinc/14/79/50/521147950.db2.gz XBWKGILEVKXUTQ-GUYCJALGSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C2CCC(CO)CC2)c1[O-] ZINC000290324546 521329628 /nfs/dbraw/zinc/32/96/28/521329628.db2.gz DGKLCILZOHLKBW-UHFFFAOYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C2CCC(CO)CC2)c1[O-] ZINC000290324546 521329637 /nfs/dbraw/zinc/32/96/37/521329637.db2.gz DGKLCILZOHLKBW-UHFFFAOYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@H](C)OC)c1[O-] ZINC000291151951 521333380 /nfs/dbraw/zinc/33/33/80/521333380.db2.gz ZREMRVKWZUKXHR-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@H](C)OC)c1[O-] ZINC000291151951 521333386 /nfs/dbraw/zinc/33/33/86/521333386.db2.gz ZREMRVKWZUKXHR-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1cccc(C[NH2+]CCN2CCCCCC2)c1[O-] ZINC000040767336 521363153 /nfs/dbraw/zinc/36/31/53/521363153.db2.gz FNSGEGUJQJNYFV-UHFFFAOYSA-N 0 3 292.423 2.757 20 10 CFCDHN CCOc1cccc(CNCc2c(C)onc2CC)c1O ZINC000292918183 521364637 /nfs/dbraw/zinc/36/46/37/521364637.db2.gz HYDFUWBQGUXUKS-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN CCN1CCC([NH2+][C@@H](C)c2cc(OC)ccc2[O-])CC1 ZINC000038097931 521579829 /nfs/dbraw/zinc/57/98/29/521579829.db2.gz VPWAYTMGGNMBCM-LBPRGKRZSA-N 0 3 278.396 2.536 20 10 CFCDHN CCCN(CC)CC[NH2+]Cc1cccc(OCC)c1[O-] ZINC000223236187 521608141 /nfs/dbraw/zinc/60/81/41/521608141.db2.gz LBVSDOPFLYISHB-UHFFFAOYSA-N 0 3 280.412 2.612 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618378 521657444 /nfs/dbraw/zinc/65/74/44/521657444.db2.gz YJCKAUZELKKKRD-JTQLQIEISA-N 0 3 255.333 2.733 20 10 CFCDHN CC[C@H](CCO)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000094949417 522142765 /nfs/dbraw/zinc/14/27/65/522142765.db2.gz SBVALKVSFPENMC-QWHCGFSZSA-N 0 3 251.370 2.760 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC000279655603 522536146 /nfs/dbraw/zinc/53/61/46/522536146.db2.gz LDSGPBFQQMJVRP-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC000279655603 522536156 /nfs/dbraw/zinc/53/61/56/522536156.db2.gz LDSGPBFQQMJVRP-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(CN[C@H](C)c2cn[nH]c2)c1O ZINC000230935438 522539633 /nfs/dbraw/zinc/53/96/33/522539633.db2.gz UDMSTFSOZQBHRN-MRVPVSSYSA-N 0 3 281.743 2.628 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](CO)C(C)(C)C)c1[O-] ZINC000194631453 522541135 /nfs/dbraw/zinc/54/11/35/522541135.db2.gz WNEXOUWAKVAIIG-GFCCVEGCSA-N 0 3 287.787 2.551 20 10 CFCDHN CC[C@@H](COC)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228675255 522594983 /nfs/dbraw/zinc/59/49/83/522594983.db2.gz ZRNOBKUXPGGFRR-NSHDSACASA-N 0 3 273.760 2.569 20 10 CFCDHN CC[C@H]([NH2+]CCSCCCO)c1ccc(C)cc1[O-] ZINC000280140110 522597652 /nfs/dbraw/zinc/59/76/52/522597652.db2.gz POQBFCOFJPRUJF-AWEZNQCLSA-N 0 3 283.437 2.857 20 10 CFCDHN CC[C@H]([NH2+]CCc1nc(C)no1)c1ccc(C)cc1[O-] ZINC000280274488 522602055 /nfs/dbraw/zinc/60/20/55/522602055.db2.gz YCHWCUCFFHCUAG-ZDUSSCGKSA-N 0 3 275.352 2.675 20 10 CFCDHN CC[C@H]([NH2+]C[C@@](C)(O)CCOC)c1ccc(C)cc1[O-] ZINC000279926024 522623425 /nfs/dbraw/zinc/62/34/25/522623425.db2.gz AKJKULZIEQILCM-HOCLYGCPSA-N 0 3 281.396 2.529 20 10 CFCDHN CC[C@H]([NH2+]Cc1cnn(C)c1C)c1ccc(C)cc1[O-] ZINC000280146907 522666874 /nfs/dbraw/zinc/66/68/74/522666874.db2.gz PYAGAQJVXUJZIH-HNNXBMFYSA-N 0 3 273.380 2.983 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279996369 522733768 /nfs/dbraw/zinc/73/37/68/522733768.db2.gz FRPXPELQNDZWTK-FMKPAKJESA-N 0 3 293.407 2.935 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@@H]1CCCO1 ZINC000278952732 522760520 /nfs/dbraw/zinc/76/05/20/522760520.db2.gz ZNLPITDMALDRJC-NOLJZWGESA-N 0 3 279.380 2.545 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@H]1CCCO1 ZINC000278952730 522764166 /nfs/dbraw/zinc/76/41/66/522764166.db2.gz ZNLPITDMALDRJC-IVMMDQJWSA-N 0 3 279.380 2.545 20 10 CFCDHN CC[C@@H]([NH2+]CCC(C)(C)O)c1ccc(C)cc1[O-] ZINC000279998016 522824121 /nfs/dbraw/zinc/82/41/21/522824121.db2.gz FTFLIIYIVRLYQI-CYBMUJFWSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@H](C)CO)c1ccccc1[O-] ZINC000229565066 522830931 /nfs/dbraw/zinc/83/09/31/522830931.db2.gz UYPSVIKKMZLJJE-GXTWGEPZSA-N 0 3 251.370 2.842 20 10 CFCDHN CC[C@@H]([NH2+]CCNc1ccccn1)c1ccccc1[O-] ZINC000274966348 522837193 /nfs/dbraw/zinc/83/71/93/522837193.db2.gz XLWHSAOZWMAYAZ-CQSZACIVSA-N 0 3 271.364 2.940 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1cc(F)ccc1F ZINC000264700245 523386042 /nfs/dbraw/zinc/38/60/42/523386042.db2.gz JVJTYMMBRVYPDQ-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1cc(F)ccc1F ZINC000264700245 523386048 /nfs/dbraw/zinc/38/60/48/523386048.db2.gz JVJTYMMBRVYPDQ-MRXNPFEDSA-N 0 3 293.313 2.836 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284050344 523511957 /nfs/dbraw/zinc/51/19/57/523511957.db2.gz KGEQODLTXQETGY-WFASDCNBSA-N 0 3 251.370 2.821 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000191956802 523741058 /nfs/dbraw/zinc/74/10/58/523741058.db2.gz RGJRAKDIFSMWMF-INIZCTEOSA-N 0 3 263.381 2.746 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000191956802 523741066 /nfs/dbraw/zinc/74/10/66/523741066.db2.gz RGJRAKDIFSMWMF-INIZCTEOSA-N 0 3 263.381 2.746 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370474 523993372 /nfs/dbraw/zinc/99/33/72/523993372.db2.gz HKZFWXOYLHTCKT-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370474 523993378 /nfs/dbraw/zinc/99/33/78/523993378.db2.gz HKZFWXOYLHTCKT-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370474 523993380 /nfs/dbraw/zinc/99/33/80/523993380.db2.gz HKZFWXOYLHTCKT-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370474 523993382 /nfs/dbraw/zinc/99/33/82/523993382.db2.gz HKZFWXOYLHTCKT-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CN(C)CCN(C(=O)/C=C/c1ccn(C)c1)c1ccccc1 ZINC000277186735 524058117 /nfs/dbraw/zinc/05/81/17/524058117.db2.gz ZSFPJCDHKMBQAM-MDZDMXLPSA-N 0 3 297.402 2.633 20 10 CFCDHN COc1ccc(CNC[C@H](O)c2ccc(C)o2)cc1C ZINC000265942013 524072009 /nfs/dbraw/zinc/07/20/09/524072009.db2.gz FZUFZLDLBGNGMX-AWEZNQCLSA-N 0 3 275.348 2.728 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)c1[O-] ZINC000291609362 524433522 /nfs/dbraw/zinc/43/35/22/524433522.db2.gz QXODIJHZVYCOLP-IEBWSBKVSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc(C[NH2+]Cc2ccnc(N3CCCC3)c2)c1[O-] ZINC000290076108 524435000 /nfs/dbraw/zinc/43/50/00/524435000.db2.gz GDVORUILXLQIQW-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN Cc1cccc(CNCc2ccnc(N3CCCC3)c2)c1O ZINC000290076108 524435006 /nfs/dbraw/zinc/43/50/06/524435006.db2.gz GDVORUILXLQIQW-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN C[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCC1(F)F ZINC000291507505 524614182 /nfs/dbraw/zinc/61/41/82/524614182.db2.gz HZKMBPQAZGXOOY-VIFPVBQESA-N 0 3 285.290 2.598 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280361671 524736660 /nfs/dbraw/zinc/73/66/60/524736660.db2.gz CUJTVCJNZJGRRA-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280361671 524736669 /nfs/dbraw/zinc/73/66/69/524736669.db2.gz CUJTVCJNZJGRRA-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)[C@H]2[C@@H]2CCCO2)c1 ZINC000291635076 524736964 /nfs/dbraw/zinc/73/69/64/524736964.db2.gz SQRCEOJOFCUALK-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C2CCN(C3CC3)CC2)c1 ZINC000037140948 524759360 /nfs/dbraw/zinc/75/93/60/524759360.db2.gz XZJMOBOMLWGDJD-GFCCVEGCSA-N 0 3 290.407 2.678 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C2CCSCC2)c1 ZINC000168831295 524770405 /nfs/dbraw/zinc/77/04/05/524770405.db2.gz LHTIBGLUQDMDPJ-JTQLQIEISA-N 0 3 267.394 2.947 20 10 CFCDHN C[C@@H](CO)CCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000230669798 524770596 /nfs/dbraw/zinc/77/05/96/524770596.db2.gz OAGZPWSPBNKABN-GHMZBOCLSA-N 0 3 255.333 2.591 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@H]2C2CC2)c1 ZINC000300419267 524774214 /nfs/dbraw/zinc/77/42/14/524774214.db2.gz UVYZMPABNHVEHJ-FSBGKCOPSA-N 0 3 277.364 2.619 20 10 CFCDHN COc1ncccc1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000290126776 525045354 /nfs/dbraw/zinc/04/53/54/525045354.db2.gz JTAKFQDHSITXJL-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN C[C@H]1[C@H]([NH+]2CCCC2)CCN1Cc1cc(F)ccc1[O-] ZINC000289753921 525106703 /nfs/dbraw/zinc/10/67/03/525106703.db2.gz JILKAPUBDSBNHK-SWLSCSKDSA-N 0 3 278.371 2.590 20 10 CFCDHN Cc1cc(O)c(CN2CCN(C3CCC3)CC2)cc1C ZINC000264948378 525314306 /nfs/dbraw/zinc/31/43/06/525314306.db2.gz KIEMBRZWFOULBR-UHFFFAOYSA-N 0 3 274.408 2.679 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H]2CCN(C)C[C@H]2C)cc1C ZINC000290553849 525316064 /nfs/dbraw/zinc/31/60/64/525316064.db2.gz RYWONLUKQNHJLY-ZBFHGGJFSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H]2CCN(C)C[C@H]2C)cc1C ZINC000290553849 525316068 /nfs/dbraw/zinc/31/60/68/525316068.db2.gz RYWONLUKQNHJLY-ZBFHGGJFSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H](CO)CC(C)C)c1 ZINC000290639693 525338111 /nfs/dbraw/zinc/33/81/11/525338111.db2.gz YKRZITJFNQGXGX-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H](CO)CC(C)C)c1 ZINC000290639693 525338117 /nfs/dbraw/zinc/33/81/17/525338117.db2.gz YKRZITJFNQGXGX-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@H](C3CC3)O[C@@H](C)C2)c1 ZINC000279773622 525347535 /nfs/dbraw/zinc/34/75/35/525347535.db2.gz ALORZYAJJPFSEF-LRDDRELGSA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000289776070 525349918 /nfs/dbraw/zinc/34/99/18/525349918.db2.gz JEXCCMARBUQSGI-HKUYNNGSSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c1 ZINC000281067641 525359317 /nfs/dbraw/zinc/35/93/17/525359317.db2.gz NWHPFXFGRXRAQK-CWTRNNRKSA-N 0 3 281.421 2.652 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1cccc(F)c1)c1ccccc1[O-] ZINC000154113254 525381860 /nfs/dbraw/zinc/38/18/60/525381860.db2.gz YCSABGWJOJRIMA-MEDUHNTESA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]([NH2+]CCC[C@H](C)CO)c1cc(F)ccc1[O-] ZINC000230669801 525441424 /nfs/dbraw/zinc/44/14/24/525441424.db2.gz OAGZPWSPBNKABN-WDEREUQCSA-N 0 3 255.333 2.591 20 10 CFCDHN C[C@@H]([NH2+]CCOc1ncccc1F)c1ccccc1[O-] ZINC000272881211 525454439 /nfs/dbraw/zinc/45/44/39/525454439.db2.gz QNEHIPQKNXQCMG-LLVKDONJSA-N 0 3 276.311 2.656 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1ccccc1[O-] ZINC000272916027 525486668 /nfs/dbraw/zinc/48/66/68/525486668.db2.gz XKNQTHRQQHXAKC-CHWSQXEVSA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@@H](NCc1cc2c(cc1O)OCO2)c1cccc(O)c1 ZINC000042880067 525516086 /nfs/dbraw/zinc/51/60/86/525516086.db2.gz FGIYZLSGMZMZTJ-SNVBAGLBSA-N 0 3 287.315 2.677 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000063218347 525594695 /nfs/dbraw/zinc/59/46/95/525594695.db2.gz WKBDAXLPXPZJCP-ZFWWWQNUSA-N 0 3 271.360 2.646 20 10 CFCDHN C[C@@H](N[C@@H](C)c1cnn(C)c1)c1ccc(N(C)C)cc1 ZINC000163860842 525622733 /nfs/dbraw/zinc/62/27/33/525622733.db2.gz KZMNWSVTOKCYIP-OLZOCXBDSA-N 0 3 272.396 2.898 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC[C@@H]2CCCO2)c([O-])c1 ZINC000020146914 525725994 /nfs/dbraw/zinc/72/59/94/525725994.db2.gz SGXHEXYEMCGHHS-CABCVRRESA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2)c([O-])c1 ZINC000273462962 525747549 /nfs/dbraw/zinc/74/75/49/525747549.db2.gz DCUMPTLFJAZLMG-VXGBXAGGSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)n(C)c2=O)c([O-])c1 ZINC000279400814 525927852 /nfs/dbraw/zinc/92/78/52/525927852.db2.gz CUAYYFKRUWIGBC-ZDUSSCGKSA-N 0 3 286.375 2.559 20 10 CFCDHN COc1cccc(CN2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c1O ZINC000291665689 525931422 /nfs/dbraw/zinc/93/14/22/525931422.db2.gz VSHZDKQTZYXCOQ-HOCLYGCPSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cccc(O)c2)c1O ZINC000037151485 526032598 /nfs/dbraw/zinc/03/25/98/526032598.db2.gz UWMQUPSKQZDVGM-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@H]1c1ccncc1)OCO2 ZINC000289849421 526335197 /nfs/dbraw/zinc/33/51/97/526335197.db2.gz PYBHOKKNOOFGDN-AWEZNQCLSA-N 0 3 298.342 2.853 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CC=CCC1)OCO2 ZINC000045629330 526336226 /nfs/dbraw/zinc/33/62/26/526336226.db2.gz QKJXGFVYHOASLO-LLVKDONJSA-N 0 3 261.321 2.567 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000226564528 526348078 /nfs/dbraw/zinc/34/80/78/526348078.db2.gz MKLMSFSEQIXXES-OAHLLOKOSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000245980255 526348870 /nfs/dbraw/zinc/34/88/70/526348870.db2.gz PHBQOTYFAVJCKY-XHDPSFHLSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000245980255 526348875 /nfs/dbraw/zinc/34/88/75/526348875.db2.gz PHBQOTYFAVJCKY-XHDPSFHLSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOC1CCCCC1 ZINC000226587689 526349063 /nfs/dbraw/zinc/34/90/63/526349063.db2.gz CKHJEUIKXZFMSX-UHFFFAOYSA-N 0 3 267.344 2.970 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000366052745 526350299 /nfs/dbraw/zinc/35/02/99/526350299.db2.gz UJEOSTRERHQOLD-OAHLLOKOSA-N 0 3 288.322 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000366052745 526350301 /nfs/dbraw/zinc/35/03/01/526350301.db2.gz UJEOSTRERHQOLD-OAHLLOKOSA-N 0 3 288.322 2.580 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000157729101 526374379 /nfs/dbraw/zinc/37/43/79/526374379.db2.gz BPLUPMRKVZETRD-AWEZNQCLSA-N 0 3 293.432 2.927 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000067011266 526374489 /nfs/dbraw/zinc/37/44/89/526374489.db2.gz QETBARIWYXEQNH-UHFFFAOYSA-N 0 3 285.343 2.843 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618494 527637235 /nfs/dbraw/zinc/63/72/35/527637235.db2.gz STFYEUMORPXQQA-VIFPVBQESA-N 0 3 277.343 2.732 20 10 CFCDHN COc1cccc(C[NH2+]CCCC(=O)OC(C)(C)C)c1[O-] ZINC000744449885 574074822 /nfs/dbraw/zinc/07/48/22/574074822.db2.gz GWTKDGGHQWNMOV-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN C[C@H]1C[C@H]1CN(C)c1ccc(OCCN(C)C)cc1 ZINC000754147656 574077804 /nfs/dbraw/zinc/07/78/04/574077804.db2.gz DMUZTYVHOLEACN-KBPBESRZSA-N 0 3 262.397 2.719 20 10 CFCDHN CC1CCN(c2ccc(CNCc3cn[nH]c3)cc2)CC1 ZINC000731041477 574107370 /nfs/dbraw/zinc/10/73/70/574107370.db2.gz AXTZBIPLDXCIND-UHFFFAOYSA-N 0 3 284.407 2.936 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)COCC(C)C)c([O-])c1C ZINC000756460776 574118812 /nfs/dbraw/zinc/11/88/12/574118812.db2.gz SWBBGUKYDYBCMD-HUUCEWRRSA-N 0 3 295.423 2.693 20 10 CFCDHN C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc([O-])cs2)C1 ZINC000731870609 574131239 /nfs/dbraw/zinc/13/12/39/574131239.db2.gz RTFXZJWXGGLFIE-NSHDSACASA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([O-])cs2)C1 ZINC000731870609 574131241 /nfs/dbraw/zinc/13/12/41/574131241.db2.gz RTFXZJWXGGLFIE-NSHDSACASA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@H]1CCCN(C(C)(C)CNC(=O)C2=CC(=O)CS2)C1 ZINC000731870609 574131243 /nfs/dbraw/zinc/13/12/43/574131243.db2.gz RTFXZJWXGGLFIE-NSHDSACASA-N 0 3 296.436 2.694 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000732284732 574150141 /nfs/dbraw/zinc/15/01/41/574150141.db2.gz AKJGVARXRPVUME-GFCCVEGCSA-N 0 3 294.420 2.544 20 10 CFCDHN Cc1cc(CN(C)c2ccc(OCCN(C)C)cc2)on1 ZINC000732411233 574156550 /nfs/dbraw/zinc/15/65/50/574156550.db2.gz WWAPQAMWKQNIFP-UHFFFAOYSA-N 0 3 289.379 2.560 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1c([O-])cccc1OC ZINC000738435655 574168884 /nfs/dbraw/zinc/16/88/84/574168884.db2.gz IIPHEXMPGHAQAF-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCS[C@H](C)CC1 ZINC000756147235 574214131 /nfs/dbraw/zinc/21/41/31/574214131.db2.gz PEPDXSUNZLSZBF-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCS[C@H](C)CC1 ZINC000756147235 574214132 /nfs/dbraw/zinc/21/41/32/574214132.db2.gz PEPDXSUNZLSZBF-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COCCC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756342811 574227004 /nfs/dbraw/zinc/22/70/04/574227004.db2.gz LFYGXSRACOJJSQ-GXSJLCMTSA-N 0 3 253.317 2.706 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)Cc2cccc(O)c2)c1[O-] ZINC000729681083 574227831 /nfs/dbraw/zinc/22/78/31/574227831.db2.gz SGSJHYMZFGZEHU-LBPRGKRZSA-N 0 3 287.359 2.827 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccco2)c([O-])c1C ZINC000756383304 574231811 /nfs/dbraw/zinc/23/18/11/574231811.db2.gz XKQMNOCLZLEBEZ-JSGCOSHPSA-N 0 3 275.348 2.986 20 10 CFCDHN CC(C)NC(=O)CC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756395177 574233547 /nfs/dbraw/zinc/23/35/47/574233547.db2.gz HREKQDWGPVTKEX-JQWIXIFHSA-N 0 3 294.370 2.584 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000756449963 574237863 /nfs/dbraw/zinc/23/78/63/574237863.db2.gz PTFPWSDRPATPER-GTNGPMTGSA-N 0 3 293.260 2.592 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(C)C2)c([O-])c1C ZINC000756443800 574238149 /nfs/dbraw/zinc/23/81/49/574238149.db2.gz IWSYQMXHVPLUHS-KGLIPLIRSA-N 0 3 262.397 2.754 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756457157 574238702 /nfs/dbraw/zinc/23/87/02/574238702.db2.gz HFWDBSYYANGGFS-CMPLNLGQSA-N 0 3 294.370 2.586 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)Cc2cnccn2)c1 ZINC000756496093 574241674 /nfs/dbraw/zinc/24/16/74/574241674.db2.gz UXXNBKHGDHHACS-OLZOCXBDSA-N 0 3 271.364 2.772 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2cnccn2)c([O-])c1 ZINC000756497036 574241734 /nfs/dbraw/zinc/24/17/34/574241734.db2.gz ZYGQWVNKUWWHLR-OLZOCXBDSA-N 0 3 271.364 2.772 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756508303 574242669 /nfs/dbraw/zinc/24/26/69/574242669.db2.gz HNJJJAVSPHUYAU-MFKMUULPSA-N 0 3 289.354 2.874 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C3CC3)C2)c2c1c(F)ccc2[O-] ZINC000756532804 574244103 /nfs/dbraw/zinc/24/41/03/574244103.db2.gz GJMNDPWVOWNPIS-GYSYKLTISA-N 0 3 290.382 2.906 20 10 CFCDHN C[C@H]([NH2+]CC1CCN(C)CC1)c1cc(F)cc(F)c1[O-] ZINC000756547262 574245542 /nfs/dbraw/zinc/24/55/42/574245542.db2.gz XGIMEIFUALKMHZ-JTQLQIEISA-N 0 3 284.350 2.663 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN(C)CC(F)(F)F)c([O-])c1 ZINC000756569506 574248681 /nfs/dbraw/zinc/24/86/81/574248681.db2.gz PTBQSXGZBGSUNE-LLVKDONJSA-N 0 3 290.329 2.845 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC2(C)COC2)c2c1c(F)ccc2[O-] ZINC000756570576 574248910 /nfs/dbraw/zinc/24/89/10/574248910.db2.gz ALLSPWMTQOTDLR-ONGXEEELSA-N 0 3 265.328 2.706 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CCC[C@@H]2C)c([O-])c1 ZINC000756616101 574252599 /nfs/dbraw/zinc/25/25/99/574252599.db2.gz IAPANBPVDJTSSR-UONOGXRCSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(=O)NC(C)(C)C)c([O-])c1C ZINC000756683339 574257679 /nfs/dbraw/zinc/25/76/79/574257679.db2.gz MFZMFRVXKLNILC-CYBMUJFWSA-N 0 3 292.423 2.964 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H](CCO)C2CC2)c2c1c(F)ccc2[O-] ZINC000756740139 574259862 /nfs/dbraw/zinc/25/98/62/574259862.db2.gz PXHVFKJLHXZZIY-OASPWFOLSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1n[nH]cc1CN[C@@H](C)c1ccc(C)c(C)c1O ZINC000756740335 574260454 /nfs/dbraw/zinc/26/04/54/574260454.db2.gz QSIKVCVNFJUXAH-LBPRGKRZSA-N 0 3 259.353 2.891 20 10 CFCDHN COc1cccc(CNCc2c[nH]nc2C(C)(C)C)c1O ZINC000733900988 574261182 /nfs/dbraw/zinc/26/11/82/574261182.db2.gz VOCHJTKVHZMZDL-UHFFFAOYSA-N 0 3 289.379 2.711 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCC[C@H]2OC)c1 ZINC000756787086 574262736 /nfs/dbraw/zinc/26/27/36/574262736.db2.gz OHJZRMPXHAKNFX-HWWQOWPSSA-N 0 3 279.380 2.867 20 10 CFCDHN C[C@H]([NH2+]CCc1ccc(CO)cc1)c1cc(F)ccc1[O-] ZINC000756790760 574263248 /nfs/dbraw/zinc/26/32/48/574263248.db2.gz PDDFODZLEXITBY-LBPRGKRZSA-N 0 3 289.350 2.917 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C(F)(F)F ZINC000756834291 574266154 /nfs/dbraw/zinc/26/61/54/574266154.db2.gz DTLMWUNPIFKFFY-CPCISQLKSA-N 0 3 281.249 2.759 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@@H](CO)C1CC1 ZINC000734160762 574277760 /nfs/dbraw/zinc/27/77/60/574277760.db2.gz GSKGUESUYOCSFF-KRWDZBQOSA-N 0 3 283.371 2.920 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@H](O)C1CC1 ZINC000734843784 574303669 /nfs/dbraw/zinc/30/36/69/574303669.db2.gz BXLNXMUNHXIGME-SFHVURJKSA-N 0 3 283.371 2.920 20 10 CFCDHN CC[C@@H](C[C@H](C)CO)[NH2+]Cc1cc(C)ccc1[O-] ZINC000743499675 574307427 /nfs/dbraw/zinc/30/74/27/574307427.db2.gz OHWIPFHDPWJLOU-JSGCOSHPSA-N 0 3 251.370 2.587 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H](CC)C[C@@H](C)CO)c1 ZINC000743499711 574367078 /nfs/dbraw/zinc/36/70/78/574367078.db2.gz PPKHCUHAMWYICU-OCCSQVGLSA-N 0 3 281.396 2.678 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000753575669 574405162 /nfs/dbraw/zinc/40/51/62/574405162.db2.gz LSIXUBOOFRBLON-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN CC(C)[C@H](CO)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806170258 617816628 /nfs/dbraw/zinc/81/66/28/617816628.db2.gz YMBVSEGXMOINSQ-NTZNESFSSA-N 0 3 281.371 2.934 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)C(OC)OC)cc1 ZINC000079607612 617999258 /nfs/dbraw/zinc/99/92/58/617999258.db2.gz SDXRUNTXMQLGIZ-CYBMUJFWSA-N 0 3 280.412 2.630 20 10 CFCDHN Cc1noc2ncc(CN(C)Cc3ccccc3O)cc12 ZINC000893961391 618248357 /nfs/dbraw/zinc/24/83/57/618248357.db2.gz FZULKLWVTWFXNF-UHFFFAOYSA-N 0 3 283.331 2.869 20 10 CFCDHN COc1cc(CN2CCSC[C@H]2C)c(O)cc1C ZINC000179444637 618276088 /nfs/dbraw/zinc/27/60/88/618276088.db2.gz MDCBIGYTEHSFHP-LLVKDONJSA-N 0 3 267.394 2.647 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])C2(CCCCC2)C1 ZINC000179584981 618328162 /nfs/dbraw/zinc/32/81/62/618328162.db2.gz NIWKPYAPGOITJH-UHFFFAOYSA-N 0 3 274.408 2.843 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])C2(CCCCC2)C1 ZINC000179584981 618328168 /nfs/dbraw/zinc/32/81/68/618328168.db2.gz NIWKPYAPGOITJH-UHFFFAOYSA-N 0 3 274.408 2.843 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC(C)(C)F)c1[O-] ZINC000877662962 618453457 /nfs/dbraw/zinc/45/34/57/618453457.db2.gz AVIMEECLIIPGKE-UHFFFAOYSA-N 0 3 261.724 2.892 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCO)CSC)c1ccc(C)cc1[O-] ZINC000794802385 618456609 /nfs/dbraw/zinc/45/66/09/618456609.db2.gz NMPVZABVRSKVQU-TZMCWYRMSA-N 0 3 283.437 2.855 20 10 CFCDHN CC(=O)Nc1cccc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000236577889 618651303 /nfs/dbraw/zinc/65/13/03/618651303.db2.gz IYXOMUNQBDXBFQ-UHFFFAOYSA-N 0 3 270.332 2.640 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCN(CC3CC3)C2)c(Cl)c1 ZINC000840896524 618813704 /nfs/dbraw/zinc/81/37/04/618813704.db2.gz IGWJEUZXYQPWNN-ZDUSSCGKSA-N 0 3 294.826 2.928 20 10 CFCDHN CN(Cc1ccccc1O)C(=O)[C@H](N)CC1CCCCC1 ZINC000314578729 618849788 /nfs/dbraw/zinc/84/97/88/618849788.db2.gz VQRNZTQVWAPFLC-OAHLLOKOSA-N 0 3 290.407 2.648 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(CO)CCCC1)CC2 ZINC000312109288 618876324 /nfs/dbraw/zinc/87/63/24/618876324.db2.gz YFQHNHRHXSULKA-ZDUSSCGKSA-N 0 3 261.365 2.522 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(NC(N)=O)cc1)c1ccccc1[O-] ZINC000183405668 618905718 /nfs/dbraw/zinc/90/57/18/618905718.db2.gz QTUAFFWVLRYHOU-LLVKDONJSA-N 0 3 285.347 2.734 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc(CO)cc1)CC2 ZINC000312857317 618957728 /nfs/dbraw/zinc/95/77/28/618957728.db2.gz RFKLGEYFDNPHRQ-OAHLLOKOSA-N 0 3 269.344 2.662 20 10 CFCDHN CC(C)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000005097742 619085798 /nfs/dbraw/zinc/08/57/98/619085798.db2.gz QHTWBDPAELAJTG-INIZCTEOSA-N 0 3 291.439 2.518 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCOC12CCCCC2 ZINC000924901013 619270517 /nfs/dbraw/zinc/27/05/17/619270517.db2.gz GJVSNYCFSOWUEU-HNNXBMFYSA-N 0 3 261.365 2.974 20 10 CFCDHN COc1ccc(CN[C@H]2CCc3cccnc32)c(O)c1 ZINC000894636490 619433736 /nfs/dbraw/zinc/43/37/36/619433736.db2.gz KVMFXODADBSTKA-AWEZNQCLSA-N 0 3 270.332 2.573 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCc3cccnc32)c([O-])c1 ZINC000894636490 619433737 /nfs/dbraw/zinc/43/37/37/619433737.db2.gz KVMFXODADBSTKA-AWEZNQCLSA-N 0 3 270.332 2.573 20 10 CFCDHN COC(=O)[C@H](C[NH2+]Cc1c(C)cccc1[O-])CC(C)C ZINC000894790273 619464633 /nfs/dbraw/zinc/46/46/33/619464633.db2.gz IEEHOLGBUVHANG-ZDUSSCGKSA-N 0 3 279.380 2.626 20 10 CFCDHN CC(=O)Nc1cccc(CNCc2ccc3c(c2)CCO3)c1 ZINC000054175015 619471657 /nfs/dbraw/zinc/47/16/57/619471657.db2.gz DOPYQYNFWUGIKQ-UHFFFAOYSA-N 0 3 296.370 2.870 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H](CF)C2)cc1F ZINC000895573583 619557275 /nfs/dbraw/zinc/55/72/75/619557275.db2.gz PIXOJUBNBADHOF-LBPRGKRZSA-N 0 3 254.324 2.683 20 10 CFCDHN CN(C)CCN(C(=O)Nc1ccc(N)cc1)C1CCCC1 ZINC000841300893 619560163 /nfs/dbraw/zinc/56/01/63/619560163.db2.gz VWBHCVHMZPCYDO-UHFFFAOYSA-N 0 3 290.411 2.607 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895584078 619560633 /nfs/dbraw/zinc/56/06/33/619560633.db2.gz PBQOLGZYNZLAMH-NSHDSACASA-N 0 3 290.388 2.847 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895584078 619560635 /nfs/dbraw/zinc/56/06/35/619560635.db2.gz PBQOLGZYNZLAMH-NSHDSACASA-N 0 3 290.388 2.847 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1C[C@@H]2C[C@]2(O)C1 ZINC000895649222 619573152 /nfs/dbraw/zinc/57/31/52/619573152.db2.gz OVRGSTLTOOFGGT-WMZOPIPTSA-N 0 3 281.355 2.626 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@@H]2C[C@]2(O)C1 ZINC000895649222 619573154 /nfs/dbraw/zinc/57/31/54/619573154.db2.gz OVRGSTLTOOFGGT-WMZOPIPTSA-N 0 3 281.355 2.626 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895845775 619621265 /nfs/dbraw/zinc/62/12/65/619621265.db2.gz IZXNGQJOKZODDL-ABAIWWIYSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895845775 619621266 /nfs/dbraw/zinc/62/12/66/619621266.db2.gz IZXNGQJOKZODDL-ABAIWWIYSA-N 0 3 265.328 2.532 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895847803 619621697 /nfs/dbraw/zinc/62/16/97/619621697.db2.gz VUBPYPNSZPTXRS-RHSMWYFYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895847803 619621699 /nfs/dbraw/zinc/62/16/99/619621699.db2.gz VUBPYPNSZPTXRS-RHSMWYFYSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCC2(C[C@@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852382 619622720 /nfs/dbraw/zinc/62/27/20/619622720.db2.gz UNBQSIFPHWOVEO-KWCYVHTRSA-N 0 3 295.354 2.677 20 10 CFCDHN COCCOc1ccc(CN[C@@H](C)c2ccccc2O)o1 ZINC000895852234 619622843 /nfs/dbraw/zinc/62/28/43/619622843.db2.gz SAYBXYIUAXWZQT-LBPRGKRZSA-N 0 3 291.347 2.861 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC(C)(C)CC[C@H]2CO)c([O-])c1 ZINC000895925351 619635774 /nfs/dbraw/zinc/63/57/74/619635774.db2.gz XGHMYUPTGFQAFZ-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CC(C)(C)CC[C@H]2CO)c([O-])c1 ZINC000895925351 619635776 /nfs/dbraw/zinc/63/57/76/619635776.db2.gz XGHMYUPTGFQAFZ-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H](OC)CC[C@@H]2C)c([O-])c1 ZINC000895947005 619639016 /nfs/dbraw/zinc/63/90/16/619639016.db2.gz ZWDDRORHNMOYRF-WFASDCNBSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H](OC)CC[C@@H]2C)c([O-])c1 ZINC000895947005 619639018 /nfs/dbraw/zinc/63/90/18/619639018.db2.gz ZWDDRORHNMOYRF-WFASDCNBSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)CCO1 ZINC000896577438 619765328 /nfs/dbraw/zinc/76/53/28/619765328.db2.gz LHGJEZMNQUJCKP-MBVDDHJVSA-N 0 3 274.408 2.877 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC000896798654 619821234 /nfs/dbraw/zinc/82/12/34/619821234.db2.gz OOWVAAQRBRDCOZ-IRXDYDNUSA-N 0 3 280.371 2.855 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC000896798654 619821235 /nfs/dbraw/zinc/82/12/35/619821235.db2.gz OOWVAAQRBRDCOZ-IRXDYDNUSA-N 0 3 280.371 2.855 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC000897387123 620089702 /nfs/dbraw/zinc/08/97/02/620089702.db2.gz GPVDVSYJOVYTNS-AWEZNQCLSA-N 0 3 265.328 2.723 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000897505633 620195739 /nfs/dbraw/zinc/19/57/39/620195739.db2.gz MWBCJJLOEGLBSP-BBRMVZONSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+]C2CC3(C2)CO[C@H](C)C3)c([O-])c1 ZINC000897772644 620279415 /nfs/dbraw/zinc/27/94/15/620279415.db2.gz AIJWZCATHJXVGJ-XEBKBJJBSA-N 0 3 261.365 2.748 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@H](CC)c1ccccc1[O-] ZINC000927015574 620439309 /nfs/dbraw/zinc/43/93/09/620439309.db2.gz GCMDMSYHUJPFIS-TZMCWYRMSA-N 0 3 251.370 2.984 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000927015572 620439476 /nfs/dbraw/zinc/43/94/76/620439476.db2.gz GCMDMSYHUJPFIS-OCCSQVGLSA-N 0 3 251.370 2.984 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@@H](C)c2cc(F)ccc2[O-])nc1 ZINC000927073101 620448869 /nfs/dbraw/zinc/44/88/69/620448869.db2.gz IPFVVPZHSVVNJV-LBPRGKRZSA-N 0 3 289.354 2.997 20 10 CFCDHN CC[C@H](N[C@H]1C[NH2+]CC1(C)C)c1ccc(F)cc1[O-] ZINC000902445262 621082960 /nfs/dbraw/zinc/08/29/60/621082960.db2.gz PQDFLKDYXWTKCV-JSGCOSHPSA-N 0 3 266.360 2.570 20 10 CFCDHN CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cccc(Cl)c1[O-] ZINC000902464408 621097916 /nfs/dbraw/zinc/09/79/16/621097916.db2.gz CENQQXRZQLGOPF-WBMYTEFPSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1N2)c1cccc(Cl)c1[O-] ZINC000902464408 621097919 /nfs/dbraw/zinc/09/79/19/621097919.db2.gz CENQQXRZQLGOPF-WBMYTEFPSA-N 0 3 280.799 2.979 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC(CC(N)=O)C2)c1[O-] ZINC000903255181 621300532 /nfs/dbraw/zinc/30/05/32/621300532.db2.gz XVBNARUABUBJMR-GRZMOONWSA-N 0 3 296.798 2.659 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c([O-])c1 ZINC000903288439 621319476 /nfs/dbraw/zinc/31/94/76/621319476.db2.gz YAANEFUSFUFKME-KDPNGRSJSA-N 0 3 259.349 2.527 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCOC12CCOCC2)c1cc(F)ccc1[O-] ZINC000903389483 621359884 /nfs/dbraw/zinc/35/98/84/621359884.db2.gz LWYNEDJWTPMWJQ-NHYWBVRUSA-N 0 3 295.354 2.520 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COC[C@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000903438632 621375274 /nfs/dbraw/zinc/37/52/74/621375274.db2.gz WEKMTAWHHJRLLM-QCZZGDTMSA-N 0 3 265.328 2.607 20 10 CFCDHN CNC(=O)c1cccc(CC[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000183525213 625514500 /nfs/dbraw/zinc/51/45/00/625514500.db2.gz MBQJPWMJYREZRD-CYBMUJFWSA-N 0 3 298.386 2.645 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1ccccc1[O-] ZINC000183615262 625521291 /nfs/dbraw/zinc/52/12/91/625521291.db2.gz UJVGNIAUWGMMDR-FKIZINRSSA-N 0 3 289.400 2.980 20 10 CFCDHN COc1cc(C)ccc1C[NH2+]Cc1ccccc1[O-] ZINC000151038038 622816446 /nfs/dbraw/zinc/81/64/46/622816446.db2.gz BGCFTFJNUWQQIZ-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000045691064 623012963 /nfs/dbraw/zinc/01/29/63/623012963.db2.gz LSBLTJCQVIXVFD-STQMWFEESA-N 0 3 250.386 2.773 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000157652010 623043940 /nfs/dbraw/zinc/04/39/40/623043940.db2.gz VVICQYPDAIUQFK-GMXVVIOVSA-N 0 3 266.360 2.665 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@H](C)C2)c([O-])c1 ZINC000157750049 623056486 /nfs/dbraw/zinc/05/64/86/623056486.db2.gz FNYJZEBOAYAFNF-RDBSUJKOSA-N 0 3 262.397 2.834 20 10 CFCDHN COc1ccc(CNCc2ccc(CO)cc2)cc1C ZINC000227461858 623110446 /nfs/dbraw/zinc/11/04/46/623110446.db2.gz DGUPXVNUXHOTAB-UHFFFAOYSA-N 0 3 271.360 2.786 20 10 CFCDHN C[N@@H+]1C[C@@H]2CCCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000822520573 623119832 /nfs/dbraw/zinc/11/98/32/623119832.db2.gz HHNJMMXCIILERY-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1C[C@@H]2CCCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000822520573 623119834 /nfs/dbraw/zinc/11/98/34/623119834.db2.gz HHNJMMXCIILERY-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1=O)c1ccccc1[O-] ZINC000822817904 623181112 /nfs/dbraw/zinc/18/11/12/623181112.db2.gz BLABQQOMUBETAN-ZIAGYGMSSA-N 0 3 290.407 2.832 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@H](N2CC=CC2)C1 ZINC000172932800 623322383 /nfs/dbraw/zinc/32/23/83/623322383.db2.gz MSDYNJIYEDGRRV-INIZCTEOSA-N 0 3 294.398 2.992 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@H](N2CC=CC2)C1 ZINC000172932800 623322390 /nfs/dbraw/zinc/32/23/90/623322390.db2.gz MSDYNJIYEDGRRV-INIZCTEOSA-N 0 3 294.398 2.992 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](SC)C2)c([O-])c1 ZINC000824683556 623544790 /nfs/dbraw/zinc/54/47/90/623544790.db2.gz PFXYHBLICVQBNZ-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](SC)C2)c([O-])c1 ZINC000824683556 623544792 /nfs/dbraw/zinc/54/47/92/623544792.db2.gz PFXYHBLICVQBNZ-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C2(CF)CCOCC2)c1[O-] ZINC000824690859 623545466 /nfs/dbraw/zinc/54/54/66/623545466.db2.gz OFMFMFRYJOHISS-UHFFFAOYSA-N 0 3 287.762 2.962 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C(C)C)[C@H](CO)C(C)C ZINC000824846418 623576037 /nfs/dbraw/zinc/57/60/37/623576037.db2.gz RRARTVHYPHUQRM-PBHICJAKSA-N 0 3 295.423 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825133855 623637890 /nfs/dbraw/zinc/63/78/90/623637890.db2.gz NEWXGPQUVMUQII-OAHLLOKOSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825133855 623637892 /nfs/dbraw/zinc/63/78/92/623637892.db2.gz NEWXGPQUVMUQII-OAHLLOKOSA-N 0 3 265.328 2.534 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)NC ZINC000825316063 623670035 /nfs/dbraw/zinc/67/00/35/623670035.db2.gz JSNLLJGECVGYAM-INIZCTEOSA-N 0 3 298.386 2.673 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CC[C@H](CO)CC2)c1[O-] ZINC000761215276 623723739 /nfs/dbraw/zinc/72/37/39/623723739.db2.gz IWKYVFUBWYVLSS-MJHDQNEOSA-N 0 3 299.798 2.695 20 10 CFCDHN Cc1cccc(CNCc2cccnc2N2CCCC2)c1O ZINC000826898816 623905651 /nfs/dbraw/zinc/90/56/51/623905651.db2.gz AHQKTFIIZXYXFE-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN C[NH+](C)CCN(C(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000827260229 623977157 /nfs/dbraw/zinc/97/71/57/623977157.db2.gz LYYSAOUNQZLQSZ-UHFFFAOYSA-N 0 3 296.436 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3COC[C@]3(C)C2)c1[O-] ZINC000827284702 623980881 /nfs/dbraw/zinc/98/08/81/623980881.db2.gz VNJGMXUTPUWCPH-ABAIWWIYSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1[O-] ZINC000827284702 623980888 /nfs/dbraw/zinc/98/08/88/623980888.db2.gz VNJGMXUTPUWCPH-ABAIWWIYSA-N 0 3 297.782 2.523 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000827370267 623994999 /nfs/dbraw/zinc/99/49/99/623994999.db2.gz DBZDVQRXQNDNLK-OLZOCXBDSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000827370267 623995000 /nfs/dbraw/zinc/99/50/00/623995000.db2.gz DBZDVQRXQNDNLK-OLZOCXBDSA-N 0 3 279.380 2.790 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(c2ccon2)CC1 ZINC000827630004 624048739 /nfs/dbraw/zinc/04/87/39/624048739.db2.gz SMVOYPZMTMFZLL-UHFFFAOYSA-N 0 3 276.311 2.899 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC1(O)CCC(F)(F)CC1 ZINC000827649749 624051953 /nfs/dbraw/zinc/05/19/53/624051953.db2.gz KLMPEMMHXBROIH-UHFFFAOYSA-N 0 3 289.297 2.561 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827698924 624069611 /nfs/dbraw/zinc/06/96/11/624069611.db2.gz CXWAQPNGZCYDAT-BONVTDFDSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827698924 624069615 /nfs/dbraw/zinc/06/96/15/624069615.db2.gz CXWAQPNGZCYDAT-BONVTDFDSA-N 0 3 299.798 2.505 20 10 CFCDHN CN(C)c1ccc(C[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000834507906 625696536 /nfs/dbraw/zinc/69/65/36/625696536.db2.gz GDHGIYJWQPKCOE-AWEZNQCLSA-N 0 3 283.375 2.630 20 10 CFCDHN [O-]c1c(F)cccc1C[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000827947645 624136024 /nfs/dbraw/zinc/13/60/24/624136024.db2.gz ALROBHXEFWNXPS-CQSZACIVSA-N 0 3 292.398 2.743 20 10 CFCDHN Cc1cccc(CC[N@@H+](C)Cc2ccccc2[O-])n1 ZINC000828062784 624164051 /nfs/dbraw/zinc/16/40/51/624164051.db2.gz RWFZJDGOMXKJJK-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc(CC[N@H+](C)Cc2ccccc2[O-])n1 ZINC000828062784 624164055 /nfs/dbraw/zinc/16/40/55/624164055.db2.gz RWFZJDGOMXKJJK-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCN(CC(F)F)CC1)CC2 ZINC000834548035 625708150 /nfs/dbraw/zinc/70/81/50/625708150.db2.gz KKFKIDOVXRRBDQ-ZDUSSCGKSA-N 0 3 296.361 2.699 20 10 CFCDHN C[C@H]([NH2+]CCOC1CCSCC1)c1ccccc1[O-] ZINC000930201944 624297906 /nfs/dbraw/zinc/29/79/06/624297906.db2.gz NJAOJOKGOHGPFQ-LBPRGKRZSA-N 0 3 281.421 2.955 20 10 CFCDHN CCOC(=O)CC[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179587274 624968462 /nfs/dbraw/zinc/96/84/62/624968462.db2.gz WGIIDXUJMSDWQJ-CQSZACIVSA-N 0 3 291.391 2.948 20 10 CFCDHN CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179587274 624968465 /nfs/dbraw/zinc/96/84/65/624968465.db2.gz WGIIDXUJMSDWQJ-CQSZACIVSA-N 0 3 291.391 2.948 20 10 CFCDHN C[C@@H](C[C@@H](O)c1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180900935 625047450 /nfs/dbraw/zinc/04/74/50/625047450.db2.gz OYXIEXQZABNQMA-IINYFYTJSA-N 0 3 279.311 2.726 20 10 CFCDHN CC(C)(C)[S@@](=O)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834588671 625728156 /nfs/dbraw/zinc/72/81/56/625728156.db2.gz DUJJXVSFRKIODB-BLVKFPJESA-N 0 3 281.421 2.516 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H](O)C2)c([O-])c1 ZINC000185538919 625738844 /nfs/dbraw/zinc/73/88/44/625738844.db2.gz VUTAMCDKJDXSRX-MJBXVCDLSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@@H](O)Cc1ccccc1 ZINC000834689088 625787253 /nfs/dbraw/zinc/78/72/53/625787253.db2.gz JKIGJBNQQWERDM-XCRHUMRWSA-N 0 3 297.398 2.961 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2ccccc2)c([O-])c1 ZINC000083421804 625845635 /nfs/dbraw/zinc/84/56/35/625845635.db2.gz HDTKBCVRMTWAJN-MRXNPFEDSA-N 0 3 257.333 2.524 20 10 CFCDHN OC[C@@H](N[C@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000834770858 625847672 /nfs/dbraw/zinc/84/76/72/625847672.db2.gz ZLBREGJTJFUMQF-QWHCGFSZSA-N 0 3 275.373 2.764 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000834779170 625854758 /nfs/dbraw/zinc/85/47/58/625854758.db2.gz IKNHSDAUWBHVGM-IRXDYDNUSA-N 0 3 297.398 2.881 20 10 CFCDHN COCC(COC)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834890050 625911820 /nfs/dbraw/zinc/91/18/20/625911820.db2.gz IGYDMGMHZWTCRN-JTQLQIEISA-N 0 3 287.787 2.666 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CCC1)c1ccc(Br)cc1[O-] ZINC000817964570 625966164 /nfs/dbraw/zinc/96/61/64/625966164.db2.gz FKCOCHLEKSYQOQ-VIFPVBQESA-N 0 3 299.212 2.687 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+]Cc1c([O-])cccc1Cl ZINC000083552426 625977456 /nfs/dbraw/zinc/97/74/56/625977456.db2.gz UMJLQNHVXQVFLX-LLVKDONJSA-N 0 3 270.804 2.866 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cnn(CCF)c1 ZINC000921747306 626104600 /nfs/dbraw/zinc/10/46/00/626104600.db2.gz UJQMOEPEMIWBRI-UHFFFAOYSA-N 0 3 290.386 2.517 20 10 CFCDHN O[C@@H]1Cc2ccccc2[C@H]1NCc1ccc2c(c1)CCCO2 ZINC000921824831 626148284 /nfs/dbraw/zinc/14/82/84/626148284.db2.gz ISQBUXLSMCVDDB-IEBWSBKVSA-N 0 3 295.382 2.760 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2CCO[C@H]2C2CC2)cc1F ZINC000922514694 626301228 /nfs/dbraw/zinc/30/12/28/626301228.db2.gz FJWWYQPXCXPDFX-ZBFHGGJFSA-N 0 3 296.361 2.688 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](COC)C(C)C)c([O-])c1 ZINC000922949884 626431594 /nfs/dbraw/zinc/43/15/94/626431594.db2.gz WDQSKOJWSWRYIA-AWEZNQCLSA-N 0 3 281.396 2.799 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@@H](OC(C)C)C2)c([O-])c1 ZINC000839148060 626526175 /nfs/dbraw/zinc/52/61/75/626526175.db2.gz WBBXTJXLWBGCCB-OTVXOJSOSA-N 0 3 279.380 2.837 20 10 CFCDHN CCOc1ccc(C[NH+]2CC(C)(CCOC)C2)c([O-])c1 ZINC000839142088 626528781 /nfs/dbraw/zinc/52/87/81/626528781.db2.gz AYPNAUSDRUKMQS-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(CN2CC(C)(CCOC)C2)c(O)c1 ZINC000839142088 626528782 /nfs/dbraw/zinc/52/87/82/626528782.db2.gz AYPNAUSDRUKMQS-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000760885927 626781974 /nfs/dbraw/zinc/78/19/74/626781974.db2.gz MUIWHHUFAAMZPG-DUVNUKRYSA-N 0 3 279.380 2.545 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(C(=O)OC)CC1)c1ccccc1[O-] ZINC000761498111 626840835 /nfs/dbraw/zinc/84/08/35/626840835.db2.gz GFCLXTPUSDQENI-CQSZACIVSA-N 0 3 292.379 2.664 20 10 CFCDHN CC[C@@H](NCC(=O)N(CC)CC)c1ccc(N(C)C)cc1 ZINC000765333972 627131148 /nfs/dbraw/zinc/13/11/48/627131148.db2.gz OEIJWMNEXWEJLI-MRXNPFEDSA-N 0 3 291.439 2.662 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCC1OCCO1)C1CCCC1 ZINC000767786503 627285630 /nfs/dbraw/zinc/28/56/30/627285630.db2.gz DMRNCIVRQYALFC-UHFFFAOYSA-N 0 3 291.391 2.900 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCC1OCCO1)C1CCCC1 ZINC000767786503 627285632 /nfs/dbraw/zinc/28/56/32/627285632.db2.gz DMRNCIVRQYALFC-UHFFFAOYSA-N 0 3 291.391 2.900 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000767927233 627295429 /nfs/dbraw/zinc/29/54/29/627295429.db2.gz ISEQVDTVBAVYKL-GFCCVEGCSA-N 0 3 277.364 2.592 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]1C1CCC1)[C@H](O)CO2 ZINC000768448326 627343961 /nfs/dbraw/zinc/34/39/61/627343961.db2.gz BUAPTXTVJNDTSW-GDBMZVCRSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]1C1CCC1)[C@H](O)CO2 ZINC000768448326 627343964 /nfs/dbraw/zinc/34/39/64/627343964.db2.gz BUAPTXTVJNDTSW-GDBMZVCRSA-N 0 3 289.375 2.583 20 10 CFCDHN COCC[N@H+](Cc1c([O-])cccc1OC)C1CCCC1 ZINC000768576053 627354756 /nfs/dbraw/zinc/35/47/56/627354756.db2.gz BNWMQCVEGRGNBU-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN COCC[N@@H+](Cc1c([O-])cccc1OC)C1CCCC1 ZINC000768576053 627354757 /nfs/dbraw/zinc/35/47/57/627354757.db2.gz BNWMQCVEGRGNBU-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000769191734 627411531 /nfs/dbraw/zinc/41/15/31/627411531.db2.gz KDELNUCAYBYFIK-UHFFFAOYSA-N 0 3 299.370 2.707 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000769191734 627411533 /nfs/dbraw/zinc/41/15/33/627411533.db2.gz KDELNUCAYBYFIK-UHFFFAOYSA-N 0 3 299.370 2.707 20 10 CFCDHN CCOc1ccc(C[N@H+](CCCCO)C2CC2)c([O-])c1 ZINC000769403526 627435489 /nfs/dbraw/zinc/43/54/89/627435489.db2.gz DCVVHTUCQZBRHD-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCCCO)C2CC2)c([O-])c1 ZINC000769403526 627435490 /nfs/dbraw/zinc/43/54/90/627435490.db2.gz DCVVHTUCQZBRHD-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000769428997 627437756 /nfs/dbraw/zinc/43/77/56/627437756.db2.gz XYCCPMJOOOMGJM-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](CO)c2ccsc2)c1 ZINC000769990603 627494583 /nfs/dbraw/zinc/49/45/83/627494583.db2.gz VBTXVEQRPUEECJ-QMTHXVAHSA-N 0 3 293.388 2.847 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](CO)c2ccsc2)c1 ZINC000769990601 627494791 /nfs/dbraw/zinc/49/47/91/627494791.db2.gz VBTXVEQRPUEECJ-IINYFYTJSA-N 0 3 293.388 2.847 20 10 CFCDHN CC[C@@H]1CN(Cc2ccc(N(CC)CC)c(F)c2)C[C@H]1O ZINC000770384328 627517233 /nfs/dbraw/zinc/51/72/33/627517233.db2.gz XLWIACMUXHVHLN-RHSMWYFYSA-N 0 3 294.414 2.875 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2ccccc2[O-])[C@H](CC)CN1C(C)=O ZINC000770504223 627525724 /nfs/dbraw/zinc/52/57/24/627525724.db2.gz BIPMTZBLVLLMLW-HZPDHXFCSA-N 0 3 290.407 2.614 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2ccccc2[O-])[C@H](CC)CN1C(C)=O ZINC000770504223 627525728 /nfs/dbraw/zinc/52/57/28/627525728.db2.gz BIPMTZBLVLLMLW-HZPDHXFCSA-N 0 3 290.407 2.614 20 10 CFCDHN CCOC(=O)CCC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000770504315 627525858 /nfs/dbraw/zinc/52/58/58/627525858.db2.gz DBGAYCZMKRUNTD-UHFFFAOYSA-N 0 3 291.391 2.948 20 10 CFCDHN COc1ccc(CN[C@@]2(CO)CCc3ccccc32)cc1C ZINC000771199454 627583768 /nfs/dbraw/zinc/58/37/68/627583768.db2.gz CPNGEXOJIMDRRU-LJQANCHMSA-N 0 3 297.398 2.927 20 10 CFCDHN CSc1cc(C[NH2+]Cc2ccccc2[O-])ccn1 ZINC000771882841 627642268 /nfs/dbraw/zinc/64/22/68/627642268.db2.gz TVFCBYKEEWOYRZ-UHFFFAOYSA-N 0 3 260.362 2.799 20 10 CFCDHN C[C@@H](NC/C=C\Cl)c1ccc(N2CCOCC2)cc1 ZINC000775261489 628004906 /nfs/dbraw/zinc/00/49/06/628004906.db2.gz VLQQJFXIPKKPIX-WPRPQAPASA-N 0 3 280.799 2.926 20 10 CFCDHN CC[C@H]([NH2+]CCCNc1ncccn1)c1ccccc1[O-] ZINC000775512528 628033370 /nfs/dbraw/zinc/03/33/70/628033370.db2.gz QZWQBFIEHRIFAV-AWEZNQCLSA-N 0 3 286.379 2.725 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCO)C1CCOCC1)c1ccccc1[O-] ZINC000775555191 628037147 /nfs/dbraw/zinc/03/71/47/628037147.db2.gz KCYHOHOKDIOJQT-JKSUJKDBSA-N 0 3 293.407 2.611 20 10 CFCDHN COC(=O)/C(C)=C\CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775836632 628073680 /nfs/dbraw/zinc/07/36/80/628073680.db2.gz OQMKKBRYDVVXGL-UKVQZPPCSA-N 0 3 276.380 2.523 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)C(C)(C)O)c1[O-] ZINC000776151660 628107269 /nfs/dbraw/zinc/10/72/69/628107269.db2.gz SADRYTOHDSZGFJ-SECBINFHSA-N 0 3 257.761 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000776222276 628118981 /nfs/dbraw/zinc/11/89/81/628118981.db2.gz AZGDVNDMGPWITA-BXUZGUMPSA-N 0 3 282.815 2.926 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCN(C)[C@@H](C)C2)c1[O-] ZINC000776222281 628119007 /nfs/dbraw/zinc/11/90/07/628119007.db2.gz AZGDVNDMGPWITA-SMDDNHRTSA-N 0 3 282.815 2.926 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[NH2+][C@@H]1CCc2cn[nH]c2C1 ZINC000776247489 628121147 /nfs/dbraw/zinc/12/11/47/628121147.db2.gz DRTDPOZRUUEFRT-LLVKDONJSA-N 0 3 295.745 2.555 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccc(F)nc1 ZINC000778169084 628282875 /nfs/dbraw/zinc/28/28/75/628282875.db2.gz MOAQQZXZFTYHBB-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CN1CC[N@H+](Cc2cc(F)ccc2[O-])Cc2ccccc21 ZINC000779010425 628344751 /nfs/dbraw/zinc/34/47/51/628344751.db2.gz VGYHSEAINGSUSC-UHFFFAOYSA-N 0 3 286.350 2.983 20 10 CFCDHN CN1CC[N@@H+](Cc2cc(F)ccc2[O-])Cc2ccccc21 ZINC000779010425 628344752 /nfs/dbraw/zinc/34/47/52/628344752.db2.gz VGYHSEAINGSUSC-UHFFFAOYSA-N 0 3 286.350 2.983 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000779028948 628346714 /nfs/dbraw/zinc/34/67/14/628346714.db2.gz LSEYMUZLHDBXQL-SMDDNHRTSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000779028948 628346717 /nfs/dbraw/zinc/34/67/17/628346717.db2.gz LSEYMUZLHDBXQL-SMDDNHRTSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000779035301 628347943 /nfs/dbraw/zinc/34/79/43/628347943.db2.gz YIGMTEROIZZVHV-CHWSQXEVSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000779035301 628347944 /nfs/dbraw/zinc/34/79/44/628347944.db2.gz YIGMTEROIZZVHV-CHWSQXEVSA-N 0 3 279.355 2.780 20 10 CFCDHN Cc1n[nH]cc1[C@@H](C)NCc1ccc2c(c1)CCO2 ZINC000779045195 628348262 /nfs/dbraw/zinc/34/82/62/628348262.db2.gz LMHVYGNZJSSSGS-SNVBAGLBSA-N 0 3 257.337 2.504 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)[C@H]2CCCOC2)c([O-])c1 ZINC000779987840 628424914 /nfs/dbraw/zinc/42/49/14/628424914.db2.gz HFMHFJCITCAORY-OCCSQVGLSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c1[O-] ZINC000780891878 628502900 /nfs/dbraw/zinc/50/29/00/628502900.db2.gz BNJVMWJFANPQCC-NWDGAFQWSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)c1[O-] ZINC000780891878 628502903 /nfs/dbraw/zinc/50/29/03/628502903.db2.gz BNJVMWJFANPQCC-NWDGAFQWSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000780891880 628503175 /nfs/dbraw/zinc/50/31/75/628503175.db2.gz BNJVMWJFANPQCC-VXGBXAGGSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000780891880 628503176 /nfs/dbraw/zinc/50/31/76/628503176.db2.gz BNJVMWJFANPQCC-VXGBXAGGSA-N 0 3 283.799 2.947 20 10 CFCDHN CC(C)[C@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)N1CCCC1 ZINC000783524157 628716969 /nfs/dbraw/zinc/71/69/69/628716969.db2.gz XXAQAHNHAWNTHY-CJNGLKHVSA-N 0 3 290.407 2.690 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)C[C@@H](C)O)c1[O-] ZINC000783602550 628725683 /nfs/dbraw/zinc/72/56/83/628725683.db2.gz PDHMQBOHYZDVPP-NXEZZACHSA-N 0 3 257.761 2.603 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCCN(Cc2ccccc2O)C1 ZINC000783718040 628738012 /nfs/dbraw/zinc/73/80/12/628738012.db2.gz OATDALCWEHAUGM-CYBMUJFWSA-N 0 3 289.297 2.936 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000783718040 628738015 /nfs/dbraw/zinc/73/80/15/628738015.db2.gz OATDALCWEHAUGM-CYBMUJFWSA-N 0 3 289.297 2.936 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000783718040 628738017 /nfs/dbraw/zinc/73/80/17/628738017.db2.gz OATDALCWEHAUGM-CYBMUJFWSA-N 0 3 289.297 2.936 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1ccc(OCC)cc1[O-])C(C)C ZINC000788971610 629112435 /nfs/dbraw/zinc/11/24/35/629112435.db2.gz PNNVEKWERIQVOO-OAHLLOKOSA-N 0 3 281.396 2.942 20 10 CFCDHN C[C@@H]1C[C@H](NCc2c([O-])ccc(Cl)c2F)CC[N@@H+]1C ZINC000790972723 629276246 /nfs/dbraw/zinc/27/62/46/629276246.db2.gz GDUBEYZGEZJWFW-NXEZZACHSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@@H]1C[C@H](NCc2c([O-])ccc(Cl)c2F)CC[N@H+]1C ZINC000790972723 629276247 /nfs/dbraw/zinc/27/62/47/629276247.db2.gz GDUBEYZGEZJWFW-NXEZZACHSA-N 0 3 286.778 2.757 20 10 CFCDHN CCCN1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835026162 629323934 /nfs/dbraw/zinc/32/39/34/629323934.db2.gz QZOXQPFLHABUSI-WAYWQWQTSA-N 0 3 287.451 2.793 20 10 CFCDHN CO[C@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835026181 629324120 /nfs/dbraw/zinc/32/41/20/629324120.db2.gz RQNFZXPDQZZIOD-AATOQMJSSA-N 0 3 274.408 2.877 20 10 CFCDHN COc1cc(CNC/C=C\c2ccc(N(C)C)cc2)ccn1 ZINC000835036180 629329952 /nfs/dbraw/zinc/32/99/52/629329952.db2.gz BBKHFFZOOHJVPI-PLNGDYQASA-N 0 3 297.402 2.959 20 10 CFCDHN CN(C)c1ccc(/C=C/CNC2COC(C)(C)OC2)cc1 ZINC000835048405 629345800 /nfs/dbraw/zinc/34/58/00/629345800.db2.gz REXWPMNZISUBDR-AATRIKPKSA-N 0 3 290.407 2.507 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccc(C)cn2)c([O-])c1 ZINC000835065862 629366280 /nfs/dbraw/zinc/36/62/80/629366280.db2.gz QVNFNHOOJFLYKV-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN COc1ccsc1C[NH2+]Cc1ccc(OC)cc1[O-] ZINC000793387344 629536130 /nfs/dbraw/zinc/53/61/30/629536130.db2.gz DOKBHDGVHTZINF-UHFFFAOYSA-N 0 3 279.361 2.761 20 10 CFCDHN COc1ccc(C[NH2+]CCCc2ccc(C)nc2)c([O-])c1 ZINC000793391357 629536625 /nfs/dbraw/zinc/53/66/25/629536625.db2.gz WBGALJSHKZSERK-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c([O-])c1 ZINC000793575134 629574138 /nfs/dbraw/zinc/57/41/38/629574138.db2.gz UGUIGELUEFBSBD-XEZPLFJOSA-N 0 3 295.423 2.509 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)CCO)c1ccc(C)cc1[O-] ZINC000794801297 629687781 /nfs/dbraw/zinc/68/77/81/629687781.db2.gz JIOINHGFPWJKQI-GXTWGEPZSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCN1C)c1ccc(C)cc1[O-] ZINC000794802045 629687882 /nfs/dbraw/zinc/68/78/82/629687882.db2.gz LVIQTISKZOABBE-ZFWWWQNUSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCN1C)c1ccc(C)cc1[O-] ZINC000794802037 629688051 /nfs/dbraw/zinc/68/80/51/629688051.db2.gz LVIQTISKZOABBE-DZGCQCFKSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]C1CCC(C(N)=O)CC1)c1ccc(C)cc1[O-] ZINC000794812361 629689333 /nfs/dbraw/zinc/68/93/33/629689333.db2.gz WDAZCXVNMPVXLH-PIMMBPRGSA-N 0 3 290.407 2.785 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](C)[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000794813908 629689456 /nfs/dbraw/zinc/68/94/56/629689456.db2.gz FZTRJVCSAVUZCY-SPKLELGKSA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)CC1CC1)c1ccc(C)cc1[O-] ZINC000794818642 629690525 /nfs/dbraw/zinc/69/05/25/629690525.db2.gz UKKUPOQCEPOOES-UKRRQHHQSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000798503280 630197040 /nfs/dbraw/zinc/19/70/40/630197040.db2.gz FPQPKDKZDDMFFP-AWEZNQCLSA-N 0 3 293.407 2.679 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC000799736331 630342012 /nfs/dbraw/zinc/34/20/12/630342012.db2.gz NQZLQVYKXKOGMY-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC000799736331 630342016 /nfs/dbraw/zinc/34/20/16/630342016.db2.gz NQZLQVYKXKOGMY-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC(C)(C)O)c1[O-] ZINC000808695608 631029767 /nfs/dbraw/zinc/02/97/67/631029767.db2.gz PBYYBUOXKQWEHU-VIFPVBQESA-N 0 3 257.761 2.776 20 10 CFCDHN CO[C@]1(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000808712707 631033663 /nfs/dbraw/zinc/03/36/63/631033663.db2.gz AMGHSHOIFPOSLX-NHYWBVRUSA-N 0 3 299.798 2.810 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808716761 631034400 /nfs/dbraw/zinc/03/44/00/631034400.db2.gz VGXKXJWNLJLXNY-MNOVXSKESA-N 0 3 298.814 2.871 20 10 CFCDHN C[C@@H](NCCCSc1nccs1)c1ccn(C)n1 ZINC000840724431 631176721 /nfs/dbraw/zinc/17/67/21/631176721.db2.gz WBPQJPTULXALCA-SNVBAGLBSA-N 0 3 282.438 2.710 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000840891919 631254767 /nfs/dbraw/zinc/25/47/67/631254767.db2.gz WFQPTFSBYWCHMF-GXTWGEPZSA-N 0 3 278.396 2.654 20 10 CFCDHN CC[C@H](N[C@H](c1nncn1C)C(C)C)c1ccccc1O ZINC000809691717 631264059 /nfs/dbraw/zinc/26/40/59/631264059.db2.gz LUGGHOIMNNYBDA-ZFWWWQNUSA-N 0 3 288.395 2.959 20 10 CFCDHN CO[C@H](CNCc1ccc(N(C)C)cc1C)C(F)(F)F ZINC000840934379 631267511 /nfs/dbraw/zinc/26/75/11/631267511.db2.gz QNXJHHIMGDYYKZ-CYBMUJFWSA-N 0 3 290.329 2.728 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCC(F)(F)[C@@H](CO)C1 ZINC000840948065 631278051 /nfs/dbraw/zinc/27/80/51/631278051.db2.gz PYIUNFUDLJBNNG-CQSZACIVSA-N 0 3 298.377 2.511 20 10 CFCDHN F[C@@H]1CCCC[C@H]1NCc1ccc(N2CCOCC2)cc1 ZINC000840962102 631286026 /nfs/dbraw/zinc/28/60/26/631286026.db2.gz ICDOUSBETCJVOH-IAGOWNOFSA-N 0 3 292.398 2.894 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc(F)ccc1[O-])OCC1CC1 ZINC000840960892 631286131 /nfs/dbraw/zinc/28/61/31/631286131.db2.gz XGJFGNQJGMYTOQ-UHFFFAOYSA-N 0 3 267.344 2.826 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccc(N)cc2)c([O-])c1 ZINC000841035822 631315319 /nfs/dbraw/zinc/31/53/19/631315319.db2.gz OXEIIAJTOOUHNG-UHFFFAOYSA-N 0 3 286.375 2.705 20 10 CFCDHN C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@@]1(C)C[NH3+] ZINC000841090869 631337051 /nfs/dbraw/zinc/33/70/51/631337051.db2.gz OWJKKFAAUGAXAM-YMTOWFKASA-N 0 3 286.778 2.601 20 10 CFCDHN Cc1cc([O-])c(CN[C@H](CC[NH3+])C(F)(F)F)c(Cl)c1 ZINC000841094457 631338563 /nfs/dbraw/zinc/33/85/63/631338563.db2.gz YOIZWIWYTGQHCR-LLVKDONJSA-N 0 3 296.720 2.723 20 10 CFCDHN CCn1cncc1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000841871952 631485465 /nfs/dbraw/zinc/48/54/65/631485465.db2.gz GYXYMEIJWSZMPG-ZDUSSCGKSA-N 0 3 272.396 2.820 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000811512007 631574421 /nfs/dbraw/zinc/57/44/21/631574421.db2.gz BDCMLDOZDZGUFT-JTQLQIEISA-N 0 3 271.307 2.878 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000811512007 631574427 /nfs/dbraw/zinc/57/44/27/631574427.db2.gz BDCMLDOZDZGUFT-JTQLQIEISA-N 0 3 271.307 2.878 20 10 CFCDHN COc1cccc(O)c1CN1CCC(F)(F)[C@@H](C)C1 ZINC000811512007 631574430 /nfs/dbraw/zinc/57/44/30/631574430.db2.gz BDCMLDOZDZGUFT-JTQLQIEISA-N 0 3 271.307 2.878 20 10 CFCDHN CC(C)[C@H]([NH3+])CCN(C)Cc1c([O-])ccc(Cl)c1F ZINC000843056274 631820890 /nfs/dbraw/zinc/82/08/90/631820890.db2.gz GXNKQRGIHSFJIE-GFCCVEGCSA-N 0 3 288.794 2.990 20 10 CFCDHN C=Cn1cc(CN[C@@H](C)c2cc(OC)ccc2O)cn1 ZINC000813330713 631903055 /nfs/dbraw/zinc/90/30/55/631903055.db2.gz DVRSTSYSYKWTCI-NSHDSACASA-N 0 3 273.336 2.549 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCO)CSC)c1ccccc1[O-] ZINC000155980174 650039725 /nfs/dbraw/zinc/03/97/25/650039725.db2.gz MVIIRIKSLCFUFA-YPMHNXCESA-N 0 3 269.410 2.547 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)c1[O-] ZINC000843420920 631951265 /nfs/dbraw/zinc/95/12/65/631951265.db2.gz MELKDQVTEPNOPG-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1[O-] ZINC000843420920 631951267 /nfs/dbraw/zinc/95/12/67/631951267.db2.gz MELKDQVTEPNOPG-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000814178537 632025295 /nfs/dbraw/zinc/02/52/95/632025295.db2.gz UHEDXARZERRUMB-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000814178537 632025301 /nfs/dbraw/zinc/02/53/01/632025301.db2.gz UHEDXARZERRUMB-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN CCN(C)c1ccc(CN2CCC(F)(F)[C@H](CO)C2)cc1 ZINC000815118742 632205834 /nfs/dbraw/zinc/20/58/34/632205834.db2.gz KSNQLFGLKWAZGP-AWEZNQCLSA-N 0 3 298.377 2.592 20 10 CFCDHN CN(C)CCC[NH2+]Cc1ccc2ccccc2c1[O-] ZINC000816528466 632479534 /nfs/dbraw/zinc/47/95/34/632479534.db2.gz DFQUKTOKIRZLQO-UHFFFAOYSA-N 0 3 258.365 2.587 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCN3CCC2CC3)ccc2ccccc21 ZINC000816610908 632494984 /nfs/dbraw/zinc/49/49/84/632494984.db2.gz CEJVQGZYAZXJDM-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN [O-]c1c(C[N@H+]2CCN3CCC2CC3)ccc2ccccc21 ZINC000816610908 632494988 /nfs/dbraw/zinc/49/49/88/632494988.db2.gz CEJVQGZYAZXJDM-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](O)C23CCCC3)c([O-])c1 ZINC000816630600 632497375 /nfs/dbraw/zinc/49/73/75/632497375.db2.gz KMWCFFSNUUNMQN-INIZCTEOSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)c([O-])c1 ZINC000816630600 632497379 /nfs/dbraw/zinc/49/73/79/632497379.db2.gz KMWCFFSNUUNMQN-INIZCTEOSA-N 0 3 291.391 2.670 20 10 CFCDHN COC[C@H](CC(C)(C)C)[NH2+]Cc1ccc(OC)cc1[O-] ZINC000845965863 632606358 /nfs/dbraw/zinc/60/63/58/632606358.db2.gz BWVVGFZYRRAYIA-ZDUSSCGKSA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000817414715 632626653 /nfs/dbraw/zinc/62/66/53/632626653.db2.gz ITSXZLDWBOVVAZ-QWHCGFSZSA-N 0 3 253.317 2.579 20 10 CFCDHN Cc1cccc(CN2C[C@H](C)OCC23CCC3)c1O ZINC000846066233 632627688 /nfs/dbraw/zinc/62/76/88/632627688.db2.gz AYMFFHOKEPBBTM-ZDUSSCGKSA-N 0 3 261.365 2.844 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC2(CO)CCC2)c1[O-] ZINC000846104871 632631703 /nfs/dbraw/zinc/63/17/03/632631703.db2.gz LSSMPHHMCGCKDD-UHFFFAOYSA-N 0 3 299.798 2.697 20 10 CFCDHN COc1cccc([C@H](C)NCc2cccc(F)n2)c1O ZINC000846157614 632649716 /nfs/dbraw/zinc/64/97/16/632649716.db2.gz MZWZJPDFCRICDV-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN COc1cccc([C@@H](C)N[C@@H](CO)c2ccsc2)c1O ZINC000846164334 632650958 /nfs/dbraw/zinc/65/09/58/632650958.db2.gz NZTGEKDFVZFXJW-MFKMUULPSA-N 0 3 293.388 2.847 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000846184060 632655315 /nfs/dbraw/zinc/65/53/15/632655315.db2.gz MHAJJEIWFQSOJD-OBJOEFQTSA-N 0 3 251.370 2.840 20 10 CFCDHN CCCN1C[C@@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1=O ZINC000817590174 632672954 /nfs/dbraw/zinc/67/29/54/632672954.db2.gz VQZNCGYRNSUEQH-UONOGXRCSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1[O-] ZINC000817943574 632746268 /nfs/dbraw/zinc/74/62/68/632746268.db2.gz VPPWIOVZISHHEO-SUMWQHHRSA-N 0 3 299.418 2.809 20 10 CFCDHN CC[C@H](N[C@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817944823 632747261 /nfs/dbraw/zinc/74/72/61/632747261.db2.gz NGQPXRBBNJKXSO-JQWIXIFHSA-N 0 3 288.313 2.814 20 10 CFCDHN CC(C)[NH2+]CCCN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000817952942 632752830 /nfs/dbraw/zinc/75/28/30/632752830.db2.gz JNAFWVNXVORFAD-SNVBAGLBSA-N 0 3 272.339 2.709 20 10 CFCDHN N[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000817955346 632754592 /nfs/dbraw/zinc/75/45/92/632754592.db2.gz WBUMCQUWPKTBIK-GJZGRUSLSA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@@H](NC[C@H](C)[NH3+])c1ccc(Cl)c(Cl)c1[O-] ZINC000817972079 632771794 /nfs/dbraw/zinc/77/17/94/632771794.db2.gz JOIHRAJBKMLCIW-NKWVEPMBSA-N 0 3 263.168 2.697 20 10 CFCDHN COc1cc(Br)cc([C@H](C)NCCF)c1O ZINC000848548239 633286044 /nfs/dbraw/zinc/28/60/44/633286044.db2.gz BJNKLPAWMIRVMS-ZETCQYMHSA-N 0 3 292.148 2.783 20 10 CFCDHN C[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(=O)OC(C)(C)C ZINC000848563341 633290492 /nfs/dbraw/zinc/29/04/92/633290492.db2.gz RTPJLCCAZGBNQQ-DGCLKSJQSA-N 0 3 291.391 2.947 20 10 CFCDHN CCc1cccc(CN2CCOC[C@@H]2C2CC2)c1O ZINC000848888378 633363104 /nfs/dbraw/zinc/36/31/04/633363104.db2.gz SGXYLZDCEFEWNG-OAHLLOKOSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H](CC)C[C@@H](C)CO)c1[O-] ZINC000848898032 633387407 /nfs/dbraw/zinc/38/74/07/633387407.db2.gz OQJUWAVCVPVTDO-DOMZBBRYSA-N 0 3 265.397 2.841 20 10 CFCDHN CCc1cccc(CN[C@H](CO)c2ccsc2)c1O ZINC000848903171 633390534 /nfs/dbraw/zinc/39/05/34/633390534.db2.gz OGAPOVYJRHBBCS-CQSZACIVSA-N 0 3 277.389 2.839 20 10 CFCDHN CCc1cccc(CN(C)Cc2cnn(C)c2C)c1O ZINC000848908231 633394344 /nfs/dbraw/zinc/39/43/44/633394344.db2.gz PAQLLZCGFPILSR-UHFFFAOYSA-N 0 3 273.380 2.629 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](C1CC1)[C@H]1CCCCO1 ZINC000848921963 633403672 /nfs/dbraw/zinc/40/36/72/633403672.db2.gz KMAUTBCYHCTKHI-CVEARBPZSA-N 0 3 279.355 2.969 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1COc2cc(F)ccc2C1 ZINC000850382836 633969156 /nfs/dbraw/zinc/96/91/56/633969156.db2.gz YXOPKMVONLIJHE-AWEZNQCLSA-N 0 3 273.307 2.625 20 10 CFCDHN C[C@@H](O)[C@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000850419482 633984435 /nfs/dbraw/zinc/98/44/35/633984435.db2.gz FQACUJDAJIPAFM-WBMJQRKESA-N 0 3 257.333 2.604 20 10 CFCDHN C[C@@H]1CC[C@H](CNCc2cc(F)c(N(C)C)cc2F)O1 ZINC000858174313 636147807 /nfs/dbraw/zinc/14/78/07/636147807.db2.gz BVSIEEIQVYBNOT-ZYHUDNBSSA-N 0 3 284.350 2.688 20 10 CFCDHN COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CCOCC1 ZINC000850494470 634017648 /nfs/dbraw/zinc/01/76/48/634017648.db2.gz RXTYCPQIYKCITR-XHDPSFHLSA-N 0 3 297.370 2.624 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cncc(C)n2)c([O-])c1 ZINC000850549615 634048326 /nfs/dbraw/zinc/04/83/26/634048326.db2.gz IARBWMCZSNPVMF-CYBMUJFWSA-N 0 3 271.364 2.692 20 10 CFCDHN CO[C@@]1(C)C[C@H]1[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000850570792 634056852 /nfs/dbraw/zinc/05/68/52/634056852.db2.gz IYZUFMBPXADIMK-UWCNHGJWSA-N 0 3 265.328 2.847 20 10 CFCDHN CCCCCCN(C)CC(=O)N(C)Cc1ccccc1O ZINC000109952607 634344352 /nfs/dbraw/zinc/34/43/52/634344352.db2.gz AMHDFLHUCMMDKM-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN CCn1nccc1CNC/C=C/c1ccc(N(C)C)cc1 ZINC000853093927 634902763 /nfs/dbraw/zinc/90/27/63/634902763.db2.gz NCEUDKPFXCUURB-AATRIKPKSA-N 0 3 284.407 2.772 20 10 CFCDHN CCn1nccc1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000853239526 634948598 /nfs/dbraw/zinc/94/85/98/634948598.db2.gz HLIJGERJCUYMGM-JTQLQIEISA-N 0 3 263.316 2.599 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CSCCS1 ZINC000857760989 636023432 /nfs/dbraw/zinc/02/34/32/636023432.db2.gz GZYADZUCCSUFEK-NSHDSACASA-N 0 3 269.435 2.639 20 10 CFCDHN CCC[C@](C)(CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858139343 636137090 /nfs/dbraw/zinc/13/70/90/636137090.db2.gz RONCOHXPDCKJDA-OAHLLOKOSA-N 0 3 286.366 2.672 20 10 CFCDHN CO[C@@H](C)[C@@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000858165695 636145718 /nfs/dbraw/zinc/14/57/18/636145718.db2.gz LAOHSWYLKZDMHE-ZJUUUORDSA-N 0 3 272.339 2.544 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000858204951 636155393 /nfs/dbraw/zinc/15/53/93/636155393.db2.gz ODHUADZZDFHVJO-UPJWGTAASA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCN1CC(F)F)c1ccccc1[O-] ZINC000858478988 636264422 /nfs/dbraw/zinc/26/44/22/636264422.db2.gz GLPPZLQKAHBUPF-RYUDHWBXSA-N 0 3 284.350 2.772 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000858504947 636275077 /nfs/dbraw/zinc/27/50/77/636275077.db2.gz BWMLPXNLEQNAJG-DGCLKSJQSA-N 0 3 275.348 2.695 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)CCCCCO)cc1F ZINC000862351293 637327714 /nfs/dbraw/zinc/32/77/14/637327714.db2.gz JRTCUDNXSQVTFB-UHFFFAOYSA-N 0 3 286.366 2.625 20 10 CFCDHN CC[C@H](C)[N@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000862386992 637349428 /nfs/dbraw/zinc/34/94/28/637349428.db2.gz GBIQZUWDMKFOKW-JTQLQIEISA-N 0 3 287.787 2.647 20 10 CFCDHN CC[C@H](C)[N@@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000862386992 637349435 /nfs/dbraw/zinc/34/94/35/637349435.db2.gz GBIQZUWDMKFOKW-JTQLQIEISA-N 0 3 287.787 2.647 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCN2C)c1[O-] ZINC000862473148 637395547 /nfs/dbraw/zinc/39/55/47/637395547.db2.gz GEXAVIZJZHOBCK-CYBMUJFWSA-N 0 3 268.788 2.538 20 10 CFCDHN Cc1cccc(CN2CCc3c(O)cccc3C2)c1O ZINC000862529195 637407648 /nfs/dbraw/zinc/40/76/48/637407648.db2.gz HUSDUSPAWSJCPY-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC[C@@H](C)NC1)c1ccc(F)cc1[O-] ZINC000863546738 637693426 /nfs/dbraw/zinc/69/34/26/637693426.db2.gz NMKFIMSOHAPQJC-QKCSRTOESA-N 0 3 266.360 2.713 20 10 CFCDHN CCOc1cccc(CN[C@H]2CCCn3nccc32)c1O ZINC000865871826 638630903 /nfs/dbraw/zinc/63/09/03/638630903.db2.gz MEAKXCMXRNANAS-ZDUSSCGKSA-N 0 3 287.363 2.612 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@H](O)C(F)F)c1ccc(C)cc1[O-] ZINC000866442389 638821954 /nfs/dbraw/zinc/82/19/54/638821954.db2.gz KTXYURJBGCQGOA-NEPJUHHUSA-N 0 3 273.323 2.757 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H]2OC[C@@H]3C[C@H]1C[C@@H]32)c1cc(F)ccc1[O-] ZINC000866444373 638822376 /nfs/dbraw/zinc/82/23/76/638822376.db2.gz GRBOZDINKRDITQ-XIDMARJMSA-N 0 3 277.339 2.605 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccnc(F)c1)CC2 ZINC000866474466 638827198 /nfs/dbraw/zinc/82/71/98/638827198.db2.gz MOWZWWXHMWMZKE-LBPRGKRZSA-N 0 3 258.296 2.703 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1ccnn1C)c1ccccc1[O-] ZINC000866614950 638855093 /nfs/dbraw/zinc/85/50/93/638855093.db2.gz QRACDCCRLFYBQF-DGCLKSJQSA-N 0 3 259.353 2.928 20 10 CFCDHN CC(=O)Oc1ccc(C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000123128108 639642903 /nfs/dbraw/zinc/64/29/03/639642903.db2.gz JHLTUERPZYBEDL-UHFFFAOYSA-N 0 3 285.343 2.950 20 10 CFCDHN CC(=O)Oc1ccc(C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000123128108 639642910 /nfs/dbraw/zinc/64/29/10/639642910.db2.gz JHLTUERPZYBEDL-UHFFFAOYSA-N 0 3 285.343 2.950 20 10 CFCDHN Cc1nccnc1[C@H](C)N[C@@H]1CCc2cccc(O)c21 ZINC000872132853 641660049 /nfs/dbraw/zinc/66/00/49/641660049.db2.gz IBFFCTFLCQTUPW-WCQYABFASA-N 0 3 269.348 2.829 20 10 CFCDHN Cc1cccc(CN2CCN(C)c3ncccc3C2)c1O ZINC000872266968 641727292 /nfs/dbraw/zinc/72/72/92/641727292.db2.gz JAHYAAXQTHWLKZ-UHFFFAOYSA-N 0 3 283.375 2.548 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC(F)F)c([O-])c1 ZINC000194032723 650714343 /nfs/dbraw/zinc/71/43/43/650714343.db2.gz OOGDEXDPPOIJQX-SNVBAGLBSA-N 0 3 259.296 2.981 20 10 CFCDHN Cc1nc2ccccc2n1CC[NH2+]Cc1ccccc1[O-] ZINC000020186653 642315318 /nfs/dbraw/zinc/31/53/18/642315318.db2.gz JNHGXUCZAGMWDF-UHFFFAOYSA-N 0 3 281.359 2.840 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000083551957 650764507 /nfs/dbraw/zinc/76/45/07/650764507.db2.gz NADHYAKTWJCPAC-NWDGAFQWSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000083551957 650764508 /nfs/dbraw/zinc/76/45/08/650764508.db2.gz NADHYAKTWJCPAC-NWDGAFQWSA-N 0 3 280.799 2.762 20 10 CFCDHN CN(CC[N@H+](C)Cc1ccccc1[O-])c1ccccc1 ZINC000085795154 650793000 /nfs/dbraw/zinc/79/30/00/650793000.db2.gz GSJVDOIPDKXGKE-UHFFFAOYSA-N 0 3 270.376 2.960 20 10 CFCDHN CN(CC[N@@H+](C)Cc1ccccc1[O-])c1ccccc1 ZINC000085795154 650793002 /nfs/dbraw/zinc/79/30/02/650793002.db2.gz GSJVDOIPDKXGKE-UHFFFAOYSA-N 0 3 270.376 2.960 20 10 CFCDHN Cc1ccc(C[N@H+](C[C@@H]2CCOC2)C2CC2)c([O-])c1 ZINC000876570874 642928123 /nfs/dbraw/zinc/92/81/23/642928123.db2.gz PGXTXWHQVDDKOF-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c([O-])c1 ZINC000876570874 642928127 /nfs/dbraw/zinc/92/81/27/642928127.db2.gz PGXTXWHQVDDKOF-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(c3c[nH]cn3)CC2)c([O-])c1 ZINC000876740895 642989176 /nfs/dbraw/zinc/98/91/76/642989176.db2.gz OEFYTMUNWFGLBZ-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@@H+](C)CCCOC(C)C)c([O-])c1 ZINC000876752539 642995232 /nfs/dbraw/zinc/99/52/32/642995232.db2.gz SOSMOKFFYIIUPC-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1ccc(C[N@H+](C)CCCOC(C)C)c([O-])c1 ZINC000876752539 642995240 /nfs/dbraw/zinc/99/52/40/642995240.db2.gz SOSMOKFFYIIUPC-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN CO[C@H](C)C[N@H+](Cc1c(C)cccc1[O-])C(C)C ZINC000876757919 642996501 /nfs/dbraw/zinc/99/65/01/642996501.db2.gz GKBNAQNEEUCKIS-CYBMUJFWSA-N 0 3 251.370 2.946 20 10 CFCDHN CO[C@H](C)C[N@@H+](Cc1c(C)cccc1[O-])C(C)C ZINC000876757919 642996507 /nfs/dbraw/zinc/99/65/07/642996507.db2.gz GKBNAQNEEUCKIS-CYBMUJFWSA-N 0 3 251.370 2.946 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(N(C)CC(F)F)CC2)c([O-])c1 ZINC000876775664 643004794 /nfs/dbraw/zinc/00/47/94/643004794.db2.gz CUHVCHZUOWIPQG-UHFFFAOYSA-N 0 3 298.377 2.862 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@@H]32)c([O-])c1 ZINC000876804670 643016918 /nfs/dbraw/zinc/01/69/18/643016918.db2.gz RMQYYDZPEDGQOF-CABCVRRESA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c([O-])c1 ZINC000876804670 643016927 /nfs/dbraw/zinc/01/69/27/643016927.db2.gz RMQYYDZPEDGQOF-CABCVRRESA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+]Cc2ccc(C)cc2[O-])n1 ZINC000876881464 643048349 /nfs/dbraw/zinc/04/83/49/643048349.db2.gz GZCMJIMGJUGHSU-UHFFFAOYSA-N 0 3 273.380 2.694 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCN1CCCCCC1=O ZINC000876892003 643054303 /nfs/dbraw/zinc/05/43/03/643054303.db2.gz JSTMXEWTTVLIFG-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc(F)c2N)cc1 ZINC000876906028 643060238 /nfs/dbraw/zinc/06/02/38/643060238.db2.gz OMXHUOXZSRWCMY-UHFFFAOYSA-N 0 3 273.355 2.764 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)c1ccccc1F ZINC000876958681 643080686 /nfs/dbraw/zinc/08/06/86/643080686.db2.gz AQXPPKBWINKXED-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877029533 643109901 /nfs/dbraw/zinc/10/99/01/643109901.db2.gz GLDXDKNAVNWALL-DOMZBBRYSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc(C)nc2)c([O-])c1 ZINC000877038912 643115571 /nfs/dbraw/zinc/11/55/71/643115571.db2.gz AWMXGHWLBDATLG-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)CC(C)(C)C ZINC000877040865 643116517 /nfs/dbraw/zinc/11/65/17/643116517.db2.gz SPPJZABNBKAOAB-LBPRGKRZSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)c1ccsc1 ZINC000877049217 643120814 /nfs/dbraw/zinc/12/08/14/643120814.db2.gz ROYIJZMUQRUXNN-CQSZACIVSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)C[C@@H](C)O ZINC000877055092 643124426 /nfs/dbraw/zinc/12/44/26/643124426.db2.gz OQVYGWQAVBOZNR-GFCCVEGCSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c([O-])c1 ZINC000877059025 643126451 /nfs/dbraw/zinc/12/64/51/643126451.db2.gz IZESNWZEOYCMFX-YUELXQCFSA-N 0 3 261.365 2.604 20 10 CFCDHN CCC1(C[NH2+]Cc2ccc(C)cc2[O-])CCOCC1 ZINC000877069109 643133023 /nfs/dbraw/zinc/13/30/23/643133023.db2.gz XCJAWNVEFQCMQM-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)Cc2ccncc2)c([O-])c1 ZINC000877073346 643135161 /nfs/dbraw/zinc/13/51/61/643135161.db2.gz ITGMEDTVCLICQQ-ZDUSSCGKSA-N 0 3 256.349 2.816 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CO)c1ccccc1 ZINC000877073901 643136140 /nfs/dbraw/zinc/13/61/40/643136140.db2.gz VOCRYFDYHQVFHM-HNNXBMFYSA-N 0 3 271.360 2.566 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)c([O-])c1 ZINC000877086058 643144776 /nfs/dbraw/zinc/14/47/76/643144776.db2.gz MFDRQUGINVFOOR-FMKPAKJESA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([C@@H](O)C[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877091805 643148755 /nfs/dbraw/zinc/14/87/55/643148755.db2.gz QNHRYYZCHDGKKZ-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@@]2(CCSC2)C1 ZINC000877095750 643150477 /nfs/dbraw/zinc/15/04/77/643150477.db2.gz SYBPQLGZWWXRKW-BBRMVZONSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000877115419 643158969 /nfs/dbraw/zinc/15/89/69/643158969.db2.gz FIQSYOKRHWGABO-RHSMWYFYSA-N 0 3 285.387 2.782 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c([O-])c1 ZINC000877135547 643171029 /nfs/dbraw/zinc/17/10/29/643171029.db2.gz GICMVZJFGADPAZ-ZBFHGGJFSA-N 0 3 263.381 2.994 20 10 CFCDHN CCOC(=O)C1(C[NH2+]Cc2c(C)cccc2[O-])CCC1 ZINC000877313084 643233371 /nfs/dbraw/zinc/23/33/71/643233371.db2.gz RIJAAHLPANAYOG-UHFFFAOYSA-N 0 3 277.364 2.524 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](C2(C)OCCO2)C1 ZINC000877315690 643234744 /nfs/dbraw/zinc/23/47/44/643234744.db2.gz PWKAJEFHYWAQAB-AWEZNQCLSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](C2(C)OCCO2)C1 ZINC000877315690 643234751 /nfs/dbraw/zinc/23/47/51/643234751.db2.gz PWKAJEFHYWAQAB-AWEZNQCLSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@@H](C2CC2)C1 ZINC000877375128 643250182 /nfs/dbraw/zinc/25/01/82/643250182.db2.gz OPGNTNPSLRNDHC-CZUORRHYSA-N 0 3 261.365 2.748 20 10 CFCDHN COc1cnccc1[C@@H](C)NCc1ccc(C)cc1O ZINC000877461452 643281755 /nfs/dbraw/zinc/28/17/55/643281755.db2.gz AFJOVCNLEHQTGR-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C ZINC000877476047 643292781 /nfs/dbraw/zinc/29/27/81/643292781.db2.gz SDDVDLRMLAJWQJ-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000877497636 643309675 /nfs/dbraw/zinc/30/96/75/643309675.db2.gz WAKIXKILNNOQMF-HNNXBMFYSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](CCO)Cc1ccccc1 ZINC000877498530 643311150 /nfs/dbraw/zinc/31/11/50/643311150.db2.gz QUKKCPSRZRLZOS-INIZCTEOSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@H](CO)CC(C)C)c([O-])c1 ZINC000877529996 643332687 /nfs/dbraw/zinc/33/26/87/643332687.db2.gz BHSKUOAAUKWALJ-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@H](CO)CC(C)C)c([O-])c1 ZINC000877529996 643332695 /nfs/dbraw/zinc/33/26/95/643332695.db2.gz BHSKUOAAUKWALJ-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000877548792 643348879 /nfs/dbraw/zinc/34/88/79/643348879.db2.gz BLAHROXIHJXLEE-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000877548792 643348885 /nfs/dbraw/zinc/34/88/85/643348885.db2.gz BLAHROXIHJXLEE-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000877553707 643354550 /nfs/dbraw/zinc/35/45/50/643354550.db2.gz BNQUSDVCRFXRKI-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000877553707 643354552 /nfs/dbraw/zinc/35/45/52/643354552.db2.gz BNQUSDVCRFXRKI-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]([C@@H](CO)C1CC1)C1CC1 ZINC000877565930 643365744 /nfs/dbraw/zinc/36/57/44/643365744.db2.gz BIQDAGZGXXSICT-RDJZCZTQSA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]CCOCC2CCCC2)c([O-])c1 ZINC000877577728 643375298 /nfs/dbraw/zinc/37/52/98/643375298.db2.gz HMNMSRIVZXNTLW-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CO[C@@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2[O-])C12CCC2 ZINC000877583733 643379021 /nfs/dbraw/zinc/37/90/21/643379021.db2.gz AIXILXFJKDEEOT-HUUCEWRRSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(CN2C[C@@H](C)OC3(CCC3)C2)c(O)c1 ZINC000877607790 643394349 /nfs/dbraw/zinc/39/43/49/643394349.db2.gz LSFNUWZWODCOMC-CYBMUJFWSA-N 0 3 261.365 2.844 20 10 CFCDHN CC(=O)NCc1ccc(C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877621018 643408246 /nfs/dbraw/zinc/40/82/46/643408246.db2.gz PEUKUFCZPQSPSO-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CC[C@H](COCC1CC1)[NH2+]Cc1c(C)cccc1[O-] ZINC000877622185 643408981 /nfs/dbraw/zinc/40/89/81/643408981.db2.gz HWNWWTLUYFILCL-CQSZACIVSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1c(C)cccc1[O-])C1CCCC1 ZINC000877638828 643424221 /nfs/dbraw/zinc/42/42/21/643424221.db2.gz PKDMHIZASVEVGM-INIZCTEOSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)c([O-])c1 ZINC000877640829 643425182 /nfs/dbraw/zinc/42/51/82/643425182.db2.gz STYKWIFLCYXDDX-RDTXWAMCSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(C[N@@H+]2Cc3cccc([O-])c3C2)c(O)c1 ZINC000877703142 643468523 /nfs/dbraw/zinc/46/85/23/643468523.db2.gz SWENRXKQLFFZDD-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN Cc1ccc(C[N@H+]2Cc3cccc([O-])c3C2)c(O)c1 ZINC000877703142 643468525 /nfs/dbraw/zinc/46/85/25/643468525.db2.gz SWENRXKQLFFZDD-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN CO[C@H](Cc1ccccc1)C[N@@H+]1Cc2cccc([O-])c2C1 ZINC000877703228 643468806 /nfs/dbraw/zinc/46/88/06/643468806.db2.gz XFIKLBFYEJMAOK-MRXNPFEDSA-N 0 3 283.371 2.966 20 10 CFCDHN CO[C@H](Cc1ccccc1)C[N@H+]1Cc2cccc([O-])c2C1 ZINC000877703228 643468810 /nfs/dbraw/zinc/46/88/10/643468810.db2.gz XFIKLBFYEJMAOK-MRXNPFEDSA-N 0 3 283.371 2.966 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](CC1CCC3(CC1)OCCO3)C2 ZINC000877703224 643469452 /nfs/dbraw/zinc/46/94/52/643469452.db2.gz WVXNQZICJPDHTK-UHFFFAOYSA-N 0 3 289.375 2.641 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](CC1CCC3(CC1)OCCO3)C2 ZINC000877703224 643469458 /nfs/dbraw/zinc/46/94/58/643469458.db2.gz WVXNQZICJPDHTK-UHFFFAOYSA-N 0 3 289.375 2.641 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)c([O-])c1 ZINC000877709677 643476496 /nfs/dbraw/zinc/47/64/96/643476496.db2.gz GDVXFOWBYHMHQJ-WBVHZDCISA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000877729956 643490222 /nfs/dbraw/zinc/49/02/22/643490222.db2.gz HJVVIYPIKHAIGD-GJZGRUSLSA-N 0 3 275.392 2.853 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1c2ccccc2CN1C ZINC000877733681 643494038 /nfs/dbraw/zinc/49/40/38/643494038.db2.gz WNQQIMXGRDOUDM-KRWDZBQOSA-N 0 3 282.387 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877736850 643496822 /nfs/dbraw/zinc/49/68/22/643496822.db2.gz DNNUHKNCTLADAH-JQWIXIFHSA-N 0 3 267.369 2.716 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877736850 643496831 /nfs/dbraw/zinc/49/68/31/643496831.db2.gz DNNUHKNCTLADAH-JQWIXIFHSA-N 0 3 267.369 2.716 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000877743369 643520084 /nfs/dbraw/zinc/52/00/84/643520084.db2.gz KERHMRBQMCYBLA-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000877743369 643520092 /nfs/dbraw/zinc/52/00/92/643520092.db2.gz KERHMRBQMCYBLA-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(c2cnccn2)CC1)c1ccccc1[O-] ZINC000877755496 643535103 /nfs/dbraw/zinc/53/51/03/643535103.db2.gz CSEIMCLOBOXLLZ-CYBMUJFWSA-N 0 3 298.390 2.502 20 10 CFCDHN COc1cccc(CN[C@H](C)c2ccccc2O)n1 ZINC000877755562 643535308 /nfs/dbraw/zinc/53/53/08/643535308.db2.gz FPMQBFSPWSNTBZ-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc(Cl)n1C)c1ccccc1[O-] ZINC000877755600 643535547 /nfs/dbraw/zinc/53/55/47/643535547.db2.gz HRXMARXHAYOXHE-SECBINFHSA-N 0 3 265.744 2.630 20 10 CFCDHN COCCc1ncc(C[NH2+][C@H](C)c2ccccc2[O-])s1 ZINC000877757718 643538846 /nfs/dbraw/zinc/53/88/46/643538846.db2.gz SGEIAPIFBQJUCD-LLVKDONJSA-N 0 3 292.404 2.888 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1C(=O)N(C)C)c1ccccc1[O-] ZINC000877758102 643539350 /nfs/dbraw/zinc/53/93/50/643539350.db2.gz IVLDNZFSKXIRKE-ZDUSSCGKSA-N 0 3 298.386 2.945 20 10 CFCDHN C[C@H]1CN(Cc2ccccc2O)CC[C@@H](C(F)(F)F)O1 ZINC000877822191 643588831 /nfs/dbraw/zinc/58/88/31/643588831.db2.gz FGWSTVRGYNMBMT-GWCFXTLKSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccccc2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877822191 643588835 /nfs/dbraw/zinc/58/88/35/643588835.db2.gz FGWSTVRGYNMBMT-GWCFXTLKSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccccc2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877822191 643588836 /nfs/dbraw/zinc/58/88/36/643588836.db2.gz FGWSTVRGYNMBMT-GWCFXTLKSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCC2(CCOCC2)O1)c1ccccc1[O-] ZINC000878355043 643857381 /nfs/dbraw/zinc/85/73/81/643857381.db2.gz UUIOHJJGKQCBLR-KGLIPLIRSA-N 0 3 291.391 2.771 20 10 CFCDHN Cc1cccc(CNC(=O)C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000879648404 644361942 /nfs/dbraw/zinc/36/19/42/644361942.db2.gz NJTKKHHDLHGBSP-CQSZACIVSA-N 0 3 298.386 2.668 20 10 CFCDHN COc1ccc(CN[C@H](C)c2ccccc2O)nc1 ZINC000879649596 644362641 /nfs/dbraw/zinc/36/26/41/644362641.db2.gz XBDGHVRNOQIYHN-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN C[C@@H]([NH2+]CCCS(=O)(=O)C(C)(C)C)c1ccccc1[O-] ZINC000879650184 644363944 /nfs/dbraw/zinc/36/39/44/644363944.db2.gz NKOPBQANFNUWNW-GFCCVEGCSA-N 0 3 299.436 2.646 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)CC1CCCC1)c1ccccc1[O-] ZINC000879650510 644364952 /nfs/dbraw/zinc/36/49/52/644364952.db2.gz FLGTWYSHQPSPBM-JSGCOSHPSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC(C)(C)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651808 644365052 /nfs/dbraw/zinc/36/50/52/644365052.db2.gz LHFAWKFPFRAXTM-RYUDHWBXSA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1cc(O)c(CN(C)Cc2cccn2C)cc1C ZINC000128285304 644590983 /nfs/dbraw/zinc/59/09/83/644590983.db2.gz WKOHJEZOYHKWMD-UHFFFAOYSA-N 0 3 258.365 2.980 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000248480572 650936119 /nfs/dbraw/zinc/93/61/19/650936119.db2.gz APQSWZBLOCXNCK-CHWSQXEVSA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644258 650943703 /nfs/dbraw/zinc/94/37/03/650943703.db2.gz BTZDCOSOFDEULL-SMDDNHRTSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644258 650943705 /nfs/dbraw/zinc/94/37/05/650943705.db2.gz BTZDCOSOFDEULL-SMDDNHRTSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644259 650943889 /nfs/dbraw/zinc/94/38/89/650943889.db2.gz BTZDCOSOFDEULL-RISCZKNCSA-N 0 3 282.815 2.960 20 10 CFCDHN C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[O-])CCN1C ZINC000093644259 650943893 /nfs/dbraw/zinc/94/38/93/650943893.db2.gz BTZDCOSOFDEULL-RISCZKNCSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN(CC)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094616690 650960024 /nfs/dbraw/zinc/96/00/24/650960024.db2.gz OJEVWAIHTXEMHA-LLVKDONJSA-N 0 3 254.349 2.524 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1cc(F)ccc1[O-] ZINC000094617311 650960064 /nfs/dbraw/zinc/96/00/64/650960064.db2.gz ZSIXSXGSVIBYSQ-NILFDRSVSA-N 0 3 278.371 2.809 20 10 CFCDHN CCC[C@H](N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 ZINC000881377330 644964206 /nfs/dbraw/zinc/96/42/06/644964206.db2.gz KAARGJPGLJEJPC-AWEZNQCLSA-N 0 3 287.411 2.501 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252673861 651016199 /nfs/dbraw/zinc/01/61/99/651016199.db2.gz NADHYAKTWJCPAC-RYUDHWBXSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252673861 651016201 /nfs/dbraw/zinc/01/62/01/651016201.db2.gz NADHYAKTWJCPAC-RYUDHWBXSA-N 0 3 280.799 2.762 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(OC)c2O)C[C@H]1C ZINC000252875605 651028390 /nfs/dbraw/zinc/02/83/90/651028390.db2.gz WQPGAPAZOVHHCV-LLVKDONJSA-N 0 3 298.814 2.580 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccns2)c([O-])c1 ZINC000883241947 645690439 /nfs/dbraw/zinc/69/04/39/645690439.db2.gz QNFNLMZLFBQJCS-UHFFFAOYSA-N 0 3 278.377 2.580 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCN1CC)c1ccc(C)cc1[O-] ZINC000883354769 645758936 /nfs/dbraw/zinc/75/89/36/645758936.db2.gz BTOZLGAMTWVKIV-DZGCQCFKSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[NH+](CC)[C@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000134061548 646271623 /nfs/dbraw/zinc/27/16/23/646271623.db2.gz DLDDTACSUQQAOA-LBPRGKRZSA-N 0 3 282.815 2.962 20 10 CFCDHN COc1ccc(C)cc1C[NH2+]Cc1ccccc1[O-] ZINC000134228501 646308561 /nfs/dbraw/zinc/30/85/61/646308561.db2.gz MMPGFYSUFYEEHR-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1ccc(C[NH2+]Cc2ccccc2[O-])cc1[N+](=O)[O-] ZINC000134236706 646309667 /nfs/dbraw/zinc/30/96/67/646309667.db2.gz KROTYDPHCGXTRU-UHFFFAOYSA-N 0 3 272.304 2.899 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3cc(C)co3)C2)cc1 ZINC000886158392 646900512 /nfs/dbraw/zinc/90/05/12/646900512.db2.gz YMNBHVJCIGYNKY-AWEZNQCLSA-N 0 3 286.375 2.965 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2CCc3cccnc32)c1 ZINC000886547782 647043054 /nfs/dbraw/zinc/04/30/54/647043054.db2.gz RHPFQZDEEDUXDT-CQSZACIVSA-N 0 3 270.332 2.573 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886612672 647067074 /nfs/dbraw/zinc/06/70/74/647067074.db2.gz QZLVEFBXJSFEKM-VXGBXAGGSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@H+](C)C[C@@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886612672 647067081 /nfs/dbraw/zinc/06/70/81/647067081.db2.gz QZLVEFBXJSFEKM-VXGBXAGGSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)[N@@H+](C)C[C@@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886612672 647067087 /nfs/dbraw/zinc/06/70/87/647067087.db2.gz QZLVEFBXJSFEKM-VXGBXAGGSA-N 0 3 268.376 2.911 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@@H]1CCCOC1)c1ccccc1[O-] ZINC000886788359 647137192 /nfs/dbraw/zinc/13/71/92/647137192.db2.gz ASCGNIQUKVRRTA-VNQPRFMTSA-N 0 3 293.407 2.875 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H]1CCCOC1 ZINC000886789510 647137810 /nfs/dbraw/zinc/13/78/10/647137810.db2.gz WJVNDMDMBTYNMI-ZOWXZIJZSA-N 0 3 297.370 2.624 20 10 CFCDHN Cc1cc(CC[NH2+][C@H](C)c2ccc(C)cc2[O-])nn1C ZINC000926910010 648653621 /nfs/dbraw/zinc/65/36/21/648653621.db2.gz IMWAMPBOAMRAGQ-CYBMUJFWSA-N 0 3 273.380 2.636 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC2CCOCC2)c([O-])c1 ZINC000927078123 648700922 /nfs/dbraw/zinc/70/09/22/648700922.db2.gz FKQGWEVQEQQAJA-CYBMUJFWSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@H]([NH2+]CCO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000927081673 648702306 /nfs/dbraw/zinc/70/23/06/648702306.db2.gz RAILVNBFCSNATR-ZFWWWQNUSA-N 0 3 279.380 2.547 20 10 CFCDHN CCOCCOCC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000927086652 648705147 /nfs/dbraw/zinc/70/51/47/648705147.db2.gz HUMRJXZQRIWDDI-WCQYABFASA-N 0 3 297.370 2.722 20 10 CFCDHN CCC[N@H+](C/C(C)=C/C(=O)OC)Cc1ccccc1[O-] ZINC000929752902 649111833 /nfs/dbraw/zinc/11/18/33/649111833.db2.gz HTMIGJPURPBOQA-JLHYYAGUSA-N 0 3 277.364 2.724 20 10 CFCDHN CCC[N@@H+](C/C(C)=C/C(=O)OC)Cc1ccccc1[O-] ZINC000929752902 649111836 /nfs/dbraw/zinc/11/18/36/649111836.db2.gz HTMIGJPURPBOQA-JLHYYAGUSA-N 0 3 277.364 2.724 20 10 CFCDHN C[N@H+](CCOC1CCSCC1)Cc1ccccc1[O-] ZINC000929975319 649158620 /nfs/dbraw/zinc/15/86/20/649158620.db2.gz FHXXQMUTPRNMQZ-UHFFFAOYSA-N 0 3 281.421 2.736 20 10 CFCDHN C[N@@H+](CCOC1CCSCC1)Cc1ccccc1[O-] ZINC000929975319 649158622 /nfs/dbraw/zinc/15/86/22/649158622.db2.gz FHXXQMUTPRNMQZ-UHFFFAOYSA-N 0 3 281.421 2.736 20 10 CFCDHN CC[C@](O)(C[NH2+][C@@H](C)c1ccccc1[O-])C(F)(F)F ZINC000931554371 649453126 /nfs/dbraw/zinc/45/31/26/649453126.db2.gz ORBJGMMTDPZGGE-CABZTGNLSA-N 0 3 277.286 2.746 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@@H]2O)c1[O-] ZINC000305794943 651078727 /nfs/dbraw/zinc/07/87/27/651078727.db2.gz VCLBHVROPRIOQW-MFKMUULPSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](COCC2CC2)C1 ZINC001237493090 779691153 /nfs/dbraw/zinc/69/11/53/779691153.db2.gz VLDMSEPQKLANTO-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](COCC2CC2)C1 ZINC001237493090 779691158 /nfs/dbraw/zinc/69/11/58/779691158.db2.gz VLDMSEPQKLANTO-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN CS[C@@H](C)CC[N@@H+]1CCc2cccc([O-])c2C1 ZINC001208156777 769883024 /nfs/dbraw/zinc/88/30/24/769883024.db2.gz YTMTYHVOLWQBCT-NSHDSACASA-N 0 3 251.395 2.892 20 10 CFCDHN CS[C@@H](C)CC[N@H+]1CCc2cccc([O-])c2C1 ZINC001208156777 769883039 /nfs/dbraw/zinc/88/30/39/769883039.db2.gz YTMTYHVOLWQBCT-NSHDSACASA-N 0 3 251.395 2.892 20 10 CFCDHN CN1CCC[C@H]2C[N@H+](Cc3c([O-])cccc3Cl)C[C@H]21 ZINC001140341972 770530355 /nfs/dbraw/zinc/53/03/55/770530355.db2.gz NMFIMSCVEAGYLE-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CCC[C@H]2C[N@@H+](Cc3c([O-])cccc3Cl)C[C@H]21 ZINC001140341972 770530359 /nfs/dbraw/zinc/53/03/59/770530359.db2.gz NMFIMSCVEAGYLE-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CC[N@H+](Cc1cc(F)ccc1[O-])[C@H]1CCCOC1 ZINC000402710128 770554390 /nfs/dbraw/zinc/55/43/90/770554390.db2.gz RVKPZUGNRRVEEO-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[N@@H+](Cc1cc(F)ccc1[O-])[C@H]1CCCOC1 ZINC000402710128 770554393 /nfs/dbraw/zinc/55/43/93/770554393.db2.gz RVKPZUGNRRVEEO-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[C@@H]([NH2+]CCO[C@@H]1CC1(F)F)c1ccccc1[O-] ZINC000690732696 770837719 /nfs/dbraw/zinc/83/77/19/770837719.db2.gz SNKCFQHOXORJSR-DGCLKSJQSA-N 0 3 271.307 2.857 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](CCO)C2CCCC2)c1 ZINC000725102537 775273854 /nfs/dbraw/zinc/27/38/54/775273854.db2.gz CWJKKPZZRXSICC-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc(CN2CC3(C2)CC(F)(F)C3)c1O ZINC001231590881 777266141 /nfs/dbraw/zinc/26/61/41/777266141.db2.gz KGBJCACKCUNEAE-UHFFFAOYSA-N 0 3 253.292 2.932 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H](F)C[C@H](CO)C1 ZINC001231587353 777268793 /nfs/dbraw/zinc/26/87/93/777268793.db2.gz ACTACVPMPOARDA-GXTWGEPZSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H](F)C[C@H](CO)C1 ZINC001231587353 777268798 /nfs/dbraw/zinc/26/87/98/777268798.db2.gz ACTACVPMPOARDA-GXTWGEPZSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCC[C@@H](O)C1 ZINC001231588920 777269092 /nfs/dbraw/zinc/26/90/92/777269092.db2.gz ZDTBEKFSSBTHRI-CQSZACIVSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCC[C@@H](O)C1 ZINC001231588920 777269099 /nfs/dbraw/zinc/26/90/99/777269099.db2.gz ZDTBEKFSSBTHRI-CQSZACIVSA-N 0 3 271.360 2.892 20 10 CFCDHN C[N@H+](CCC1OCCO1)Cc1c([O-])ccc2ccccc21 ZINC001231590678 777271375 /nfs/dbraw/zinc/27/13/75/777271375.db2.gz KGYYXAXTCLYCCF-UHFFFAOYSA-N 0 3 287.359 2.740 20 10 CFCDHN C[N@@H+](CCC1OCCO1)Cc1c([O-])ccc2ccccc21 ZINC001231590678 777271378 /nfs/dbraw/zinc/27/13/78/777271378.db2.gz KGYYXAXTCLYCCF-UHFFFAOYSA-N 0 3 287.359 2.740 20 10 CFCDHN CN1CC[C@H]2C[N@H+](Cc3c([O-])ccc4ccccc43)C[C@H]21 ZINC001231590479 777271974 /nfs/dbraw/zinc/27/19/74/777271974.db2.gz DDGOFOVSMIPLFU-WMLDXEAASA-N 0 3 282.387 2.681 20 10 CFCDHN CN1CC[C@H]2C[N@@H+](Cc3c([O-])ccc4ccccc43)C[C@H]21 ZINC001231590479 777271983 /nfs/dbraw/zinc/27/19/83/777271983.db2.gz DDGOFOVSMIPLFU-WMLDXEAASA-N 0 3 282.387 2.681 20 10 CFCDHN COc1cc(CN2CCc3cc(C)ccc3C2)c(O)cc1O ZINC001231638899 777289103 /nfs/dbraw/zinc/28/91/03/777289103.db2.gz BTPMHUWHLZFUBQ-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN Cc1cc(C)c(CN2CCOCC23CCC3)c(O)c1 ZINC001231845592 777346722 /nfs/dbraw/zinc/34/67/22/777346722.db2.gz BWNLXUWRZGEJIO-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN Cc1cc(C)c(CN2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC001231847510 777348181 /nfs/dbraw/zinc/34/81/81/777348181.db2.gz DNVIKJUJMBMZEN-MRXNPFEDSA-N 0 3 263.381 2.866 20 10 CFCDHN Cc1cc(C)c(CN2CCN(C)c3ncccc3C2)c(O)c1 ZINC001231845911 777348285 /nfs/dbraw/zinc/34/82/85/777348285.db2.gz UKGUMEXHPMFNMV-UHFFFAOYSA-N 0 3 297.402 2.856 20 10 CFCDHN CN1CC[C@H]([N@H+](C)Cc2ccc3ccccc3c2[O-])C1 ZINC001231881713 777364507 /nfs/dbraw/zinc/36/45/07/777364507.db2.gz HAUHPZCMULACHP-HNNXBMFYSA-N 0 3 270.376 2.681 20 10 CFCDHN CN1CC[C@H]([N@@H+](C)Cc2ccc3ccccc3c2[O-])C1 ZINC001231881713 777364511 /nfs/dbraw/zinc/36/45/11/777364511.db2.gz HAUHPZCMULACHP-HNNXBMFYSA-N 0 3 270.376 2.681 20 10 CFCDHN Cc1nc(N)ccc1CN(C)Cc1ccc(N(C)C)cc1 ZINC001232347334 777531961 /nfs/dbraw/zinc/53/19/61/777531961.db2.gz NEKSPRULCVUROI-UHFFFAOYSA-N 0 3 284.407 2.670 20 10 CFCDHN CN(Cc1ccc(N2CCCC2)cc1)Cc1ccc(N)nc1 ZINC001232368623 777537031 /nfs/dbraw/zinc/53/70/31/777537031.db2.gz PGFIHEWZGODMGB-UHFFFAOYSA-N 0 3 296.418 2.896 20 10 CFCDHN CN(C)c1ccc(CN2CCc3c(O)cccc3C2)c(O)c1 ZINC001232834905 777686993 /nfs/dbraw/zinc/68/69/93/777686993.db2.gz PLBXHQKTODXTME-UHFFFAOYSA-N 0 3 298.386 2.722 20 10 CFCDHN CN(C)c1ccc(CN2Cc3ccccc3C2)c(O)c1 ZINC001232834766 777687554 /nfs/dbraw/zinc/68/75/54/777687554.db2.gz LXEKCKVESAQJRL-UHFFFAOYSA-N 0 3 268.360 2.974 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H]2c2cnccn2)c(O)c1 ZINC001232839550 777688795 /nfs/dbraw/zinc/68/87/95/777688795.db2.gz PFYHUPQRLYYPIT-INIZCTEOSA-N 0 3 298.390 2.585 20 10 CFCDHN Cc1ccc(CCN(C)Cc2cc(O)c(O)c(O)c2)cc1 ZINC001233014094 777763671 /nfs/dbraw/zinc/76/36/71/777763671.db2.gz YROYLVJXQFCTSH-UHFFFAOYSA-N 0 3 287.359 2.786 20 10 CFCDHN C[C@H]1CCCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233012167 777764186 /nfs/dbraw/zinc/76/41/86/777764186.db2.gz JBDHBKOCEVQPPW-JTQLQIEISA-N 0 3 251.326 2.568 20 10 CFCDHN CCN(Cc1cc(C(C)(C)C)ccc1O)C1CN(C)C1 ZINC001233286915 777867387 /nfs/dbraw/zinc/86/73/87/777867387.db2.gz OIZXXNCNDCXDKF-UHFFFAOYSA-N 0 3 276.424 2.826 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)C2)c1[O-] ZINC001233287723 777868284 /nfs/dbraw/zinc/86/82/84/777868284.db2.gz FFNITLRPOAMJEC-BMIGLBTASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@](C)(O)C2)c1[O-] ZINC001233287723 777868292 /nfs/dbraw/zinc/86/82/92/777868292.db2.gz FFNITLRPOAMJEC-BMIGLBTASA-N 0 3 299.798 2.647 20 10 CFCDHN COC[C@@H]1CCN1Cc1cccc(OC(F)(F)F)c1O ZINC001233776441 778073971 /nfs/dbraw/zinc/07/39/71/778073971.db2.gz SJQMPYIMINDNRC-JTQLQIEISA-N 0 3 291.269 2.512 20 10 CFCDHN CN1CC[NH+](Cc2cccc(-c3ccccc3)c2[O-])CC1 ZINC001234992650 778346586 /nfs/dbraw/zinc/34/65/86/778346586.db2.gz QCMOYKVRLZXKEE-UHFFFAOYSA-N 0 3 282.387 2.807 20 10 CFCDHN CC1(CO)C[NH+](Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001234993352 778347331 /nfs/dbraw/zinc/34/73/31/778347331.db2.gz YQVZVHQQNANIRI-UHFFFAOYSA-N 0 3 283.371 2.873 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CCCC[C@]12CC[NH2+]C2 ZINC001235118007 778388634 /nfs/dbraw/zinc/38/86/34/778388634.db2.gz CTGTZXCEFXRVMI-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN COc1ccc2c(c1)C[C@@H]([N@@H+]1CCc3cccc([O-])c3C1)C2 ZINC001168283035 778392405 /nfs/dbraw/zinc/39/24/05/778392405.db2.gz OISKCGBEQVGSOA-INIZCTEOSA-N 0 3 295.382 2.926 20 10 CFCDHN COc1ccc2c(c1)C[C@@H]([N@H+]1CCc3cccc([O-])c3C1)C2 ZINC001168283035 778392413 /nfs/dbraw/zinc/39/24/13/778392413.db2.gz OISKCGBEQVGSOA-INIZCTEOSA-N 0 3 295.382 2.926 20 10 CFCDHN COCC1C[NH+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235674265 778533233 /nfs/dbraw/zinc/53/32/33/778533233.db2.gz FBAOMKJEUXXTSH-UHFFFAOYSA-N 0 3 263.381 2.768 20 10 CFCDHN COCC[NH+](CCOC)Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235676924 778533989 /nfs/dbraw/zinc/53/39/89/778533989.db2.gz XIXZZTZXGIPUKE-UHFFFAOYSA-N 0 3 295.423 2.785 20 10 CFCDHN CC1(C)C[NH2+]CCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001235825764 778570002 /nfs/dbraw/zinc/57/00/02/778570002.db2.gz NHTQRFMRAMLKQU-UHFFFAOYSA-N 0 3 288.313 2.595 20 10 CFCDHN CCN(Cc1cc(Cl)c(OC)cc1[O-])[C@@H]1CCC[NH2+]C1 ZINC001236008082 778652802 /nfs/dbraw/zinc/65/28/02/778652802.db2.gz QSASDQVKZHZISE-GFCCVEGCSA-N 0 3 298.814 2.628 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[C@@]3([NH3+])C2)cc1Cl ZINC001236019124 778656431 /nfs/dbraw/zinc/65/64/31/778656431.db2.gz BHJVBJTWNDIJRJ-BDJLRTHQSA-N 0 3 294.826 2.876 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CCC[C@H]([NH2+]C2CC2)C1 ZINC001236219041 778742729 /nfs/dbraw/zinc/74/27/29/778742729.db2.gz WEAXBRNUYIXWTE-AWEZNQCLSA-N 0 3 280.799 2.762 20 10 CFCDHN C[C@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@H](C)[NH2+]1 ZINC001236425470 778820576 /nfs/dbraw/zinc/82/05/76/778820576.db2.gz WNMDXMRHVANUOX-UWVGGRQHSA-N 0 3 288.313 2.593 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCO[C@H]2CC2(F)F)c([O-])c1 ZINC000690730718 778922075 /nfs/dbraw/zinc/92/20/75/778922075.db2.gz KJYRQQMKBVHTOH-GWCFXTLKSA-N 0 3 271.307 2.775 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](O)[C@@H](C)C2)c([O-])c1 ZINC001236782877 778934049 /nfs/dbraw/zinc/93/40/49/778934049.db2.gz GGASGXJDLJGZHE-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c([O-])c1 ZINC001236782877 778934050 /nfs/dbraw/zinc/93/40/50/778934050.db2.gz GGASGXJDLJGZHE-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236807238 778946020 /nfs/dbraw/zinc/94/60/20/778946020.db2.gz DZLVGMFIUPLLSZ-SUMWQHHRSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236807238 778946028 /nfs/dbraw/zinc/94/60/28/778946028.db2.gz DZLVGMFIUPLLSZ-SUMWQHHRSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(CN2CCc3c(O)cccc3C2)c(O)c1 ZINC001236806901 778946745 /nfs/dbraw/zinc/94/67/45/778946745.db2.gz CHHGALQSJBONRY-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN CCOC1CC[NH+](Cc2c(C)cc(OC)cc2[O-])CC1 ZINC001236814973 778950358 /nfs/dbraw/zinc/95/03/58/778950358.db2.gz YIXNQURYGJYXKK-UHFFFAOYSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCc3cccc([O-])c3C2)c(O)c1 ZINC001236817004 778950744 /nfs/dbraw/zinc/95/07/44/778950744.db2.gz AEGHKVXENKGLKD-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCc3cccc([O-])c3C2)c(O)c1 ZINC001236817004 778950748 /nfs/dbraw/zinc/95/07/48/778950748.db2.gz AEGHKVXENKGLKD-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236819708 778954140 /nfs/dbraw/zinc/95/41/40/778954140.db2.gz ZMQUBMMZKZSZLN-GUYCJALGSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236819708 778954142 /nfs/dbraw/zinc/95/41/42/778954142.db2.gz ZMQUBMMZKZSZLN-GUYCJALGSA-N 0 3 291.391 2.710 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@@H](F)[C@@H](O)CC1 ZINC001236827537 778956207 /nfs/dbraw/zinc/95/62/07/778956207.db2.gz UYUCORUMYQTNNI-CVEARBPZSA-N 0 3 289.350 2.840 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@@H](F)[C@@H](O)CC1 ZINC001236827537 778956214 /nfs/dbraw/zinc/95/62/14/778956214.db2.gz UYUCORUMYQTNNI-CVEARBPZSA-N 0 3 289.350 2.840 20 10 CFCDHN C[N@H+](CCC1OCCO1)Cc1cc2ccccc2cc1[O-] ZINC001236830485 778958061 /nfs/dbraw/zinc/95/80/61/778958061.db2.gz AWFRHACUTRZHLA-UHFFFAOYSA-N 0 3 287.359 2.740 20 10 CFCDHN C[N@@H+](CCC1OCCO1)Cc1cc2ccccc2cc1[O-] ZINC001236830485 778958066 /nfs/dbraw/zinc/95/80/66/778958066.db2.gz AWFRHACUTRZHLA-UHFFFAOYSA-N 0 3 287.359 2.740 20 10 CFCDHN CC1(C(N)=O)CC[NH+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236839379 778962269 /nfs/dbraw/zinc/96/22/69/778962269.db2.gz FWKYUBBASDXSOI-UHFFFAOYSA-N 0 3 298.386 2.633 20 10 CFCDHN C[C@]1(O)CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841451 778962314 /nfs/dbraw/zinc/96/23/14/778962314.db2.gz KSTISEKTDAPRNJ-KRWDZBQOSA-N 0 3 271.360 2.892 20 10 CFCDHN C[C@]1(O)CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841451 778962316 /nfs/dbraw/zinc/96/23/16/778962316.db2.gz KSTISEKTDAPRNJ-KRWDZBQOSA-N 0 3 271.360 2.892 20 10 CFCDHN CC(C)(C)c1cc(O)c(CN2CCNC2)cc1Cl ZINC001236850519 778964869 /nfs/dbraw/zinc/96/48/69/778964869.db2.gz NNTGDMRPTVCMPM-UHFFFAOYSA-N 0 3 268.788 2.706 20 10 CFCDHN C[N@H+](Cc1cccc(-n2cncn2)c1)Cc1ccccc1[O-] ZINC001236884630 778972653 /nfs/dbraw/zinc/97/26/53/778972653.db2.gz CZXZYNLEBAUHTG-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN C[N@@H+](Cc1cccc(-n2cncn2)c1)Cc1ccccc1[O-] ZINC001236884630 778972656 /nfs/dbraw/zinc/97/26/56/778972656.db2.gz CZXZYNLEBAUHTG-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](C)C2)c([O-])c1 ZINC001237046089 778998893 /nfs/dbraw/zinc/99/88/93/778998893.db2.gz PHMWLHAIDYGRMU-IUODEOHRSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](C)C2)c([O-])c1 ZINC001237046089 778998896 /nfs/dbraw/zinc/99/88/96/778998896.db2.gz PHMWLHAIDYGRMU-IUODEOHRSA-N 0 3 263.381 2.718 20 10 CFCDHN [O-]c1cc(OCC(F)(F)F)ccc1C[NH+]1CCCC1 ZINC001237050617 779000318 /nfs/dbraw/zinc/00/03/18/779000318.db2.gz CZBXKNVLNQNBNF-UHFFFAOYSA-N 0 3 275.270 2.929 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H](O)C[C@H]2C)c([O-])c1 ZINC001237050208 779000990 /nfs/dbraw/zinc/00/09/90/779000990.db2.gz YYVJJPHOIOFFOA-DOMZBBRYSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H](O)C[C@H]2C)c([O-])c1 ZINC001237050208 779000996 /nfs/dbraw/zinc/00/09/96/779000996.db2.gz YYVJJPHOIOFFOA-DOMZBBRYSA-N 0 3 263.381 2.861 20 10 CFCDHN C[C@H]1CC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237054244 779002065 /nfs/dbraw/zinc/00/20/65/779002065.db2.gz XOVBWVNEOGOZFM-VIFPVBQESA-N 0 3 275.270 2.928 20 10 CFCDHN C[C@H]1CC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237054244 779002073 /nfs/dbraw/zinc/00/20/73/779002073.db2.gz XOVBWVNEOGOZFM-VIFPVBQESA-N 0 3 275.270 2.928 20 10 CFCDHN CN(Cc1c([O-])ccc(F)c1Cl)C1CC[NH+](C)CC1 ZINC001237120000 779017596 /nfs/dbraw/zinc/01/75/96/779017596.db2.gz HNDFDJXASSRXKJ-UHFFFAOYSA-N 0 3 286.778 2.711 20 10 CFCDHN Nc1cccc(CN2CCCc3cc(O)c(O)cc3C2)c1 ZINC001237219496 779051866 /nfs/dbraw/zinc/05/18/66/779051866.db2.gz JBKAITIGHUFPRX-UHFFFAOYSA-N 0 3 284.359 2.628 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237405485 779099207 /nfs/dbraw/zinc/09/92/07/779099207.db2.gz QTADSORATFSDOU-RISCZKNCSA-N 0 3 280.799 2.620 20 10 CFCDHN CCOC(=O)C[C@@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237484555 779117869 /nfs/dbraw/zinc/11/78/69/779117869.db2.gz FNHHKXZBESUDNK-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)C[C@@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237484555 779117874 /nfs/dbraw/zinc/11/78/74/779117874.db2.gz FNHHKXZBESUDNK-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCCN(c2ccccn2)CC1 ZINC001237483239 779118097 /nfs/dbraw/zinc/11/80/97/779118097.db2.gz OQSXBISYTDNBSO-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCCN(c2ccccn2)CC1 ZINC001237483239 779118100 /nfs/dbraw/zinc/11/81/00/779118100.db2.gz OQSXBISYTDNBSO-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(CCOC2)CC1 ZINC001237483750 779118141 /nfs/dbraw/zinc/11/81/41/779118141.db2.gz SPCTWVKYEKSLQT-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC2(C[C@@H]2CCO)CC1 ZINC001237484966 779118329 /nfs/dbraw/zinc/11/83/29/779118329.db2.gz KPWIXDXUGFZJEX-AWEZNQCLSA-N 0 3 275.392 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@@H]2C(=O)CCC[C@@H]2C1 ZINC001237491599 779118693 /nfs/dbraw/zinc/11/86/93/779118693.db2.gz PXMCGYJMNUYOGM-OCCSQVGLSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@@H]2C(=O)CCC[C@@H]2C1 ZINC001237491599 779118698 /nfs/dbraw/zinc/11/86/98/779118698.db2.gz PXMCGYJMNUYOGM-OCCSQVGLSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cnc2c(c1)CN(Cc1c(C)cccc1O)CC2 ZINC001237493743 779120440 /nfs/dbraw/zinc/12/04/40/779120440.db2.gz DBKGKYRHKOYKLO-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN C[NH+]1CCC2(CN(Cc3cc(Cl)cc(F)c3[O-])C2)CC1 ZINC001237623651 779147326 /nfs/dbraw/zinc/14/73/26/779147326.db2.gz RWPOVQMBRUDJMT-UHFFFAOYSA-N 0 3 298.789 2.712 20 10 CFCDHN COc1cc(CN2CCc3ccccc3C2)c(O)c(OC)c1 ZINC001237674466 779158415 /nfs/dbraw/zinc/15/84/15/779158415.db2.gz ITDOBSBRCAJTID-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3OCC[C@H]32)c1[O-] ZINC001237679469 779160019 /nfs/dbraw/zinc/16/00/19/779160019.db2.gz IICASWAPFDFXMI-CHWSQXEVSA-N 0 3 267.756 2.717 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3OCC[C@H]32)c1[O-] ZINC001237679469 779160021 /nfs/dbraw/zinc/16/00/21/779160021.db2.gz IICASWAPFDFXMI-CHWSQXEVSA-N 0 3 267.756 2.717 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@H]3OCC[C@H]32)c1O ZINC001237679469 779160025 /nfs/dbraw/zinc/16/00/25/779160025.db2.gz IICASWAPFDFXMI-CHWSQXEVSA-N 0 3 267.756 2.717 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c1[O-] ZINC001237686745 779160715 /nfs/dbraw/zinc/16/07/15/779160715.db2.gz MTYQCVQVSNAMDP-LERXQTSPSA-N 0 3 281.783 2.821 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H]3OC[C@@H](C)[C@H]3C2)c1[O-] ZINC001237686745 779160719 /nfs/dbraw/zinc/16/07/19/779160719.db2.gz MTYQCVQVSNAMDP-LERXQTSPSA-N 0 3 281.783 2.821 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3OCC[C@H]3C2)c1[O-] ZINC001237686728 779161651 /nfs/dbraw/zinc/16/16/51/779161651.db2.gz MELKDQVTEPNOPG-FZMZJTMJSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3OCC[C@H]3C2)c1[O-] ZINC001237686728 779161657 /nfs/dbraw/zinc/16/16/57/779161657.db2.gz MELKDQVTEPNOPG-FZMZJTMJSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001237682065 779161834 /nfs/dbraw/zinc/16/18/34/779161834.db2.gz WKDAYVDWCXVMOT-NHYWBVRUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001237682065 779161836 /nfs/dbraw/zinc/16/18/36/779161836.db2.gz WKDAYVDWCXVMOT-NHYWBVRUSA-N 0 3 283.799 2.947 20 10 CFCDHN CN(Cc1ccc(N2CCCC2)cc1)Cc1c[nH]ccc1=O ZINC001237840157 779192865 /nfs/dbraw/zinc/19/28/65/779192865.db2.gz MAYWSEPAXQOXNB-UHFFFAOYSA-N 0 3 297.402 2.607 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3cc(F)c(Cl)cc3[O-])C[C@@H]2C1 ZINC001237936743 779211369 /nfs/dbraw/zinc/21/13/69/779211369.db2.gz DMWSIRMOAHOZKK-PWSUYJOCSA-N 0 3 298.789 2.568 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3cc(F)c(Cl)cc3[O-])C[C@@H]2C1 ZINC001237936743 779211372 /nfs/dbraw/zinc/21/13/72/779211372.db2.gz DMWSIRMOAHOZKK-PWSUYJOCSA-N 0 3 298.789 2.568 20 10 CFCDHN C[C@H](Cc1cccc(F)c1)[NH2+]Cc1cccc(O)c1[O-] ZINC001168465898 779219339 /nfs/dbraw/zinc/21/93/39/779219339.db2.gz ZQBJLLHJHINGCR-LLVKDONJSA-N 0 3 275.323 2.958 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCCC[C@@](O)(CF)C2)c1[O-] ZINC001238055792 779240722 /nfs/dbraw/zinc/24/07/22/779240722.db2.gz DNXARWARBLILLS-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCCC[C@@](O)(CF)C2)c1[O-] ZINC001238055792 779240727 /nfs/dbraw/zinc/24/07/27/779240727.db2.gz DNXARWARBLILLS-OAHLLOKOSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(CN2[C@@H]3CC[C@H]2CC(=O)C3)c1O ZINC001238059164 779240746 /nfs/dbraw/zinc/24/07/46/779240746.db2.gz AVSVBCRZVGVHEH-BETUJISGSA-N 0 3 263.312 2.536 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001238059434 779241325 /nfs/dbraw/zinc/24/13/25/779241325.db2.gz CUCNUNKKMZOPIR-BLLLJJGKSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001238059434 779241329 /nfs/dbraw/zinc/24/13/29/779241329.db2.gz CUCNUNKKMZOPIR-BLLLJJGKSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)CCc2ccncc2)c1[O-] ZINC001238060639 779242526 /nfs/dbraw/zinc/24/25/26/779242526.db2.gz CYCAMYWHPPOHCA-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)CCc2ccncc2)c1[O-] ZINC001238060639 779242531 /nfs/dbraw/zinc/24/25/31/779242531.db2.gz CYCAMYWHPPOHCA-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2nnc3ccccn32)c([O-])c1 ZINC000387049262 779943144 /nfs/dbraw/zinc/94/31/44/779943144.db2.gz NECSEWPYCPZNKE-ZDUSSCGKSA-N 0 3 296.374 2.637 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001203558607 780073103 /nfs/dbraw/zinc/07/31/03/780073103.db2.gz PAIWBULBPZGMQH-UHFFFAOYSA-N 0 3 285.343 2.752 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001203558607 780073111 /nfs/dbraw/zinc/07/31/11/780073111.db2.gz PAIWBULBPZGMQH-UHFFFAOYSA-N 0 3 285.343 2.752 20 10 CFCDHN CC(C)[NH+](CCNCc1cc(F)cc(F)c1[O-])C(C)C ZINC000708393284 781271832 /nfs/dbraw/zinc/27/18/32/781271832.db2.gz BMNITWZRBVGWDX-UHFFFAOYSA-N 0 3 286.366 2.879 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709847479 781320122 /nfs/dbraw/zinc/32/01/22/781320122.db2.gz ADHXKCQGMFMWJV-HNNXBMFYSA-N 0 3 280.799 2.621 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000711412850 781429928 /nfs/dbraw/zinc/42/99/28/781429928.db2.gz HALHUQYSZJNLHM-CYBMUJFWSA-N 0 3 265.328 2.723 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H](O)[C@H]2C)c([O-])c1 ZINC000295029949 199309028 /nfs/dbraw/zinc/30/90/28/199309028.db2.gz NWKXTVOZMBPBEM-DOMZBBRYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H](O)[C@H]2C)c([O-])c1 ZINC000295029949 199309030 /nfs/dbraw/zinc/30/90/30/199309030.db2.gz NWKXTVOZMBPBEM-DOMZBBRYSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@H](CO)c2ccccc2)c1[O-] ZINC000295034715 199311977 /nfs/dbraw/zinc/31/19/77/199311977.db2.gz MAQKJFIFUFVARO-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@H](CO)c2ccccc2)c1[O-] ZINC000295034715 199311979 /nfs/dbraw/zinc/31/19/79/199311979.db2.gz MAQKJFIFUFVARO-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc(CN(C)[C@H](CO)c2ccccc2)c1O ZINC000295034715 199311980 /nfs/dbraw/zinc/31/19/80/199311980.db2.gz MAQKJFIFUFVARO-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CC(C)(C)O)c1ccccc1[O-] ZINC000295133704 199364266 /nfs/dbraw/zinc/36/42/66/199364266.db2.gz YMIJSHXCDJPFOA-DGCLKSJQSA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC000092073455 347609245 /nfs/dbraw/zinc/60/92/45/347609245.db2.gz ZDXRSCDHXIOTAN-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC000092073455 347609247 /nfs/dbraw/zinc/60/92/47/347609247.db2.gz ZDXRSCDHXIOTAN-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CC2(O)CCCC2)c([O-])c1 ZINC000093503179 347677687 /nfs/dbraw/zinc/67/76/87/347677687.db2.gz VYGMYTVUDIRTCO-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CC2(O)CCCC2)c([O-])c1 ZINC000093503179 347677692 /nfs/dbraw/zinc/67/76/92/347677692.db2.gz VYGMYTVUDIRTCO-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CC[C@H]([NH2+]CCC(C)(C)CO)c1ccccc1[O-] ZINC000294727358 199154301 /nfs/dbraw/zinc/15/43/01/199154301.db2.gz FZSNKAOQYCQBIF-ZDUSSCGKSA-N 0 3 251.370 2.842 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000294861673 199218694 /nfs/dbraw/zinc/21/86/94/199218694.db2.gz CAWWPJOZRXKRQM-NOZJJQNGSA-N 0 3 255.333 2.731 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@@H](CO)c2ccccc2)c1 ZINC000294923349 199250576 /nfs/dbraw/zinc/25/05/76/199250576.db2.gz BCISZISNBUCRIA-INIZCTEOSA-N 0 3 287.359 2.566 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCC[C@H]1CCO)CC2 ZINC000296438453 199892886 /nfs/dbraw/zinc/89/28/86/199892886.db2.gz MMVJMTKCMHTAME-YUTCNCBUSA-N 0 3 261.365 2.520 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CO)C1CCCC1)CC2 ZINC000297183838 200107788 /nfs/dbraw/zinc/10/77/88/200107788.db2.gz DZYSETMLEJXKQK-KGLIPLIRSA-N 0 3 261.365 2.520 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC[C@@H](C)CCO)c([O-])c1 ZINC000297296194 200138445 /nfs/dbraw/zinc/13/84/45/200138445.db2.gz MBUAEMDTWHKCPI-DGCLKSJQSA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)Cc1cccc(F)c1)c1ccccc1[O-] ZINC000297338769 200154326 /nfs/dbraw/zinc/15/43/26/200154326.db2.gz OIEUWXOOGCABAG-WFASDCNBSA-N 0 3 289.350 2.786 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297645805 200251018 /nfs/dbraw/zinc/25/10/18/200251018.db2.gz JYIPDYGRTHYCNK-OCCSQVGLSA-N 0 3 263.381 2.768 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2ccccn2)c([O-])c1 ZINC000020089273 372226385 /nfs/dbraw/zinc/22/63/85/372226385.db2.gz RYJJJKBBJXOIOS-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN COc1ccc(CC[NH2+]Cc2cccc(OC)c2[O-])cc1 ZINC000019907394 372206429 /nfs/dbraw/zinc/20/64/29/372206429.db2.gz YGHQXZMEADMQFS-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN CCOCCNCc1ccc(N(CC)CC)cc1 ZINC000036228403 372568014 /nfs/dbraw/zinc/56/80/14/372568014.db2.gz ZHTSTVJYMPJJNO-UHFFFAOYSA-N 0 3 250.386 2.659 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000038013586 372766550 /nfs/dbraw/zinc/76/65/50/372766550.db2.gz GNYPTLNBOKPVGP-JSGCOSHPSA-N 0 3 278.396 2.738 20 10 CFCDHN CC[C@@H](C)NC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000038014105 372768997 /nfs/dbraw/zinc/76/89/97/372768997.db2.gz RDRSAMTWXAOXCM-KGLIPLIRSA-N 0 3 291.439 2.708 20 10 CFCDHN CCC[C@@H](CC)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000050402770 373374916 /nfs/dbraw/zinc/37/49/16/373374916.db2.gz ZNNROJMMNVEREJ-LLVKDONJSA-N 0 3 251.326 2.789 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2CC(C)(C)OC2(C)C)c1 ZINC000089726078 374943110 /nfs/dbraw/zinc/94/31/10/374943110.db2.gz ZVKKIFVFPKVBAM-AWEZNQCLSA-N 0 3 279.380 2.837 20 10 CFCDHN Cc1nc(C2CC[NH+](Cc3cc(C)ccc3[O-])CC2)no1 ZINC000092787881 375154003 /nfs/dbraw/zinc/15/40/03/375154003.db2.gz LKUKQFRGKWSJKQ-UHFFFAOYSA-N 0 3 287.363 2.772 20 10 CFCDHN CCC[C@H](C)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658655 375577748 /nfs/dbraw/zinc/57/77/48/375577748.db2.gz YZZPIFDVUZQVDJ-JTQLQIEISA-N 0 3 251.326 2.741 20 10 CFCDHN CCC[C@H](C)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658655 375577755 /nfs/dbraw/zinc/57/77/55/375577755.db2.gz YZZPIFDVUZQVDJ-JTQLQIEISA-N 0 3 251.326 2.741 20 10 CFCDHN CCC[N@@H+]1CC[C@@H](CNCc2c([O-])cccc2Cl)C1 ZINC000113326835 376010879 /nfs/dbraw/zinc/01/08/79/376010879.db2.gz FEJSUNLQMORNDQ-LBPRGKRZSA-N 0 3 282.815 2.867 20 10 CFCDHN CCC[N@H+]1CC[C@@H](CNCc2c([O-])cccc2Cl)C1 ZINC000113326835 376010885 /nfs/dbraw/zinc/01/08/85/376010885.db2.gz FEJSUNLQMORNDQ-LBPRGKRZSA-N 0 3 282.815 2.867 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000113341571 376011256 /nfs/dbraw/zinc/01/12/56/376011256.db2.gz BVBTWJUIPSNQEH-OAHLLOKOSA-N 0 3 251.370 2.587 20 10 CFCDHN CCCOc1ccc(C[NH2+]C2(C)CCOCC2)c([O-])c1 ZINC000131118168 377661249 /nfs/dbraw/zinc/66/12/49/377661249.db2.gz UOXXLTXSJABBDX-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@H]3CCCC[C@@H]32)c1 ZINC000133465674 377931840 /nfs/dbraw/zinc/93/18/40/377931840.db2.gz DMNLGKQUXJUQGJ-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000133132394 377906752 /nfs/dbraw/zinc/90/67/52/377906752.db2.gz VHGYNWDWRMMEFS-AWEZNQCLSA-N 0 3 261.365 2.974 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2ccccc2[O-])C12CCC2 ZINC000135200117 378096813 /nfs/dbraw/zinc/09/68/13/378096813.db2.gz XTHWKOYTKYFVJY-LSDHHAIUSA-N 0 3 261.365 2.830 20 10 CFCDHN C[C@@H](NCc1ccc(C(N)=O)cc1)c1ccc(N(C)C)cc1 ZINC000154667953 378587770 /nfs/dbraw/zinc/58/77/70/378587770.db2.gz QOGAJPRNTDCXQI-CYBMUJFWSA-N 0 3 297.402 2.702 20 10 CFCDHN Cc1cccc(CN2CC(Cc3ccco3)C2)c1O ZINC000529649101 383742026 /nfs/dbraw/zinc/74/20/26/383742026.db2.gz OIKHYEXTQVYENO-UHFFFAOYSA-N 0 3 257.333 2.968 20 10 CFCDHN Cc1cccc(C[NH+]2CC(Cc3ccco3)C2)c1[O-] ZINC000529649101 383742030 /nfs/dbraw/zinc/74/20/30/383742030.db2.gz OIKHYEXTQVYENO-UHFFFAOYSA-N 0 3 257.333 2.968 20 10 CFCDHN CC(C)O[C@@]1(C)C[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000529669424 383745634 /nfs/dbraw/zinc/74/56/34/383745634.db2.gz MUKDSXDTTKUYRN-KGLIPLIRSA-N 0 3 253.317 2.577 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCCNC(=O)C(C)C)cc1 ZINC000178222860 380423838 /nfs/dbraw/zinc/42/38/38/380423838.db2.gz MXDUGEXMANUDKK-CQSZACIVSA-N 0 3 291.439 2.566 20 10 CFCDHN CC[C@H](C)[C@H](N)C(=O)NCc1ccc(N(CC)CC)cc1 ZINC000178712519 380479256 /nfs/dbraw/zinc/47/92/56/380479256.db2.gz GELMJSDSAXHVGD-BBRMVZONSA-N 0 3 291.439 2.522 20 10 CFCDHN COc1ccc(N2CCN(C3CCCC3)CC2)cc1 ZINC000179296771 380528635 /nfs/dbraw/zinc/52/86/35/380528635.db2.gz JXCUGSMVOSMCDC-UHFFFAOYSA-N 0 3 260.381 2.760 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]1CN1CCCCC1 ZINC000179562285 380555832 /nfs/dbraw/zinc/55/58/32/380555832.db2.gz XZTFKFCDAOCKPK-INIZCTEOSA-N 0 3 274.408 2.843 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]1CN1CCCCC1 ZINC000179562285 380555837 /nfs/dbraw/zinc/55/58/37/380555837.db2.gz XZTFKFCDAOCKPK-INIZCTEOSA-N 0 3 274.408 2.843 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@@H+](C2CC2)CC1 ZINC000179730192 380574156 /nfs/dbraw/zinc/57/41/56/380574156.db2.gz XIPWLCCPZAEYAE-UHFFFAOYSA-N 0 3 280.799 2.716 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@H+](C2CC2)CC1 ZINC000179730192 380574161 /nfs/dbraw/zinc/57/41/61/380574161.db2.gz XIPWLCCPZAEYAE-UHFFFAOYSA-N 0 3 280.799 2.716 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@@H](C)C2CC2)cc1OC ZINC000179714794 380574551 /nfs/dbraw/zinc/57/45/51/380574551.db2.gz QGJXWUOILVSZJH-JTQLQIEISA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@@H](C)C2CC2)cc1OC ZINC000179714794 380574558 /nfs/dbraw/zinc/57/45/58/380574558.db2.gz QGJXWUOILVSZJH-JTQLQIEISA-N 0 3 265.353 2.640 20 10 CFCDHN COC(=O)[C@H](C)C[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179774134 380580809 /nfs/dbraw/zinc/58/08/09/380580809.db2.gz MAILDXNBXUUGID-SNVBAGLBSA-N 0 3 285.771 2.595 20 10 CFCDHN COC(=O)[C@H](C)C[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179774134 380580814 /nfs/dbraw/zinc/58/08/14/380580814.db2.gz MAILDXNBXUUGID-SNVBAGLBSA-N 0 3 285.771 2.595 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1ccccc1[O-] ZINC000179889953 380592256 /nfs/dbraw/zinc/59/22/56/380592256.db2.gz KPDSLKKBCJNIRZ-BZNIZROVSA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000180866341 380709172 /nfs/dbraw/zinc/70/91/72/380709172.db2.gz YTDRRHHOMGTBSC-MNOVXSKESA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000180866341 380709174 /nfs/dbraw/zinc/70/91/74/380709174.db2.gz YTDRRHHOMGTBSC-MNOVXSKESA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cccnc1C1(C[NH2+]Cc2ccccc2[O-])CC1 ZINC000368262390 380973072 /nfs/dbraw/zinc/97/30/72/380973072.db2.gz XVADYXFARGBKMM-UHFFFAOYSA-N 0 3 268.360 2.917 20 10 CFCDHN CCOc1cccc(C[N@H+](CC2CCC2)[C@@H](C)CO)c1[O-] ZINC000289371873 381033493 /nfs/dbraw/zinc/03/34/93/381033493.db2.gz LNOBROVOCJIXSF-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC2CCC2)[C@@H](C)CO)c1[O-] ZINC000289371873 381033499 /nfs/dbraw/zinc/03/34/99/381033499.db2.gz LNOBROVOCJIXSF-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+]Cc1cccc(C)c1[O-] ZINC000182461831 381093427 /nfs/dbraw/zinc/09/34/27/381093427.db2.gz UIFFGMCJPVTZQJ-LBPRGKRZSA-N 0 3 273.380 2.631 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)c1[O-] ZINC000182635530 381126798 /nfs/dbraw/zinc/12/67/98/381126798.db2.gz YIQLIVRKBFFJDU-ZBFHGGJFSA-N 0 3 293.432 2.845 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)c1ccccc1)CC2 ZINC000296012551 381210267 /nfs/dbraw/zinc/21/02/67/381210267.db2.gz OZYMIGDCHAUYSX-GOEBONIOSA-N 0 3 269.344 2.703 20 10 CFCDHN CCNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000183419912 381270411 /nfs/dbraw/zinc/27/04/11/381270411.db2.gz KAZQPFDEJPOQOY-ZDUSSCGKSA-N 0 3 298.386 2.993 20 10 CFCDHN CC[C@H](C[NH2+][C@H](C)c1ccccc1[O-])N1CCCC1 ZINC000183410421 381269644 /nfs/dbraw/zinc/26/96/44/381269644.db2.gz BAHJXRKDCQAERW-ZIAGYGMSSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](C3(C)OCCO3)C2)c1 ZINC000183245057 381244387 /nfs/dbraw/zinc/24/43/87/381244387.db2.gz XCVQUJDTCPDZPC-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c1 ZINC000183245057 381244393 /nfs/dbraw/zinc/24/43/93/381244393.db2.gz XCVQUJDTCPDZPC-OAHLLOKOSA-N 0 3 291.391 2.676 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183628655 381297869 /nfs/dbraw/zinc/29/78/69/381297869.db2.gz IOESOCZALOGZHS-GFCCVEGCSA-N 0 3 251.370 2.842 20 10 CFCDHN CCN1CCCC[C@H]1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183506981 381281172 /nfs/dbraw/zinc/28/11/72/381281172.db2.gz VMCPSHDNMULWNX-KBPBESRZSA-N 0 3 262.397 2.917 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000183545167 381285606 /nfs/dbraw/zinc/28/56/06/381285606.db2.gz YRIDLRWYZFPGKW-DZGCQCFKSA-N 0 3 271.360 2.819 20 10 CFCDHN CC(C)(C)[C@@H](CCO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296308167 381340614 /nfs/dbraw/zinc/34/06/14/381340614.db2.gz DZAZQLAIIYEXMQ-TZMCWYRMSA-N 0 3 263.381 2.766 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CCCCN1C1CC1)CC2 ZINC000296249861 381320121 /nfs/dbraw/zinc/32/01/21/381320121.db2.gz BFKAAKJLKVGQPL-CVEARBPZSA-N 0 3 286.419 2.986 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC(C)(CO)CC2)c([O-])c1 ZINC000184075086 381368482 /nfs/dbraw/zinc/36/84/82/381368482.db2.gz YQBFZPZKRIAQPR-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000296465629 381408532 /nfs/dbraw/zinc/40/85/32/381408532.db2.gz OBHKJDJVIOWDAR-AWEZNQCLSA-N 0 3 297.358 2.523 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])[C@H](O)C(F)F ZINC000296444703 381399993 /nfs/dbraw/zinc/39/99/93/381399993.db2.gz MNDUTKQRSGXBAZ-GAFUQQFSSA-N 0 3 273.323 2.756 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000296531070 381435958 /nfs/dbraw/zinc/43/59/58/381435958.db2.gz QLSATTLUKGTJGO-ABAIWWIYSA-N 0 3 296.386 2.685 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CO)Cc1ccccc1)CC2 ZINC000296490820 381418285 /nfs/dbraw/zinc/41/82/85/381418285.db2.gz PPSXHMBLWOZYRK-HZPDHXFCSA-N 0 3 283.371 2.573 20 10 CFCDHN COCCC[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184840916 381485973 /nfs/dbraw/zinc/48/59/73/381485973.db2.gz QOHKECIQJLKEJL-LBPRGKRZSA-N 0 3 263.381 2.958 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)[nH]n1 ZINC000296979605 381548779 /nfs/dbraw/zinc/54/87/79/381548779.db2.gz RVWIEQJAGRBBEV-QMTHXVAHSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)n[nH]1 ZINC000296979605 381548784 /nfs/dbraw/zinc/54/87/84/381548784.db2.gz RVWIEQJAGRBBEV-QMTHXVAHSA-N 0 3 271.364 2.632 20 10 CFCDHN CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000297836847 381573245 /nfs/dbraw/zinc/57/32/45/381573245.db2.gz SEJDHMXNPZNZOA-KFWWJZLASA-N 0 3 274.408 2.842 20 10 CFCDHN Cc1noc(C)c1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297877768 381574085 /nfs/dbraw/zinc/57/40/85/381574085.db2.gz UVVLMEGZQWLMGN-CQSZACIVSA-N 0 3 272.348 2.817 20 10 CFCDHN CCCC[N@H+](CCc1cn[nH]c1)Cc1ccccc1[O-] ZINC000297659106 381569659 /nfs/dbraw/zinc/56/96/59/381569659.db2.gz NSCRGJSIIUQTIU-UHFFFAOYSA-N 0 3 273.380 2.960 20 10 CFCDHN CCCC[N@@H+](CCc1cn[nH]c1)Cc1ccccc1[O-] ZINC000297659106 381569666 /nfs/dbraw/zinc/56/96/66/381569666.db2.gz NSCRGJSIIUQTIU-UHFFFAOYSA-N 0 3 273.380 2.960 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)Cc2ccccc2)c1 ZINC000185370145 381615783 /nfs/dbraw/zinc/61/57/83/381615783.db2.gz RBRMZEQMOGPYJU-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@H]2Cn2cccn2)c1[O-] ZINC000371426323 381622778 /nfs/dbraw/zinc/62/27/78/381622778.db2.gz PHAMHNFWKKLTNN-INIZCTEOSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@H]2Cn2cccn2)c1[O-] ZINC000371426323 381622783 /nfs/dbraw/zinc/62/27/83/381622783.db2.gz PHAMHNFWKKLTNN-INIZCTEOSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000371469083 381633751 /nfs/dbraw/zinc/63/37/51/381633751.db2.gz CYEXEZWVCCBBIA-NUEKZKHPSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1[O-] ZINC000371469083 381633755 /nfs/dbraw/zinc/63/37/55/381633755.db2.gz CYEXEZWVCCBBIA-NUEKZKHPSA-N 0 3 275.392 2.946 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H](C)O)c1cc2c(cc1[O-])CCCC2 ZINC000185456414 381638724 /nfs/dbraw/zinc/63/87/24/381638724.db2.gz VGOQZYYYBPZRGV-NWDGAFQWSA-N 0 3 263.381 2.693 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c([O-])c1 ZINC000185475596 381643796 /nfs/dbraw/zinc/64/37/96/381643796.db2.gz YFWSAZNZXRZESX-BLVKFPJESA-N 0 3 283.437 2.898 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)C[C@@H](C)O)c1 ZINC000185521008 381656163 /nfs/dbraw/zinc/65/61/63/381656163.db2.gz YQSKMEWFMZRABK-YNEHKIRRSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1[O-] ZINC000360042750 381746594 /nfs/dbraw/zinc/74/65/94/381746594.db2.gz YELGLIWQKOEKRB-BMFZPTHFSA-N 0 3 275.392 2.994 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000186143937 381833335 /nfs/dbraw/zinc/83/33/35/381833335.db2.gz JCKUZXRROMQVJR-JQWIXIFHSA-N 0 3 269.360 2.979 20 10 CFCDHN COCCCCN1CC=C(c2ccc(N(C)C)cc2)C1 ZINC000372806768 381871877 /nfs/dbraw/zinc/87/18/77/381871877.db2.gz WLEHLYHUNPJYAW-UHFFFAOYSA-N 0 3 274.408 2.878 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cc(C)ccc2[O-])C1 ZINC000186457549 381917904 /nfs/dbraw/zinc/91/79/04/381917904.db2.gz PVNNIFNFQZTWRD-STQMWFEESA-N 0 3 292.379 2.582 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC(C)(C)OCC)c1 ZINC000186539903 381940872 /nfs/dbraw/zinc/94/08/72/381940872.db2.gz FZKCSLNCINJUSP-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](n3cccn3)C2)c1[O-] ZINC000373220242 381954184 /nfs/dbraw/zinc/95/41/84/381954184.db2.gz ZDJROJGWXXGIFX-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](n3cccn3)C2)c1[O-] ZINC000373220242 381954191 /nfs/dbraw/zinc/95/41/91/381954191.db2.gz ZDJROJGWXXGIFX-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1[O-] ZINC000375805477 382104015 /nfs/dbraw/zinc/10/40/15/382104015.db2.gz MDRYQTKCEVSVIR-JSGCOSHPSA-N 0 3 289.354 2.853 20 10 CFCDHN C[C@H]1[N@H+](Cc2ccccc2[O-])CCC12CCOCC2 ZINC000375240465 382072914 /nfs/dbraw/zinc/07/29/14/382072914.db2.gz XIAUKKUOYITJNK-CYBMUJFWSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@H]1[N@@H+](Cc2ccccc2[O-])CCC12CCOCC2 ZINC000375240465 382072919 /nfs/dbraw/zinc/07/29/19/382072919.db2.gz XIAUKKUOYITJNK-CYBMUJFWSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1ccc(O)c(CN2CCC[C@@H](OCC3CC3)C2)c1 ZINC000375287786 382076139 /nfs/dbraw/zinc/07/61/39/382076139.db2.gz ORUCLGLNLDGLAY-MRXNPFEDSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000375287786 382076148 /nfs/dbraw/zinc/07/61/48/382076148.db2.gz ORUCLGLNLDGLAY-MRXNPFEDSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000375287786 382076175 /nfs/dbraw/zinc/07/61/75/382076175.db2.gz ORUCLGLNLDGLAY-MRXNPFEDSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000375301595 382078073 /nfs/dbraw/zinc/07/80/73/382078073.db2.gz GXTVFYGHTXIWJL-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000375301595 382078077 /nfs/dbraw/zinc/07/80/77/382078077.db2.gz GXTVFYGHTXIWJL-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](O)C23CCCC3)c1[O-] ZINC000293510966 382151340 /nfs/dbraw/zinc/15/13/40/382151340.db2.gz ADIGUULKDPRGSV-OAHLLOKOSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c1[O-] ZINC000293510966 382151346 /nfs/dbraw/zinc/15/13/46/382151346.db2.gz ADIGUULKDPRGSV-OAHLLOKOSA-N 0 3 291.391 2.670 20 10 CFCDHN CN(C)c1ccc(CNCc2cnc3n2CCCC3)cc1 ZINC000377116644 382219917 /nfs/dbraw/zinc/21/99/17/382219917.db2.gz WPFZLMGDJGTSRF-UHFFFAOYSA-N 0 3 284.407 2.575 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(c3c[nH]cn3)CC2)c1 ZINC000377231624 382237874 /nfs/dbraw/zinc/23/78/74/382237874.db2.gz KOGVKHNECFMHDW-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1Cc2ccccc2O1 ZINC000363879557 382248740 /nfs/dbraw/zinc/24/87/40/382248740.db2.gz PCVGPYGLSPEKMU-HNNXBMFYSA-N 0 3 269.344 2.828 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1Cc2ccccc2O1 ZINC000363879557 382248745 /nfs/dbraw/zinc/24/87/45/382248745.db2.gz PCVGPYGLSPEKMU-HNNXBMFYSA-N 0 3 269.344 2.828 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC3(CCOCC3)[C@@H]2C)c1[O-] ZINC000363870688 382249471 /nfs/dbraw/zinc/24/94/71/382249471.db2.gz WXNABWFXHCKLRP-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC3(CCOCC3)[C@@H]2C)c1[O-] ZINC000363870688 382249478 /nfs/dbraw/zinc/24/94/78/382249478.db2.gz WXNABWFXHCKLRP-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN COC[C@H]1CCN1Cc1ccc(N2CCCCC2)cc1 ZINC000293722526 382251140 /nfs/dbraw/zinc/25/11/40/382251140.db2.gz UCRZNXRLPONBSD-QGZVFWFLSA-N 0 3 274.408 2.898 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1[O-] ZINC000293751083 382262968 /nfs/dbraw/zinc/26/29/68/382262968.db2.gz RISQHFIQLPBZQZ-GXTWGEPZSA-N 0 3 250.386 2.631 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000293774261 382273687 /nfs/dbraw/zinc/27/36/87/382273687.db2.gz SLKXJVCUQVTDPO-KBPBESRZSA-N 0 3 292.423 2.904 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000377633985 382307824 /nfs/dbraw/zinc/30/78/24/382307824.db2.gz WESRWBMANAPYOP-SUMWQHHRSA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000377633985 382307832 /nfs/dbraw/zinc/30/78/32/382307832.db2.gz WESRWBMANAPYOP-SUMWQHHRSA-N 0 3 291.391 2.964 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@@H](O)C2)c1[O-] ZINC000187982653 382315163 /nfs/dbraw/zinc/31/51/63/382315163.db2.gz RLNDOCHHNXJNRL-ZWNOBZJWSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1 ZINC000293889309 382323197 /nfs/dbraw/zinc/32/31/97/382323197.db2.gz VUONIHCQYUPFFY-ZDUSSCGKSA-N 0 3 298.386 2.959 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@H](C)O[C@@]2(CCOC2)C1 ZINC000377700756 382325876 /nfs/dbraw/zinc/32/58/76/382325876.db2.gz RTZJNWJMXYTHNS-LXZKKBNFSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@H](C)O[C@@]2(CCOC2)C1 ZINC000377700756 382325882 /nfs/dbraw/zinc/32/58/82/382325882.db2.gz RTZJNWJMXYTHNS-LXZKKBNFSA-N 0 3 291.391 2.723 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@]2(CO)CC(C)C)c1 ZINC000188037615 382331132 /nfs/dbraw/zinc/33/11/32/382331132.db2.gz QKXQPTYYRLAVDV-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@]2(CO)CC(C)C)c1 ZINC000188037615 382331138 /nfs/dbraw/zinc/33/11/38/382331138.db2.gz QKXQPTYYRLAVDV-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c([O-])c1C ZINC000377803360 382349869 /nfs/dbraw/zinc/34/98/69/382349869.db2.gz VKVUDCRXROGYPA-QWHCGFSZSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCSCCCO)c([O-])c1 ZINC000293960335 382354458 /nfs/dbraw/zinc/35/44/58/382354458.db2.gz ZWKOQCIYXQDTHJ-CYBMUJFWSA-N 0 3 283.437 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](O)C23CCCC3)c1 ZINC000293997088 382371428 /nfs/dbraw/zinc/37/14/28/382371428.db2.gz SOQCWMXYTLZEEO-INIZCTEOSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](O)C23CCCC3)c1 ZINC000293997088 382371432 /nfs/dbraw/zinc/37/14/32/382371432.db2.gz SOQCWMXYTLZEEO-INIZCTEOSA-N 0 3 291.391 2.670 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCc2cn[nH]c2)c([O-])c1 ZINC000294039239 382389534 /nfs/dbraw/zinc/38/95/34/382389534.db2.gz FYWKDOYCYCZTKI-GFCCVEGCSA-N 0 3 259.353 2.625 20 10 CFCDHN CCOc1cccc(CN2CCC[C@H]2CF)c1O ZINC000294122629 382425078 /nfs/dbraw/zinc/42/50/78/382425078.db2.gz UATGHAKTNGPJHE-LBPRGKRZSA-N 0 3 253.317 2.725 20 10 CFCDHN c1cc(N2CCCCC2)ccc1CN1CC2(C1)CCOC2 ZINC000294136419 382429108 /nfs/dbraw/zinc/42/91/08/382429108.db2.gz UTAIKHFABUTWRB-UHFFFAOYSA-N 0 3 286.419 2.899 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1C[C@H]3CCCCC[C@@H]31)OCO2 ZINC000378345175 382442055 /nfs/dbraw/zinc/44/20/55/382442055.db2.gz HWMUSBRSGOYVHS-YPMHNXCESA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1C[C@H]3CCCCC[C@@H]31)OCO2 ZINC000378345175 382442059 /nfs/dbraw/zinc/44/20/59/382442059.db2.gz HWMUSBRSGOYVHS-YPMHNXCESA-N 0 3 275.348 2.885 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@](CO)(C(C)C)C2)cc1C ZINC000378126826 382402563 /nfs/dbraw/zinc/40/25/63/382402563.db2.gz COGBMKSQGHIMJN-QGZVFWFLSA-N 0 3 277.408 2.849 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@](CO)(C(C)C)C2)cc1C ZINC000378126826 382402567 /nfs/dbraw/zinc/40/25/67/382402567.db2.gz COGBMKSQGHIMJN-QGZVFWFLSA-N 0 3 277.408 2.849 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C[C@@H]21 ZINC000378472365 382468241 /nfs/dbraw/zinc/46/82/41/382468241.db2.gz IMPCXJHQZOXQMZ-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3cccc(Cl)c3[O-])C[C@@H]21 ZINC000378472365 382468242 /nfs/dbraw/zinc/46/82/42/382468242.db2.gz IMPCXJHQZOXQMZ-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000378626943 382493241 /nfs/dbraw/zinc/49/32/41/382493241.db2.gz AFMWUNJQSUZESB-HNNXBMFYSA-N 0 3 268.360 2.852 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000378626943 382493247 /nfs/dbraw/zinc/49/32/47/382493247.db2.gz AFMWUNJQSUZESB-HNNXBMFYSA-N 0 3 268.360 2.852 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cc(C)ccc1[O-])OC ZINC000294298435 382500342 /nfs/dbraw/zinc/50/03/42/382500342.db2.gz UUNMBFVFTFMAFL-WFASDCNBSA-N 0 3 251.370 2.851 20 10 CFCDHN CS[C@@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000294920770 382543182 /nfs/dbraw/zinc/54/31/82/382543182.db2.gz AVGQPNJIZUDLCW-CYBMUJFWSA-N 0 3 251.395 2.946 20 10 CFCDHN CS[C@@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000294920770 382543187 /nfs/dbraw/zinc/54/31/87/382543187.db2.gz AVGQPNJIZUDLCW-CYBMUJFWSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCc2ncccc2C)c1 ZINC000294962567 382553444 /nfs/dbraw/zinc/55/34/44/382553444.db2.gz IKKUAGDXFVLZFH-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)[C@H](C(=O)OC)C1 ZINC000367306941 382563734 /nfs/dbraw/zinc/56/37/34/382563734.db2.gz BTEZHUVYAJGBDY-MRVWCRGKSA-N 0 3 277.364 2.584 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)[C@H](C(=O)OC)C1 ZINC000367306941 382563736 /nfs/dbraw/zinc/56/37/36/382563736.db2.gz BTEZHUVYAJGBDY-MRVWCRGKSA-N 0 3 277.364 2.584 20 10 CFCDHN CCC(=O)N1CCC[N@@H+]([C@H](CC)c2ccccc2[O-])CC1 ZINC000367322892 382564189 /nfs/dbraw/zinc/56/41/89/382564189.db2.gz WXKVMIFZDLVGCQ-OAHLLOKOSA-N 0 3 290.407 2.788 20 10 CFCDHN CCC(=O)N1CCC[N@H+]([C@H](CC)c2ccccc2[O-])CC1 ZINC000367322892 382564196 /nfs/dbraw/zinc/56/41/96/382564196.db2.gz WXKVMIFZDLVGCQ-OAHLLOKOSA-N 0 3 290.407 2.788 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H](OC)[C@H](C)CC)c1 ZINC000294841760 382533969 /nfs/dbraw/zinc/53/39/69/382533969.db2.gz RCOVYPWEOUTTBD-WBMJQRKESA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000190221455 382657744 /nfs/dbraw/zinc/65/77/44/382657744.db2.gz RHGFDIBPYWKMBY-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000190221455 382657745 /nfs/dbraw/zinc/65/77/45/382657745.db2.gz RHGFDIBPYWKMBY-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN CCC(=O)CC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000190294572 382660926 /nfs/dbraw/zinc/66/09/26/382660926.db2.gz HHIKRQCEDZDELY-MRXNPFEDSA-N 0 3 291.391 2.742 20 10 CFCDHN CCC(=O)CC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000190294572 382660928 /nfs/dbraw/zinc/66/09/28/382660928.db2.gz HHIKRQCEDZDELY-MRXNPFEDSA-N 0 3 291.391 2.742 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@@H](C)CC2)c1[O-] ZINC000190694633 382678228 /nfs/dbraw/zinc/67/82/28/382678228.db2.gz ILWDELQTGPZPHJ-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@@H](C)CC2)c1[O-] ZINC000190694633 382678230 /nfs/dbraw/zinc/67/82/30/382678230.db2.gz ILWDELQTGPZPHJ-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCS[C@H]3COCC[C@H]32)cc1C ZINC000247291022 383160060 /nfs/dbraw/zinc/16/00/60/383160060.db2.gz UENIJDGBTLFBSU-ZBFHGGJFSA-N 0 3 293.432 2.715 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCS[C@H]3COCC[C@H]32)cc1C ZINC000247291022 383160067 /nfs/dbraw/zinc/16/00/67/383160067.db2.gz UENIJDGBTLFBSU-ZBFHGGJFSA-N 0 3 293.432 2.715 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000249372088 383342758 /nfs/dbraw/zinc/34/27/58/383342758.db2.gz CWFPHBPKDKSFLN-KGLIPLIRSA-N 0 3 262.397 2.693 20 10 CFCDHN COc1ccc(CNCCC(=O)OC(C)(C)C)cc1C ZINC000266129679 384088131 /nfs/dbraw/zinc/08/81/31/384088131.db2.gz CMCFFTIJVPOKAD-UHFFFAOYSA-N 0 3 279.380 2.825 20 10 CFCDHN CN(C)c1ccc(CNCc2ccn(C)c2)cc1F ZINC000267086691 384297371 /nfs/dbraw/zinc/29/73/71/384297371.db2.gz LMQNUQIXMHQIFK-UHFFFAOYSA-N 0 3 261.344 2.520 20 10 CFCDHN CC[C@@](C)(CCO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000268536870 384629839 /nfs/dbraw/zinc/62/98/39/384629839.db2.gz JRDIUOIPBYXNPG-HNNXBMFYSA-N 0 3 251.370 2.650 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])c1ccc([S@](C)=O)cc1 ZINC000268824192 384670687 /nfs/dbraw/zinc/67/06/87/384670687.db2.gz KUEXXWTUFBFREW-ODXCJYRJSA-N 0 3 289.400 2.980 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NC[C@@H](O)C(F)(F)F)cc1 ZINC000268859550 384679865 /nfs/dbraw/zinc/67/98/65/384679865.db2.gz RPOJTFAIYRBOAV-ZWNOBZJWSA-N 0 3 290.329 2.717 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCc3cn[nH]c32)cc1F ZINC000268883945 384684519 /nfs/dbraw/zinc/68/45/19/384684519.db2.gz YPWUBPYIMABVRI-AWEZNQCLSA-N 0 3 288.370 2.782 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CCO)C2CCCCC2)c1 ZINC000269362366 384752342 /nfs/dbraw/zinc/75/23/42/384752342.db2.gz PIZBJSXSOWWFOH-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CCO)C2CCCCC2)c1 ZINC000269362366 384752346 /nfs/dbraw/zinc/75/23/46/384752346.db2.gz PIZBJSXSOWWFOH-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)CC2CCC2)c1 ZINC000281203128 385187499 /nfs/dbraw/zinc/18/74/99/385187499.db2.gz SENXCGIUQKWOSS-YPMHNXCESA-N 0 3 279.380 2.603 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000282180291 385238476 /nfs/dbraw/zinc/23/84/76/385238476.db2.gz FQEUMVUMHXUIRW-ZWNOBZJWSA-N 0 3 253.317 2.531 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000282180291 385238485 /nfs/dbraw/zinc/23/84/85/385238485.db2.gz FQEUMVUMHXUIRW-ZWNOBZJWSA-N 0 3 253.317 2.531 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2([S@](C)=O)CC2)c([O-])c1C ZINC000282241823 385257893 /nfs/dbraw/zinc/25/78/93/385257893.db2.gz JBLBFCLSWIYBPS-BUXKBTBVSA-N 0 3 281.421 2.571 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2([S@](C)=O)CC2)c([O-])c1C ZINC000282241820 385257990 /nfs/dbraw/zinc/25/79/90/385257990.db2.gz JBLBFCLSWIYBPS-BLVKFPJESA-N 0 3 281.421 2.571 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@@H](O)C1 ZINC000271024503 385307214 /nfs/dbraw/zinc/30/72/14/385307214.db2.gz CPKAYLDLOSIPNK-MRXNPFEDSA-N 0 3 269.344 2.626 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@H](O)C1 ZINC000271024503 385307219 /nfs/dbraw/zinc/30/72/19/385307219.db2.gz CPKAYLDLOSIPNK-MRXNPFEDSA-N 0 3 269.344 2.626 20 10 CFCDHN CCCCN(CC(=O)NC(C)(C)C)Cc1ccccc1O ZINC000282433104 385310044 /nfs/dbraw/zinc/31/00/44/385310044.db2.gz KFMVXLZFRHACCV-UHFFFAOYSA-N 0 3 292.423 2.909 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C2(CN(C)C)CCC2)cc1C ZINC000282379178 385298450 /nfs/dbraw/zinc/29/84/50/385298450.db2.gz XITDFVXVUCULKO-UHFFFAOYSA-N 0 3 262.397 2.583 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](OC)C[C@@H]2C)c1 ZINC000282390050 385299742 /nfs/dbraw/zinc/29/97/42/385299742.db2.gz RCUUKPCZMPFTOP-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](OC)C[C@@H]2C)c1 ZINC000282390050 385299746 /nfs/dbraw/zinc/29/97/46/385299746.db2.gz RCUUKPCZMPFTOP-JSGCOSHPSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1ccc(O)c(CN[C@H](CCO)c2ccccc2)c1 ZINC000271814500 385394212 /nfs/dbraw/zinc/39/42/12/385394212.db2.gz LSOJIGJOZHRPJJ-MRXNPFEDSA-N 0 3 287.359 2.614 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@](C)(O)c2ccsc2)c1[O-] ZINC000271840875 385394270 /nfs/dbraw/zinc/39/42/70/385394270.db2.gz QUTOWFOONCBAAD-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN CCC(CC)(CCO)[NH2+]Cc1cc(C)ccc1[O-] ZINC000283031364 385426077 /nfs/dbraw/zinc/42/60/77/385426077.db2.gz QIUKROPRFZFMLU-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000272215754 385476851 /nfs/dbraw/zinc/47/68/51/385476851.db2.gz BDXUUDUATUAMHP-UHFFFAOYSA-N 0 3 275.327 2.634 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)nn1C)c1ccccc1[O-] ZINC000284465569 385549077 /nfs/dbraw/zinc/54/90/77/385549077.db2.gz UDSXWFDQZCKUIM-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)CN2CCCC2=O)c([O-])c1 ZINC000284275179 385546796 /nfs/dbraw/zinc/54/67/96/385546796.db2.gz XBSNJHLSJZNNCW-KBPBESRZSA-N 0 3 290.407 2.671 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1[O-] ZINC000284337541 385547580 /nfs/dbraw/zinc/54/75/80/385547580.db2.gz MPFQYADJLYAZPA-DUVNUKRYSA-N 0 3 295.423 2.591 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000284996168 385551494 /nfs/dbraw/zinc/55/14/94/385551494.db2.gz JELYYTZCNZKJNT-ZIAGYGMSSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000284996168 385551498 /nfs/dbraw/zinc/55/14/98/385551498.db2.gz JELYYTZCNZKJNT-ZIAGYGMSSA-N 0 3 277.364 2.544 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CC(=O)N(C(C)C)C2)c([O-])c1 ZINC000285159863 385553062 /nfs/dbraw/zinc/55/30/62/385553062.db2.gz MOGPXJGIPIXDKR-ZIAGYGMSSA-N 0 3 290.407 2.669 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000285358948 385554690 /nfs/dbraw/zinc/55/46/90/385554690.db2.gz YWCUFEMGKWTBMQ-HUUCEWRRSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1[O-] ZINC000285358948 385554693 /nfs/dbraw/zinc/55/46/93/385554693.db2.gz YWCUFEMGKWTBMQ-HUUCEWRRSA-N 0 3 291.391 2.934 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000285406301 385555241 /nfs/dbraw/zinc/55/52/41/385555241.db2.gz FMCNETRVDPFKPZ-KBPBESRZSA-N 0 3 293.407 2.943 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)c1 ZINC000272593346 385572355 /nfs/dbraw/zinc/57/23/55/385572355.db2.gz ICFHSEATBLFFAZ-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c1 ZINC000272593346 385572358 /nfs/dbraw/zinc/57/23/58/385572358.db2.gz ICFHSEATBLFFAZ-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000272813193 385623479 /nfs/dbraw/zinc/62/34/79/385623479.db2.gz DKOWJWSVVIRFLP-ABAIWWIYSA-N 0 3 275.323 2.916 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c1 ZINC000273167235 385672029 /nfs/dbraw/zinc/67/20/29/385672029.db2.gz LQOLSAHNUQAXPI-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN COC[C@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273304007 385676872 /nfs/dbraw/zinc/67/68/72/385676872.db2.gz CHNYEUNMTRXDSI-MFKMUULPSA-N 0 3 251.370 2.942 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCOC1)c1cc2c(cc1[O-])CCCC2 ZINC000273384848 385680580 /nfs/dbraw/zinc/68/05/80/385680580.db2.gz JCRJZLYGDIKXOU-CHWSQXEVSA-N 0 3 275.392 2.958 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCOC1)c1cc2c(cc1[O-])CCCC2 ZINC000273384855 385680757 /nfs/dbraw/zinc/68/07/57/385680757.db2.gz JCRJZLYGDIKXOU-STQMWFEESA-N 0 3 275.392 2.958 20 10 CFCDHN COC[C@H](C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2)OC ZINC000273381566 385681315 /nfs/dbraw/zinc/68/13/15/385681315.db2.gz CEFHRTGHWADCRG-DOMZBBRYSA-N 0 3 293.407 2.583 20 10 CFCDHN Cc1noc(CCC[NH2+][C@H](C)c2cc(C)ccc2[O-])n1 ZINC000273508659 385685652 /nfs/dbraw/zinc/68/56/52/385685652.db2.gz RIKHMTAEJNEFMF-LLVKDONJSA-N 0 3 275.352 2.675 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)C(C)C)c([O-])c1C ZINC000273557803 385687682 /nfs/dbraw/zinc/68/76/82/385687682.db2.gz HHYXEVJWMKUGEE-TZMCWYRMSA-N 0 3 251.370 2.677 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CCCO)c([O-])c1C ZINC000273579234 385689113 /nfs/dbraw/zinc/68/91/13/385689113.db2.gz MFTADGBKAJIRDQ-YPMHNXCESA-N 0 3 251.370 2.821 20 10 CFCDHN COc1ccc(CN[C@H]2COc3ccccc3[C@H]2O)cc1C ZINC000288504577 197096956 /nfs/dbraw/zinc/09/69/56/197096956.db2.gz IGIDNTWRHYYLPT-MAUKXSAKSA-N 0 3 299.370 2.588 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@H]1CCO)CC2 ZINC000296438446 285264431 /nfs/dbraw/zinc/26/44/31/285264431.db2.gz MMVJMTKCMHTAME-IACUBPJLSA-N 0 3 261.365 2.520 20 10 CFCDHN CCn1cc([C@H](C)NCc2ccc3c(c2)CCN3C)cn1 ZINC000372422325 393447482 /nfs/dbraw/zinc/44/74/82/393447482.db2.gz PIRICEWBHRFGGG-ZDUSSCGKSA-N 0 3 284.407 2.746 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCCC2(C)C)cc1OC ZINC000179954846 393473550 /nfs/dbraw/zinc/47/35/50/393473550.db2.gz YSPBVFLNCIOHRR-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCCC2(C)C)cc1OC ZINC000179954846 393473565 /nfs/dbraw/zinc/47/35/65/393473565.db2.gz YSPBVFLNCIOHRR-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)Cc2ccc(O)cc2)c1[O-] ZINC000105446964 393863698 /nfs/dbraw/zinc/86/36/98/393863698.db2.gz OVLNJDIBXYXDBJ-LBPRGKRZSA-N 0 3 287.359 2.827 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCc2ccccn2)c1[O-] ZINC000120806887 393940536 /nfs/dbraw/zinc/94/05/36/393940536.db2.gz WFXZDKHTXIUOIT-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCc2ccccn2)c1[O-] ZINC000120806887 393940541 /nfs/dbraw/zinc/94/05/41/393940541.db2.gz WFXZDKHTXIUOIT-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CCc2ccccn2)c1 ZINC000120808490 393942016 /nfs/dbraw/zinc/94/20/16/393942016.db2.gz NFCSCEPJFJEXTQ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CCc2ccccn2)c1 ZINC000120808490 393942020 /nfs/dbraw/zinc/94/20/20/393942020.db2.gz NFCSCEPJFJEXTQ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN C[C@H]([NH2+]CCc1cn2c(n1)SCC2)c1ccccc1[O-] ZINC000274371884 394042182 /nfs/dbraw/zinc/04/21/82/394042182.db2.gz KWYOTBVNBXWLQF-NSHDSACASA-N 0 3 289.404 2.588 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(F)cc1[O-] ZINC000286001704 394177570 /nfs/dbraw/zinc/17/75/70/394177570.db2.gz IRMOWPVCGFVAAT-SMDDNHRTSA-N 0 3 268.376 2.912 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H]2CCN(C)C[C@H]2C)cc1C ZINC000290553830 394230767 /nfs/dbraw/zinc/23/07/67/394230767.db2.gz RYWONLUKQNHJLY-GDBMZVCRSA-N 0 3 276.424 2.781 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H]2CCN(C)C[C@H]2C)cc1C ZINC000290553830 394230769 /nfs/dbraw/zinc/23/07/69/394230769.db2.gz RYWONLUKQNHJLY-GDBMZVCRSA-N 0 3 276.424 2.781 20 10 CFCDHN C[N@@H+]1CC[C@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731373 394276705 /nfs/dbraw/zinc/27/67/05/394276705.db2.gz GGXTXBYUWRRTDX-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731373 394276710 /nfs/dbraw/zinc/27/67/10/394276710.db2.gz GGXTXBYUWRRTDX-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN CN1CC[C@]2(CC[N@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731373 394276713 /nfs/dbraw/zinc/27/67/13/394276713.db2.gz GGXTXBYUWRRTDX-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN CN1CC[C@]2(CC[N@@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731373 394276717 /nfs/dbraw/zinc/27/67/17/394276717.db2.gz GGXTXBYUWRRTDX-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN CN(C)C1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCC1 ZINC000295895119 394304500 /nfs/dbraw/zinc/30/45/00/394304500.db2.gz IIYSPQTUAROVEH-AWEZNQCLSA-N 0 3 274.408 2.844 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1[O-] ZINC000527804464 394410096 /nfs/dbraw/zinc/41/00/96/394410096.db2.gz PVCCUVZJYUFASZ-OXIQGZBJSA-N 0 3 279.380 2.692 20 10 CFCDHN COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCCOC2)c1[O-] ZINC000527925206 394426823 /nfs/dbraw/zinc/42/68/23/394426823.db2.gz LIYSLGFHBSXQTO-CHWSQXEVSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCOC2(C)C)c1 ZINC000294709400 286338903 /nfs/dbraw/zinc/33/89/03/286338903.db2.gz DQDMVFDIXWRMDF-YGRLFVJLSA-N 0 3 265.353 2.619 20 10 CFCDHN CC(C)N1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000020189091 171054150 /nfs/dbraw/zinc/05/41/50/171054150.db2.gz YTSUDXJWCMKEOW-ZDUSSCGKSA-N 0 3 262.397 2.916 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCOC(C)C)c1[O-] ZINC000020198402 171062685 /nfs/dbraw/zinc/06/26/85/171062685.db2.gz FMRNUJXPRFTMMQ-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CC(C)[C@H](C[NH2+]Cc1ccccc1[O-])N1CCCC1 ZINC000020200664 171064600 /nfs/dbraw/zinc/06/46/00/171064600.db2.gz UTYNFWODUOXTID-HNNXBMFYSA-N 0 3 262.397 2.602 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCn2ccnc2)c([O-])c1 ZINC000020506100 171228460 /nfs/dbraw/zinc/22/84/60/171228460.db2.gz CCVRWVJFWITVSG-ZDUSSCGKSA-N 0 3 259.353 2.638 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCc2ccccn2)c1 ZINC000035628622 260030580 /nfs/dbraw/zinc/03/05/80/260030580.db2.gz WVUCUBIEXBOGIX-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCOCC2(CCC2)C1 ZINC000363915708 262028937 /nfs/dbraw/zinc/02/89/37/262028937.db2.gz AVWDWKPVANKKSC-UHFFFAOYSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCOCC2(CCC2)C1 ZINC000363915708 262028938 /nfs/dbraw/zinc/02/89/38/262028938.db2.gz AVWDWKPVANKKSC-UHFFFAOYSA-N 0 3 265.328 2.534 20 10 CFCDHN COc1cccc(C[NH2+]C2CCC3(CCCO3)CC2)c1[O-] ZINC000367719541 267112641 /nfs/dbraw/zinc/11/26/41/267112641.db2.gz IGTXHWKWTKRGNN-UHFFFAOYSA-N 0 3 291.391 2.982 20 10 CFCDHN CC(C)[C@@]1(CO)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000367958047 267130527 /nfs/dbraw/zinc/13/05/27/267130527.db2.gz DJPNPNGGVKZLFT-KRWDZBQOSA-N 0 3 294.414 2.732 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@](=O)C[C@@H](C)C1 ZINC000368038971 267140103 /nfs/dbraw/zinc/14/01/03/267140103.db2.gz QFIOOAYFRYWXNC-CFZJUORYSA-N 0 3 281.421 2.544 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]2COC[C@H]21 ZINC000368039741 267140229 /nfs/dbraw/zinc/14/02/29/267140229.db2.gz GYJNIPXHBWFBOT-AEGPPILISA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H]2COC[C@H]21 ZINC000368039741 267140231 /nfs/dbraw/zinc/14/02/31/267140231.db2.gz GYJNIPXHBWFBOT-AEGPPILISA-N 0 3 261.365 2.954 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c1 ZINC000370394028 267315959 /nfs/dbraw/zinc/31/59/59/267315959.db2.gz DHJLBBGYTKNAGQ-YPMHNXCESA-N 0 3 271.364 2.632 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1[O-] ZINC000370725682 267341753 /nfs/dbraw/zinc/34/17/53/267341753.db2.gz UZLDZODBJDPYMB-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1[O-] ZINC000370725682 267341755 /nfs/dbraw/zinc/34/17/55/267341755.db2.gz UZLDZODBJDPYMB-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CC[C@H]([NH+]2CCCCC2)C1 ZINC000226564535 275061047 /nfs/dbraw/zinc/06/10/47/275061047.db2.gz MKLMSFSEQIXXES-HNNXBMFYSA-N 0 3 278.371 2.592 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094616753 276174483 /nfs/dbraw/zinc/17/44/83/276174483.db2.gz MKSNWQUOPSUOSJ-WCQYABFASA-N 0 3 266.360 2.666 20 10 CFCDHN C[C@H](C[S@](C)=O)NCc1ccc(N2CCCCC2)cc1 ZINC000168153059 278219425 /nfs/dbraw/zinc/21/94/25/278219425.db2.gz NRPFFYBTUQWBQJ-JLTOFOAXSA-N 0 3 294.464 2.534 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296503874 279161523 /nfs/dbraw/zinc/16/15/23/279161523.db2.gz QFTGIVJSGCSOBF-OCCSQVGLSA-N 0 3 262.397 2.699 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCCCN1C1CC1)CC2 ZINC000296249885 280454528 /nfs/dbraw/zinc/45/45/28/280454528.db2.gz BFKAAKJLKVGQPL-JKSUJKDBSA-N 0 3 286.419 2.986 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000377619037 281025436 /nfs/dbraw/zinc/02/54/36/281025436.db2.gz DFASUKQXYLZQSE-HUUCEWRRSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOC[C@@H]1C1CC1 ZINC000377619037 281025438 /nfs/dbraw/zinc/02/54/38/281025438.db2.gz DFASUKQXYLZQSE-HUUCEWRRSA-N 0 3 261.365 2.954 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c1[O-] ZINC000403520366 327906472 /nfs/dbraw/zinc/90/64/72/327906472.db2.gz KYEFIIBLNAKORQ-MBNYWOFBSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000181965839 329238641 /nfs/dbraw/zinc/23/86/41/329238641.db2.gz KQEFDHLZFSHDOW-IMJJTQAJSA-N 0 3 291.391 2.694 20 10 CFCDHN CC[C@H]([NH2+]CC12CC(C1)CO2)c1ccc(C)cc1[O-] ZINC000527985059 330298609 /nfs/dbraw/zinc/29/86/09/330298609.db2.gz XHZZPVLOEIGAOF-UGWHAMFMSA-N 0 3 261.365 2.920 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)cc1OC ZINC000529637759 333502368 /nfs/dbraw/zinc/50/23/68/333502368.db2.gz DHIPGRWYDXATFJ-FRRDWIJNSA-N 0 3 291.391 2.935 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H]2c3ccccc3C(=O)N2C)c1[O-] ZINC000529669755 333504810 /nfs/dbraw/zinc/50/48/10/333504810.db2.gz PBVFMKQURUJSOQ-MRXNPFEDSA-N 0 3 296.370 2.617 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000290208764 519628630 /nfs/dbraw/zinc/62/86/30/519628630.db2.gz PTIXTDLMPJHAFL-NEPJUHHUSA-N 0 3 268.376 2.911 20 10 CFCDHN CCCC1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000151593725 519893067 /nfs/dbraw/zinc/89/30/67/519893067.db2.gz ASBRCEXJTLXMFX-UHFFFAOYSA-N 0 3 263.337 2.791 20 10 CFCDHN CCC[C@](C)(O)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000266193795 521294832 /nfs/dbraw/zinc/29/48/32/521294832.db2.gz JHLNAIXPSPCJOT-HNNXBMFYSA-N 0 3 251.370 2.650 20 10 CFCDHN CC[N@@H+](Cc1cc(OC)c(OC)cc1[O-])CC(C)C ZINC000159845061 521291512 /nfs/dbraw/zinc/29/15/12/521291512.db2.gz SZFQDHONKSEWNR-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN CC[N@H+](Cc1cc(OC)c(OC)cc1[O-])CC(C)C ZINC000159845061 521291521 /nfs/dbraw/zinc/29/15/21/521291521.db2.gz SZFQDHONKSEWNR-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN CCC(C)(C)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000211423487 521303480 /nfs/dbraw/zinc/30/34/80/521303480.db2.gz FXGAOBCIWVXCQE-UHFFFAOYSA-N 0 3 251.326 2.741 20 10 CFCDHN CCC(C)(C)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000211423487 521303487 /nfs/dbraw/zinc/30/34/87/521303487.db2.gz FXGAOBCIWVXCQE-UHFFFAOYSA-N 0 3 251.326 2.741 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](CO)CC2CCC2)c1[O-] ZINC000279677830 522539764 /nfs/dbraw/zinc/53/97/64/522539764.db2.gz IRNHMZMLIGGZJY-CYBMUJFWSA-N 0 3 299.798 2.695 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000279150031 519717720 /nfs/dbraw/zinc/71/77/20/519717720.db2.gz SQVRAFUSTDSOJV-NSHDSACASA-N 0 3 285.347 2.596 20 10 CFCDHN CC(C)CN1CCC([NH2+]Cc2ccccc2[O-])CC1 ZINC000227436585 519720831 /nfs/dbraw/zinc/72/08/31/519720831.db2.gz AAPFNZWYBJKVKL-UHFFFAOYSA-N 0 3 262.397 2.602 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000289802870 520344833 /nfs/dbraw/zinc/34/48/33/520344833.db2.gz SLENFFGKFPCOCI-HUUCEWRRSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000289802870 520344838 /nfs/dbraw/zinc/34/48/38/520344838.db2.gz SLENFFGKFPCOCI-HUUCEWRRSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)[C@H]2CCOC2)c([O-])c1 ZINC000266139872 520374331 /nfs/dbraw/zinc/37/43/31/520374331.db2.gz GQSXHMDKHSEYDU-OCCSQVGLSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(OC)ccc1[O-] ZINC000278813074 520958007 /nfs/dbraw/zinc/95/80/07/520958007.db2.gz YULKRSXUCIFCRU-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(OC)ccc1[O-] ZINC000278813074 520958017 /nfs/dbraw/zinc/95/80/17/520958017.db2.gz YULKRSXUCIFCRU-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 ZINC000276280985 521043833 /nfs/dbraw/zinc/04/38/33/521043833.db2.gz FGWBGNJYDDTFPG-STQMWFEESA-N 0 3 279.380 2.681 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C2CCC(CO)CC2)c1 ZINC000290335599 521140819 /nfs/dbraw/zinc/14/08/19/521140819.db2.gz FCIRRUKJQLMKLR-UHFFFAOYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C2CCC(CO)CC2)c1 ZINC000290335599 521140823 /nfs/dbraw/zinc/14/08/23/521140823.db2.gz FCIRRUKJQLMKLR-UHFFFAOYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C2(C3CC3)CCOCC2)c1 ZINC000364067062 521147053 /nfs/dbraw/zinc/14/70/53/521147053.db2.gz OFLNNJIUZYUGET-UHFFFAOYSA-N 0 3 291.391 2.840 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@](C)(OC)C2CC2)c1 ZINC000291055324 521151605 /nfs/dbraw/zinc/15/16/05/521151605.db2.gz OECAOMFVUQKSLE-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c1[O-] ZINC000290316355 521334231 /nfs/dbraw/zinc/33/42/31/521334231.db2.gz COGCURFTZMAILJ-DZGCQCFKSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@@H]2C)c1[O-] ZINC000290316355 521334235 /nfs/dbraw/zinc/33/42/35/521334235.db2.gz COGCURFTZMAILJ-DZGCQCFKSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[NH2+]CC(CC)(CC)CO)c1[O-] ZINC000120483964 521362358 /nfs/dbraw/zinc/36/23/58/521362358.db2.gz HJWWJCJQERWOAZ-UHFFFAOYSA-N 0 3 281.396 2.679 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2CC(F)(F)C2)c1[O-] ZINC000291684905 521362638 /nfs/dbraw/zinc/36/26/38/521362638.db2.gz IDLWJEUJMTWCAW-UHFFFAOYSA-N 0 3 271.307 2.926 20 10 CFCDHN CCOC(CC[NH2+]Cc1cc(C)c(C)cc1[O-])OCC ZINC000276075389 521629373 /nfs/dbraw/zinc/62/93/73/521629373.db2.gz FBJMNIUXWQCVMW-UHFFFAOYSA-N 0 3 281.396 2.888 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@@]23CCOC3)c1O ZINC000312644112 522538043 /nfs/dbraw/zinc/53/80/43/522538043.db2.gz DPYNFERODUNENP-HNNXBMFYSA-N 0 3 297.782 2.809 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c1[O-] ZINC000188568471 522540516 /nfs/dbraw/zinc/54/05/16/522540516.db2.gz RVPCKYHLKVRDFC-JHJVBQTASA-N 0 3 297.782 2.711 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCOC[C@H]2C)c1[O-] ZINC000277523736 522541786 /nfs/dbraw/zinc/54/17/86/522541786.db2.gz PJPDGRYOJONONE-BXKDBHETSA-N 0 3 285.771 2.569 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCSC2)c1[O-] ZINC000230935068 522543173 /nfs/dbraw/zinc/54/31/73/522543173.db2.gz ZRKPKHWFRSLTQX-JTQLQIEISA-N 0 3 273.785 2.649 20 10 CFCDHN CC[C@@H](C[NH2+]Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000227711724 522548146 /nfs/dbraw/zinc/54/81/46/522548146.db2.gz UJCZHKCYNJWSGU-ZDUSSCGKSA-N 0 3 294.395 2.785 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@H](C)O)c1ccc(C)cc1[O-] ZINC000280077161 522585813 /nfs/dbraw/zinc/58/58/13/522585813.db2.gz LLSRAAARNYZKHF-JSGCOSHPSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+]CCCO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279981392 522586084 /nfs/dbraw/zinc/58/60/84/522586084.db2.gz DQNYRTXHRHOJOU-ZBFHGGJFSA-N 0 3 293.407 2.937 20 10 CFCDHN COC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCCO1 ZINC000279339365 522749254 /nfs/dbraw/zinc/74/92/54/522749254.db2.gz DXHWQJDSZARCQM-UONOGXRCSA-N 0 3 299.798 2.638 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@H]1CCCO1 ZINC000278952725 522759516 /nfs/dbraw/zinc/75/95/16/522759516.db2.gz ZNLPITDMALDRJC-DUVNUKRYSA-N 0 3 279.380 2.545 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])[C@H]1CCCO1 ZINC000278605870 522764621 /nfs/dbraw/zinc/76/46/21/522764621.db2.gz BHVDPRZDFAOZNG-IVMMDQJWSA-N 0 3 279.380 2.545 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)cc1OC ZINC000160526791 522776390 /nfs/dbraw/zinc/77/63/90/522776390.db2.gz SFFUZNLEKOOGCV-NEPJUHHUSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)cc1OC ZINC000160526791 522776398 /nfs/dbraw/zinc/77/63/98/522776398.db2.gz SFFUZNLEKOOGCV-NEPJUHHUSA-N 0 3 279.380 2.887 20 10 CFCDHN COCC(C)(C)N(C)Cc1ccc(N(C)C)c(F)c1 ZINC000292707181 522812402 /nfs/dbraw/zinc/81/24/02/522812402.db2.gz CWXRQHHTYXVQJK-UHFFFAOYSA-N 0 3 268.376 2.749 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCCCC1)c1ccccc1[O-] ZINC000049574501 522835276 /nfs/dbraw/zinc/83/52/76/522835276.db2.gz VODWXMWLPKAKMA-OAHLLOKOSA-N 0 3 262.397 2.919 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)C(F)(F)F)c1ccc(C)cc1[O-] ZINC000280121777 522850789 /nfs/dbraw/zinc/85/07/89/522850789.db2.gz OHGLBYFQMNRZKK-ZYHUDNBSSA-N 0 3 277.286 2.665 20 10 CFCDHN COCC1(CC[NH2+]Cc2cccc(OC)c2[O-])CCC1 ZINC000292848889 522864055 /nfs/dbraw/zinc/86/40/55/522864055.db2.gz BSJXAQVLLIXVRQ-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(NC(C)=O)nc1)c1ccccc1[O-] ZINC000279196458 522876937 /nfs/dbraw/zinc/87/69/37/522876937.db2.gz WZCBKQMGYCMHDE-OAHLLOKOSA-N 0 3 299.374 2.987 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)CC(C)C)c1ccccc1[O-] ZINC000040774187 522919225 /nfs/dbraw/zinc/91/92/25/522919225.db2.gz SJWADDJDPIMURU-TZMCWYRMSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000365836039 522951685 /nfs/dbraw/zinc/95/16/85/522951685.db2.gz GYPYUMZTQPPFAM-DZGCQCFKSA-N 0 3 271.364 2.987 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H](n2cccn2)C1 ZINC000365836039 522951694 /nfs/dbraw/zinc/95/16/94/522951694.db2.gz GYPYUMZTQPPFAM-DZGCQCFKSA-N 0 3 271.364 2.987 20 10 CFCDHN COCc1ccccc1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000226583762 523103292 /nfs/dbraw/zinc/10/32/92/523103292.db2.gz CVDYGVLZIVRQIO-UHFFFAOYSA-N 0 3 275.323 2.968 20 10 CFCDHN CCn1cc(CNCc2cc(C)c(C)cc2O)cn1 ZINC000266156290 523384781 /nfs/dbraw/zinc/38/47/81/523384781.db2.gz LWYVVLIPUXKXLO-UHFFFAOYSA-N 0 3 259.353 2.515 20 10 CFCDHN CO[C@@H](C)C[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000289580588 523405802 /nfs/dbraw/zinc/40/58/02/523405802.db2.gz JYOGRKVAARORMR-JTQLQIEISA-N 0 3 257.761 2.821 20 10 CFCDHN CO[C@@H](C)C[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000289580588 523405807 /nfs/dbraw/zinc/40/58/07/523405807.db2.gz JYOGRKVAARORMR-JTQLQIEISA-N 0 3 257.761 2.821 20 10 CFCDHN CC[C@]1(CO)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000275123814 523615637 /nfs/dbraw/zinc/61/56/37/523615637.db2.gz IGFICUVGCZJEFK-KRWDZBQOSA-N 0 3 294.414 2.876 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000228183455 523834410 /nfs/dbraw/zinc/83/44/10/523834410.db2.gz CHXVLGSODXCNKG-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3c([O-])cccc3Cl)CC[C@H]21 ZINC000228183455 523834414 /nfs/dbraw/zinc/83/44/14/523834414.db2.gz CHXVLGSODXCNKG-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CCC[C@]2(CC[N@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538747 523860593 /nfs/dbraw/zinc/86/05/93/523860593.db2.gz CPOOZYYGZJVVEF-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN CN1CCC[C@]2(CC[N@@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538747 523860599 /nfs/dbraw/zinc/86/05/99/523860599.db2.gz CPOOZYYGZJVVEF-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@@H+]1CCC[C@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538747 523860602 /nfs/dbraw/zinc/86/06/02/523860602.db2.gz CPOOZYYGZJVVEF-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@H+]1CCC[C@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538747 523860607 /nfs/dbraw/zinc/86/06/07/523860607.db2.gz CPOOZYYGZJVVEF-INIZCTEOSA-N 0 3 294.826 2.963 20 10 CFCDHN CC[C@H](C)C[N@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000160172118 523869051 /nfs/dbraw/zinc/86/90/51/523869051.db2.gz PLBQFNKYYBFLGH-NSHDSACASA-N 0 3 267.369 2.887 20 10 CFCDHN CC[C@H](C)C[N@@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000160172118 523869055 /nfs/dbraw/zinc/86/90/55/523869055.db2.gz PLBQFNKYYBFLGH-NSHDSACASA-N 0 3 267.369 2.887 20 10 CFCDHN C[C@H](CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000265674752 524218606 /nfs/dbraw/zinc/21/86/06/524218606.db2.gz XPLJFUODGUNRAC-CYBMUJFWSA-N 0 3 271.360 2.920 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(O)CCSC2)c([O-])c1 ZINC000294955694 524332859 /nfs/dbraw/zinc/33/28/59/524332859.db2.gz YRSDPABPNZOAHQ-WFASDCNBSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1[O-] ZINC000271809465 524437734 /nfs/dbraw/zinc/43/77/34/524437734.db2.gz KQSQYEPYMSICOH-CQSZACIVSA-N 0 3 261.365 2.892 20 10 CFCDHN C[C@H]1C[N@@H+]2CCC[C@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000245947144 524687687 /nfs/dbraw/zinc/68/76/87/524687687.db2.gz RXXJOAPSHLMGHR-FZMZJTMJSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000245947144 524687699 /nfs/dbraw/zinc/68/76/99/524687699.db2.gz RXXJOAPSHLMGHR-FZMZJTMJSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000156074886 524689486 /nfs/dbraw/zinc/68/94/86/524689486.db2.gz RXXJOAPSHLMGHR-SMDDNHRTSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000156074886 524689491 /nfs/dbraw/zinc/68/94/91/524689491.db2.gz RXXJOAPSHLMGHR-SMDDNHRTSA-N 0 3 280.799 2.714 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C)[C@H](O)c2ccccc2)c1 ZINC000290059447 524755056 /nfs/dbraw/zinc/75/50/56/524755056.db2.gz FDAHPQKNUTXBHD-PXAZEXFGSA-N 0 3 287.359 2.613 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@H]3OCC[C@H]3C2)c1 ZINC000368034198 524760600 /nfs/dbraw/zinc/76/06/00/524760600.db2.gz AEURRZQBKNAAMC-BFQNTYOBSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@H]3OCC[C@H]3C2)c1 ZINC000368034198 524760609 /nfs/dbraw/zinc/76/06/09/524760609.db2.gz AEURRZQBKNAAMC-BFQNTYOBSA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCCCCC2)c1 ZINC000040767256 524762279 /nfs/dbraw/zinc/76/22/79/524762279.db2.gz HUQNYFMKDSVBSA-CQSZACIVSA-N 0 3 292.423 2.927 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(N(C)C)CCC2)c1 ZINC000097927842 524768920 /nfs/dbraw/zinc/76/89/20/524768920.db2.gz OCXHIXFCTLYRFC-LBPRGKRZSA-N 0 3 278.396 2.536 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@@H](C)C2)c1 ZINC000230670314 524773726 /nfs/dbraw/zinc/77/37/26/524773726.db2.gz UTSMTQJMBAHBGR-SRVKXCTJSA-N 0 3 265.353 2.619 20 10 CFCDHN C[C@@H](C[S@@](C)=O)NCc1ccc(N2CCCCC2)cc1 ZINC000168153162 524872628 /nfs/dbraw/zinc/87/26/28/524872628.db2.gz NRPFFYBTUQWBQJ-XOBRGWDASA-N 0 3 294.464 2.534 20 10 CFCDHN C[C@@H](Cc1cccs1)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879907 524933046 /nfs/dbraw/zinc/93/30/46/524933046.db2.gz NGYBDVUMGWLYCI-JTQLQIEISA-N 0 3 291.372 2.903 20 10 CFCDHN COc1ncccc1CC[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000289749120 525044856 /nfs/dbraw/zinc/04/48/56/525044856.db2.gz IBOSUMWEYACPCV-UHFFFAOYSA-N 0 3 286.375 2.745 20 10 CFCDHN COc1ncccc1CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000290214342 525045771 /nfs/dbraw/zinc/04/57/71/525045771.db2.gz QEJOBEVMBSWENE-NSHDSACASA-N 0 3 290.338 2.828 20 10 CFCDHN C[C@]1(CCCO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000290622308 525241106 /nfs/dbraw/zinc/24/11/06/525241106.db2.gz XITMIBDBYBTYFH-OAHLLOKOSA-N 0 3 267.344 2.658 20 10 CFCDHN C[C@]1(CCCO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000290622308 525241112 /nfs/dbraw/zinc/24/11/12/525241112.db2.gz XITMIBDBYBTYFH-OAHLLOKOSA-N 0 3 267.344 2.658 20 10 CFCDHN CSC1(C[NH2+]Cc2cc(C)c(C)cc2[O-])CC1 ZINC000193656609 525334454 /nfs/dbraw/zinc/33/44/54/525334454.db2.gz ZWIPSYXJQYCWMH-UHFFFAOYSA-N 0 3 251.395 2.994 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C2CCC(CO)CC2)c1 ZINC000290411315 525337827 /nfs/dbraw/zinc/33/78/27/525337827.db2.gz KAEYDYFQHDGQBD-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C2CCC(CO)CC2)c1 ZINC000290411315 525337832 /nfs/dbraw/zinc/33/78/32/525337832.db2.gz KAEYDYFQHDGQBD-UHFFFAOYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(O)c(CN2CCN(c3ccccc3O)CC2)c1 ZINC000158551077 525344231 /nfs/dbraw/zinc/34/42/31/525344231.db2.gz VBYVQMKMOJQIAU-UHFFFAOYSA-N 0 3 298.386 2.728 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC[C@@H](O)c2ccccc2)c1 ZINC000289418244 525348837 /nfs/dbraw/zinc/34/88/37/525348837.db2.gz ITCWUAYIQKWLKC-QGZVFWFLSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)CN2CCCCC2)c1 ZINC000071407941 525352996 /nfs/dbraw/zinc/35/29/96/525352996.db2.gz XBPRMAMTWZCMMM-CQSZACIVSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCCc3[nH]c(=O)ccc32)c1 ZINC000264990813 525354825 /nfs/dbraw/zinc/35/48/25/525354825.db2.gz XBJFJOZVBFWJGG-AWEZNQCLSA-N 0 3 284.359 2.968 20 10 CFCDHN C[C@H]([NH2+]CCNc1ccccn1)c1ccccc1[O-] ZINC000272912559 525355862 /nfs/dbraw/zinc/35/58/62/525355862.db2.gz WVKPAFPWLJHEEB-LBPRGKRZSA-N 0 3 257.337 2.550 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185482610 525406949 /nfs/dbraw/zinc/40/69/49/525406949.db2.gz PRMRVHNJUYCVGZ-CMPLNLGQSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@@H]([NH2+]CCNc1ccccn1)c1ccccc1[O-] ZINC000272912554 525451133 /nfs/dbraw/zinc/45/11/33/525451133.db2.gz WVKPAFPWLJHEEB-GFCCVEGCSA-N 0 3 257.337 2.550 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCN2C)c1cccnc1 ZINC000050286103 525531412 /nfs/dbraw/zinc/53/14/12/525531412.db2.gz MHBLLUAURVJXGZ-CYBMUJFWSA-N 0 3 267.376 2.925 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCO[C@@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000230669914 525573589 /nfs/dbraw/zinc/57/35/89/525573589.db2.gz PSDWOQVIJFQCLH-JBCWJZNQSA-N 0 3 265.328 2.749 20 10 CFCDHN C[C@@H](N[C@@H](C)c1cn[nH]c1)c1ccc(N(C)C)cc1 ZINC000222484768 525619778 /nfs/dbraw/zinc/61/97/78/525619778.db2.gz UNFKFOZKKUBGNX-NEPJUHHUSA-N 0 3 258.369 2.888 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000037649051 525731400 /nfs/dbraw/zinc/73/14/00/525731400.db2.gz IAACUQGPBGHZGM-ZIAGYGMSSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@@](CO)([NH2+]Cc1ccccc1[O-])C1CCCCC1 ZINC000265771654 525743523 /nfs/dbraw/zinc/74/35/23/525743523.db2.gz MIWSZCXEUNRXQJ-INIZCTEOSA-N 0 3 263.381 2.813 20 10 CFCDHN Cc1ccncc1CNCc1ccc(N2CCOCC2)cc1 ZINC000279949388 525747731 /nfs/dbraw/zinc/74/77/31/525747731.db2.gz OIJFSUQCXQTVMS-UHFFFAOYSA-N 0 3 297.402 2.516 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC[C@@H]2O)c([O-])c1C ZINC000275123116 525749134 /nfs/dbraw/zinc/74/91/34/525749134.db2.gz LPLTZFXUXDOQPH-SNPRPXQTSA-N 0 3 263.381 2.963 20 10 CFCDHN C[C@@H](O)CC(C)(C)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183612111 525752667 /nfs/dbraw/zinc/75/26/67/525752667.db2.gz SOKHNLPRJHMEIK-VXGBXAGGSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1cccc(CC[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000226585131 525900782 /nfs/dbraw/zinc/90/07/82/525900782.db2.gz NPBAMZUFAIKVOV-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)Cc2ccccc2)c([O-])c1 ZINC000063218408 525942860 /nfs/dbraw/zinc/94/28/60/525942860.db2.gz VUQWOCGAGKVCKK-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN COc1cccc(C[NH2+]C[C@](C)(O)C2CCCCC2)c1[O-] ZINC000191670325 526022051 /nfs/dbraw/zinc/02/20/51/526022051.db2.gz CLDWMQVWQZRXML-KRWDZBQOSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1cccc(CNCc2cccc(OC)c2O)c1 ZINC000037680147 526026894 /nfs/dbraw/zinc/02/68/94/526026894.db2.gz CBHWJYSDFAOYML-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN Cc1cc(Br)cc(C[NH2+][C@H](C)CF)c1[O-] ZINC000290187349 526157972 /nfs/dbraw/zinc/15/79/72/526157972.db2.gz OGPGSVRHANNKOM-MRVPVSSYSA-N 0 3 276.149 2.911 20 10 CFCDHN Cc1cnn([C@H]2CCN(Cc3ccc(N(C)C)cc3)C2)c1 ZINC000290057670 526269235 /nfs/dbraw/zinc/26/92/35/526269235.db2.gz XKPNWORHJUZJBH-KRWDZBQOSA-N 0 3 284.407 2.705 20 10 CFCDHN Cc1nnc(CC[NH2+]Cc2cc(C)c(C)cc2[O-])s1 ZINC000289946136 526328812 /nfs/dbraw/zinc/32/88/12/526328812.db2.gz UPDSLULYUBXWDP-UHFFFAOYSA-N 0 3 277.393 2.501 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@H]1CCC(F)(F)C1)OCO2 ZINC000280882472 526336853 /nfs/dbraw/zinc/33/68/53/526336853.db2.gz FAZOTDHYQBEKGH-VIFPVBQESA-N 0 3 285.290 2.646 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1COc2ccccc21 ZINC000290206158 526348898 /nfs/dbraw/zinc/34/88/98/526348898.db2.gz QAQDTUZHXOGHSS-GFCCVEGCSA-N 0 3 273.307 2.797 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282734141 526374336 /nfs/dbraw/zinc/37/43/36/526374336.db2.gz RCZRLZMOKIAHJV-OAHLLOKOSA-N 0 3 261.365 2.831 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000293019282 527606681 /nfs/dbraw/zinc/60/66/81/527606681.db2.gz OQZWVIIOPURZHQ-HNNXBMFYSA-N 0 3 263.381 2.671 20 10 CFCDHN C[C@H]1CCCC[N@@H+]1CCCCNC(=O)c1cc([O-])cs1 ZINC000731869526 574131268 /nfs/dbraw/zinc/13/12/68/574131268.db2.gz KQRIUMQUZPKPOG-LBPRGKRZSA-N 0 3 296.436 2.838 20 10 CFCDHN C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([O-])cs1 ZINC000731869526 574131270 /nfs/dbraw/zinc/13/12/70/574131270.db2.gz KQRIUMQUZPKPOG-LBPRGKRZSA-N 0 3 296.436 2.838 20 10 CFCDHN COC(=O)c1ccc(CNCc2ccc3c(c2)CCO3)cc1 ZINC000732196846 574147116 /nfs/dbraw/zinc/14/71/16/574147116.db2.gz QTHLBFNNYRVURQ-UHFFFAOYSA-N 0 3 297.354 2.698 20 10 CFCDHN O=C(NCCCCC[NH+]1CCCCC1)c1cc([O-])cs1 ZINC000732301789 574149125 /nfs/dbraw/zinc/14/91/25/574149125.db2.gz JCDHNJGGLOZPAO-UHFFFAOYSA-N 0 3 296.436 2.840 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)CC2CCOCC2)c1 ZINC000747100714 574179987 /nfs/dbraw/zinc/17/99/87/574179987.db2.gz OSPGFYATPLNMMU-ZDUSSCGKSA-N 0 3 263.381 2.995 20 10 CFCDHN COC(=O)CC[N@H+](Cc1cc2c(cc1[O-])CCC2)C(C)C ZINC000733184853 574206756 /nfs/dbraw/zinc/20/67/56/574206756.db2.gz YEMTZIHRTJQQON-UHFFFAOYSA-N 0 3 291.391 2.654 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1cc2c(cc1[O-])CCC2)C(C)C ZINC000733184853 574206759 /nfs/dbraw/zinc/20/67/59/574206759.db2.gz YEMTZIHRTJQQON-UHFFFAOYSA-N 0 3 291.391 2.654 20 10 CFCDHN CCOc1ccc(CNCc2cccc(F)n2)c(O)c1 ZINC000747934448 574220960 /nfs/dbraw/zinc/22/09/60/574220960.db2.gz BINIONCTKGCNTG-UHFFFAOYSA-N 0 3 276.311 2.615 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CCCC2)c([O-])c1C ZINC000756355978 574228866 /nfs/dbraw/zinc/22/88/66/574228866.db2.gz VDSJETCDHJBYLV-AWEZNQCLSA-N 0 3 262.397 2.755 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccco1)c1cc(F)ccc1[O-] ZINC000756382095 574231701 /nfs/dbraw/zinc/23/17/01/574231701.db2.gz QXQJZIWXDMQGSP-NOZJJQNGSA-N 0 3 265.284 2.509 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430443 574236732 /nfs/dbraw/zinc/23/67/32/574236732.db2.gz ICHUINDMLOJWCN-NZVBXONLSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430443 574236735 /nfs/dbraw/zinc/23/67/35/574236735.db2.gz ICHUINDMLOJWCN-NZVBXONLSA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c([O-])c1 ZINC000756434227 574237161 /nfs/dbraw/zinc/23/71/61/574237161.db2.gz VIBNZSKEFWDIMS-DOMZBBRYSA-N 0 3 262.397 2.691 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c([O-])c1 ZINC000756434229 574237255 /nfs/dbraw/zinc/23/72/55/574237255.db2.gz VIBNZSKEFWDIMS-SWLSCSKDSA-N 0 3 262.397 2.691 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756449789 574237948 /nfs/dbraw/zinc/23/79/48/574237948.db2.gz NSZCFAJKZJRUJU-BXKDBHETSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756449792 574238021 /nfs/dbraw/zinc/23/80/21/574238021.db2.gz NSZCFAJKZJRUJU-CABZTGNLSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756449794 574238112 /nfs/dbraw/zinc/23/81/12/574238112.db2.gz NSZCFAJKZJRUJU-JOYOIKCWSA-N 0 3 275.327 2.603 20 10 CFCDHN CCN(CC)C(=O)CN[C@H](C)c1ccc(C)c(C)c1O ZINC000756460157 574238871 /nfs/dbraw/zinc/23/88/71/574238871.db2.gz YSCBVYSWAOOXDZ-CYBMUJFWSA-N 0 3 278.396 2.528 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)COCC(C)C)c([O-])c1C ZINC000756460773 574239025 /nfs/dbraw/zinc/23/90/25/574239025.db2.gz SWBBGUKYDYBCMD-GJZGRUSLSA-N 0 3 295.423 2.693 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2cnccn2)c([O-])c1 ZINC000756497037 574241708 /nfs/dbraw/zinc/24/17/08/574241708.db2.gz ZYGQWVNKUWWHLR-QWHCGFSZSA-N 0 3 271.364 2.772 20 10 CFCDHN CC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000748242783 574242644 /nfs/dbraw/zinc/24/26/44/574242644.db2.gz QLEJSDACYTXDKA-INIZCTEOSA-N 0 3 279.380 2.830 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@](C)(CC)CC(=O)OC)c1[O-] ZINC000748246890 574243095 /nfs/dbraw/zinc/24/30/95/574243095.db2.gz QXMNJINLVIYBSR-INIZCTEOSA-N 0 3 295.379 2.612 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c1 ZINC000756555769 574247032 /nfs/dbraw/zinc/24/70/32/574247032.db2.gz VOHDYEARGDDSGK-ZFWWWQNUSA-N 0 3 274.408 2.836 20 10 CFCDHN CCc1cc(CN[C@H](C)c2cc(OC)ccc2O)n[nH]1 ZINC000756571582 574248797 /nfs/dbraw/zinc/24/87/97/574248797.db2.gz GIZCFJRVJYEFSO-SNVBAGLBSA-N 0 3 275.352 2.537 20 10 CFCDHN CCc1cc(CN[C@H](C)c2cc(OC)ccc2O)[nH]n1 ZINC000756571582 574248798 /nfs/dbraw/zinc/24/87/98/574248798.db2.gz GIZCFJRVJYEFSO-SNVBAGLBSA-N 0 3 275.352 2.537 20 10 CFCDHN CCOC[C@@H](O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733613629 574249436 /nfs/dbraw/zinc/24/94/36/574249436.db2.gz FAAJOXZBUMTCDC-INIZCTEOSA-N 0 3 293.407 2.534 20 10 CFCDHN CCOC[C@@H](O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733613629 574249438 /nfs/dbraw/zinc/24/94/38/574249438.db2.gz FAAJOXZBUMTCDC-INIZCTEOSA-N 0 3 293.407 2.534 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(O)CCCC2)c([O-])c1C ZINC000756577065 574249937 /nfs/dbraw/zinc/24/99/37/574249937.db2.gz XWRRWPOXWTUIGU-CYBMUJFWSA-N 0 3 263.381 2.965 20 10 CFCDHN Cc1cc(CN[C@H](C)c2ccc(C)c(C)c2O)[nH]n1 ZINC000756583783 574250724 /nfs/dbraw/zinc/25/07/24/574250724.db2.gz BRTWQRZHFCIKPG-GFCCVEGCSA-N 0 3 259.353 2.891 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756591244 574251233 /nfs/dbraw/zinc/25/12/33/574251233.db2.gz FUYLCDKIMHZZIB-INTNWOOBSA-N 0 3 299.411 2.782 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@@H]2C)c1 ZINC000756615683 574252374 /nfs/dbraw/zinc/25/23/74/574252374.db2.gz FNTSEXDWDWOXQH-KBPBESRZSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000756628618 574253216 /nfs/dbraw/zinc/25/32/16/574253216.db2.gz WKMPCCWPMSGFNH-YNEHKIRRSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756684508 574257672 /nfs/dbraw/zinc/25/76/72/574257672.db2.gz KJDCBOASZUKWIY-PWSUYJOCSA-N 0 3 275.327 2.566 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C2CCC(C(N)=O)CC2)c([O-])c1C ZINC000756703530 574258053 /nfs/dbraw/zinc/25/80/53/574258053.db2.gz DJBFLFOHQNRSAU-HSBZDZAISA-N 0 3 290.407 2.704 20 10 CFCDHN Cc1ccc([C@@H](C)NCC(=O)NC2CCCC2)c(O)c1C ZINC000756707047 574258317 /nfs/dbraw/zinc/25/83/17/574258317.db2.gz SLEACHSCVYAFBX-CYBMUJFWSA-N 0 3 290.407 2.718 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)C(C)(C)O)c([O-])c1C ZINC000756819125 574264906 /nfs/dbraw/zinc/26/49/06/574264906.db2.gz QLCLAUMTAAWHRP-RYUDHWBXSA-N 0 3 251.370 2.819 20 10 CFCDHN CO[C@H](CN[C@H](C)c1cc(C)ccc1O)C(F)(F)F ZINC000756834597 574265899 /nfs/dbraw/zinc/26/58/99/574265899.db2.gz HNYYMCWAFIADTL-BXKDBHETSA-N 0 3 277.286 2.929 20 10 CFCDHN COCC1([NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)CC1 ZINC000756852140 574268819 /nfs/dbraw/zinc/26/88/19/574268819.db2.gz YMRAHCCZVSLHRL-GXSJLCMTSA-N 0 3 265.328 2.848 20 10 CFCDHN CC(=O)NC1CCC([N@H+](C)Cc2cc(C)ccc2[O-])CC1 ZINC000753592255 574405695 /nfs/dbraw/zinc/40/56/95/574405695.db2.gz UPWNURVEGURNLD-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN CC(=O)NC1CCC([N@@H+](C)Cc2cc(C)ccc2[O-])CC1 ZINC000753592255 574405696 /nfs/dbraw/zinc/40/56/96/574405696.db2.gz UPWNURVEGURNLD-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2c([O-])cccc2Cl)CCN1C ZINC000090721213 618156945 /nfs/dbraw/zinc/15/69/45/618156945.db2.gz WEVUQMUJFZKNMC-QWRGUYRKSA-N 0 3 268.788 2.618 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2c([O-])cccc2Cl)CCN1C ZINC000090721212 618157131 /nfs/dbraw/zinc/15/71/31/618157131.db2.gz WEVUQMUJFZKNMC-MNOVXSKESA-N 0 3 268.788 2.618 20 10 CFCDHN CO[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000278538563 618229827 /nfs/dbraw/zinc/22/98/27/618229827.db2.gz CIBXJSXECDJELU-TZMCWYRMSA-N 0 3 253.317 2.579 20 10 CFCDHN Cc1ccc(O)c(CN2CCc3nc[nH]c3C23CCC3)c1 ZINC000895068396 618254115 /nfs/dbraw/zinc/25/41/15/618254115.db2.gz XOVFEKORXPCUTO-UHFFFAOYSA-N 0 3 283.375 2.861 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CC[C@@H]2C)c1[O-] ZINC000310286531 618276719 /nfs/dbraw/zinc/27/67/19/618276719.db2.gz MKPJLQRBLRQSFW-KWQFWETISA-N 0 3 255.745 2.942 20 10 CFCDHN CCOC(=O)C[C@](C)([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000187705360 618283334 /nfs/dbraw/zinc/28/33/34/618283334.db2.gz BFNRBOBEZDFWGZ-INIZCTEOSA-N 0 3 297.370 2.989 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@](C)(O)C2CC2)c1[O-] ZINC000776173821 618420810 /nfs/dbraw/zinc/42/08/10/618420810.db2.gz AACRSTTZYPOVNH-AWEZNQCLSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)NCc1ccc2c(c1)CCCN2C ZINC000178191666 618634815 /nfs/dbraw/zinc/63/48/15/618634815.db2.gz SLDXAIQOAHFXFC-ZDUSSCGKSA-N 0 3 298.434 2.962 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](CO)C2)c([O-])c1 ZINC000311717313 618720453 /nfs/dbraw/zinc/72/04/53/618720453.db2.gz TYIQQNLIBBLNOP-BFHYXJOUSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC[C@@H](CO)C2)c1 ZINC000311711635 618720591 /nfs/dbraw/zinc/72/05/91/618720591.db2.gz SEDFNXMYQVCZRK-MJBXVCDLSA-N 0 3 263.381 2.902 20 10 CFCDHN CO[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C ZINC000784669063 618789787 /nfs/dbraw/zinc/78/97/87/618789787.db2.gz YEMQUAZXNXIODJ-MLGOLLRUSA-N 0 3 280.387 2.749 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCOCC1CC1)CC2 ZINC000312042190 618864884 /nfs/dbraw/zinc/86/48/84/618864884.db2.gz SBCSRNWHONUMBM-AWEZNQCLSA-N 0 3 261.365 2.786 20 10 CFCDHN c1csc(SCCCN[C@@H]2CCn3ccnc32)n1 ZINC000834593603 625730392 /nfs/dbraw/zinc/73/03/92/625730392.db2.gz KRGODVLNOCRAIO-SNVBAGLBSA-N 0 3 280.422 2.556 20 10 CFCDHN C[C@H](C[N@H+](C)Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000223832758 619133661 /nfs/dbraw/zinc/13/36/61/619133661.db2.gz VTAZLMORMYMPST-GFCCVEGCSA-N 0 3 294.395 2.737 20 10 CFCDHN C[C@H](C[N@@H+](C)Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000223832758 619133664 /nfs/dbraw/zinc/13/36/64/619133664.db2.gz VTAZLMORMYMPST-GFCCVEGCSA-N 0 3 294.395 2.737 20 10 CFCDHN COc1cc(C)cc(CNCc2cccc(O)c2)c1O ZINC000894211620 619264053 /nfs/dbraw/zinc/26/40/53/619264053.db2.gz QXKJTFRWLAITFT-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895657609 619577343 /nfs/dbraw/zinc/57/73/43/619577343.db2.gz AWYARBMKXITFSW-UHFFFAOYSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1cccc(F)c1 ZINC000896563765 619763582 /nfs/dbraw/zinc/76/35/82/619763582.db2.gz MSPOFKFXXJZCBY-MRXNPFEDSA-N 0 3 293.313 2.668 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H](N(C)C)C(F)(F)F ZINC000896879579 619855838 /nfs/dbraw/zinc/85/58/38/619855838.db2.gz WTSJHXNJZDSWIX-CYBMUJFWSA-N 0 3 290.329 2.673 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CC2)[C@@H]2CCCOC2)c([O-])c1 ZINC000897082587 619926433 /nfs/dbraw/zinc/92/64/33/619926433.db2.gz VJEILFZSDZMNNZ-WBVHZDCISA-N 0 3 275.392 2.995 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1cnn(CC2CCC2)c1 ZINC000897432871 620144331 /nfs/dbraw/zinc/14/43/31/620144331.db2.gz QDKPDRBFVVOXNT-UHFFFAOYSA-N 0 3 289.354 2.818 20 10 CFCDHN CN1C[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3[O-])C[C@]2(C)C1 ZINC000897621450 620260481 /nfs/dbraw/zinc/26/04/81/620260481.db2.gz BPAREJICTJCGMD-ABAIWWIYSA-N 0 3 298.789 2.568 20 10 CFCDHN CN1C[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3[O-])C[C@]2(C)C1 ZINC000897621450 620260482 /nfs/dbraw/zinc/26/04/82/620260482.db2.gz BPAREJICTJCGMD-ABAIWWIYSA-N 0 3 298.789 2.568 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3nonc3c2)cc1 ZINC000897994165 620315125 /nfs/dbraw/zinc/31/51/25/620315125.db2.gz NKXMEELXQJOVNI-UHFFFAOYSA-N 0 3 282.347 2.579 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCOC12CCCC2 ZINC000898112857 620335772 /nfs/dbraw/zinc/33/57/72/620335772.db2.gz XBIKUSKRPRFTPT-AWEZNQCLSA-N 0 3 265.328 2.723 20 10 CFCDHN COc1cccc(CN2CC(Cc3ccoc3)C2)c1O ZINC000898160810 620341168 /nfs/dbraw/zinc/34/11/68/620341168.db2.gz VKGLCFCKRLABAY-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@@H]2CNC(=O)C2)c1[O-] ZINC000926980095 620435760 /nfs/dbraw/zinc/43/57/60/620435760.db2.gz OVNXJLFIYLONEP-MNOVXSKESA-N 0 3 296.798 2.531 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000927015571 620439527 /nfs/dbraw/zinc/43/95/27/620439527.db2.gz GCMDMSYHUJPFIS-JSGCOSHPSA-N 0 3 251.370 2.984 20 10 CFCDHN CCOCCOCC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000927086655 620451371 /nfs/dbraw/zinc/45/13/71/620451371.db2.gz HUMRJXZQRIWDDI-YPMHNXCESA-N 0 3 297.370 2.722 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2Cc3ccccc3[C@H]2O)c([O-])c1 ZINC000898392501 620456800 /nfs/dbraw/zinc/45/68/00/620456800.db2.gz IRKXCKOJPMFUQR-SJLPKXTDSA-N 0 3 299.370 2.539 20 10 CFCDHN Fc1cc(CNC/C=C/Cl)ccc1N1CCOCC1 ZINC000898435303 620463912 /nfs/dbraw/zinc/46/39/12/620463912.db2.gz GQLHQJWPMBUZTR-DAFODLJHSA-N 0 3 284.762 2.504 20 10 CFCDHN CC[C@@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902470479 621101187 /nfs/dbraw/zinc/10/11/87/621101187.db2.gz YJDSLANESLAMJD-IGHBBLSQSA-N 0 3 280.799 2.979 20 10 CFCDHN C[C@H]([NH2+]Cc1cnn(CCF)c1)c1cc(F)ccc1[O-] ZINC000903273730 621309504 /nfs/dbraw/zinc/30/95/04/621309504.db2.gz CPSHTWYSFFGIEW-JTQLQIEISA-N 0 3 281.306 2.548 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCN2C)c1[O-] ZINC000903318622 621331818 /nfs/dbraw/zinc/33/18/18/621331818.db2.gz ROIOHKQOOGTAGG-CMPLNLGQSA-N 0 3 268.788 2.709 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC(C)(C)C1)c1ccccc1[O-] ZINC000903344927 621337047 /nfs/dbraw/zinc/33/70/47/621337047.db2.gz RWDIIXPLPRHQKU-CYBMUJFWSA-N 0 3 262.397 2.775 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCCCC1=O)c1ccccc1[O-] ZINC000183381924 625481932 /nfs/dbraw/zinc/48/19/32/625481932.db2.gz XNVBTPKLTURGCL-CQSZACIVSA-N 0 3 290.407 2.836 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000903390500 621360232 /nfs/dbraw/zinc/36/02/32/621360232.db2.gz ARRSWYXKGIGVKN-ATZCPNFKSA-N 0 3 267.344 2.829 20 10 CFCDHN C[NH+](C)[C@H](CNC(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000821948128 623011914 /nfs/dbraw/zinc/01/19/14/623011914.db2.gz KOPXEMLSBVDGOT-CYBMUJFWSA-N 0 3 296.436 2.694 20 10 CFCDHN C[C@@](CO)([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000226608746 623083751 /nfs/dbraw/zinc/08/37/51/623083751.db2.gz DEWNUCHLYRNHDQ-INIZCTEOSA-N 0 3 275.323 2.529 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@@H](C)C2)c([O-])c1 ZINC000226866572 623092388 /nfs/dbraw/zinc/09/23/88/623092388.db2.gz FNYJZEBOAYAFNF-IHRRRGAJSA-N 0 3 262.397 2.834 20 10 CFCDHN CC[C@@H]([NH2+]CCC1(C)OCCO1)c1ccccc1[O-] ZINC000158108475 623093889 /nfs/dbraw/zinc/09/38/89/623093889.db2.gz DYTRPIKJRYFAOQ-CYBMUJFWSA-N 0 3 265.353 2.586 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(CO)cc1)c1cc(F)ccc1[O-] ZINC000227464626 623110666 /nfs/dbraw/zinc/11/06/66/623110666.db2.gz RDUXYRKMLWAPQC-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000228408523 623142494 /nfs/dbraw/zinc/14/24/94/623142494.db2.gz YTXNHHVRVINQSN-AWEZNQCLSA-N 0 3 254.333 2.954 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCC[C@@H](O)C1)c1ccccc1[O-] ZINC000229556885 623211847 /nfs/dbraw/zinc/21/18/47/623211847.db2.gz BEOXBAKEHHIWOL-NFAWXSAZSA-N 0 3 263.381 2.984 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](C)c2cn[nH]c2)c1 ZINC000230669566 623289927 /nfs/dbraw/zinc/28/99/27/623289927.db2.gz OWDYXHLZPYESFQ-ZJUUUORDSA-N 0 3 261.325 2.536 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](OC)[C@@H](C)CC)c([O-])c1 ZINC000824596804 623530091 /nfs/dbraw/zinc/53/00/91/623530091.db2.gz LPNKRDUBJTTWDT-BLLLJJGKSA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637185 623537551 /nfs/dbraw/zinc/53/75/51/623537551.db2.gz WNWBHONHRHDVMG-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Cl)cc(C)c1[O-] ZINC000824637185 623537557 /nfs/dbraw/zinc/53/75/57/623537557.db2.gz WNWBHONHRHDVMG-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN COc1ccc(CNC2(CF)CCOCC2)cc1C ZINC000824691046 623545979 /nfs/dbraw/zinc/54/59/79/623545979.db2.gz SKQPXMHISFJEJD-UHFFFAOYSA-N 0 3 267.344 2.612 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@H](CO)CC(C)(C)C ZINC000825040482 623609611 /nfs/dbraw/zinc/60/96/11/623609611.db2.gz LFLZVCOUQACCAW-ZDUSSCGKSA-N 0 3 269.360 2.760 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@H](CO)CC(C)(C)C ZINC000825040482 623609616 /nfs/dbraw/zinc/60/96/16/623609616.db2.gz LFLZVCOUQACCAW-ZDUSSCGKSA-N 0 3 269.360 2.760 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](CCCO)C2)c1[O-] ZINC000825339069 623677162 /nfs/dbraw/zinc/67/71/62/623677162.db2.gz ZPUNDVFBUIVCQT-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](CCCO)C2)c1[O-] ZINC000825339069 623677166 /nfs/dbraw/zinc/67/71/66/623677166.db2.gz ZPUNDVFBUIVCQT-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CCCO)C2)c1[O-] ZINC000825338826 623677182 /nfs/dbraw/zinc/67/71/82/623677182.db2.gz UYZWSVNEGGZZGQ-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](CCCO)C2)c1[O-] ZINC000825338826 623677185 /nfs/dbraw/zinc/67/71/85/623677185.db2.gz UYZWSVNEGGZZGQ-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN CC[C@@H](COCC1CC1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000826866419 623899072 /nfs/dbraw/zinc/89/90/72/623899072.db2.gz AJZHYGOYBYGMEA-AWEZNQCLSA-N 0 3 267.344 2.826 20 10 CFCDHN COCC1(C2CCC2)C[NH+](Cc2cc(F)ccc2[O-])C1 ZINC000827012236 623924970 /nfs/dbraw/zinc/92/49/70/623924970.db2.gz TXSXKAUWBXKOFY-UHFFFAOYSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000827179302 623960459 /nfs/dbraw/zinc/96/04/59/623960459.db2.gz UMQBZBGXPSGGLL-HOCLYGCPSA-N 0 3 273.307 2.799 20 10 CFCDHN CN(C)c1ccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000834507907 625697477 /nfs/dbraw/zinc/69/74/77/625697477.db2.gz GDHGIYJWQPKCOE-CQSZACIVSA-N 0 3 283.375 2.630 20 10 CFCDHN C[C@H](NC(=O)c1cccc(CN(C)C)c1)c1ccccc1O ZINC000827973415 624144095 /nfs/dbraw/zinc/14/40/95/624144095.db2.gz OWWCCPKOPIOUNE-ZDUSSCGKSA-N 0 3 298.386 2.945 20 10 CFCDHN Cc1cccc(CN2CCOC[C@H]2CC(C)C)c1O ZINC000180202215 625003633 /nfs/dbraw/zinc/00/36/33/625003633.db2.gz IWWSQAVPKUIBEQ-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN C[C@H](C[C@@H](O)c1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180900954 625047564 /nfs/dbraw/zinc/04/75/64/625047564.db2.gz OYXIEXQZABNQMA-QMTHXVAHSA-N 0 3 279.311 2.726 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252673860 625202554 /nfs/dbraw/zinc/20/25/54/625202554.db2.gz NADHYAKTWJCPAC-NEPJUHHUSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1cccc(Cl)c1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252673860 625202556 /nfs/dbraw/zinc/20/25/56/625202556.db2.gz NADHYAKTWJCPAC-NEPJUHHUSA-N 0 3 280.799 2.762 20 10 CFCDHN O=C(CC[NH2+][C@@H]1CCc2cccc([O-])c21)Nc1ccccc1 ZINC000834585943 625727023 /nfs/dbraw/zinc/72/70/23/625727023.db2.gz WDTDWVYZADKVEX-OAHLLOKOSA-N 0 3 296.370 2.998 20 10 CFCDHN CC(C)(C)[S@](=O)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834588673 625727956 /nfs/dbraw/zinc/72/79/56/625727956.db2.gz DUJJXVSFRKIODB-CWTRNNRKSA-N 0 3 281.421 2.516 20 10 CFCDHN CCCCOCCOCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834613084 625736247 /nfs/dbraw/zinc/73/62/47/625736247.db2.gz YSKRQIMZKLVIIF-HNNXBMFYSA-N 0 3 293.407 2.802 20 10 CFCDHN CO[C@@H]1CCC[C@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834702599 625791321 /nfs/dbraw/zinc/79/13/21/625791321.db2.gz SHVJABSJDANKDX-KCQAQPDRSA-N 0 3 261.365 2.784 20 10 CFCDHN CO[C@@H](CC[NH2+][C@@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834779570 625855225 /nfs/dbraw/zinc/85/52/25/625855225.db2.gz NKGDKBOKZKXGFS-PWSUYJOCSA-N 0 3 289.297 2.937 20 10 CFCDHN Oc1cccc2c1[C@@H](NCc1cccnc1F)CC2 ZINC000834790320 625860039 /nfs/dbraw/zinc/86/00/39/625860039.db2.gz NTAQGXKGVYPTIY-LBPRGKRZSA-N 0 3 258.296 2.703 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H](CCO)Cc1ccccc1)CC2 ZINC000834794010 625862324 /nfs/dbraw/zinc/86/23/24/625862324.db2.gz MAOSCUODHXDISA-DLBZAZTESA-N 0 3 297.398 2.963 20 10 CFCDHN CCO[C@@H]1CCC[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834915348 625921238 /nfs/dbraw/zinc/92/12/38/625921238.db2.gz XOUYBOGVQOLRQI-VNHYZAJKSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834914559 625921435 /nfs/dbraw/zinc/92/14/35/625921435.db2.gz OBUFMYOSWUTKKO-HJQYOEGKSA-N 0 3 265.328 2.583 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922677907 626339988 /nfs/dbraw/zinc/33/99/88/626339988.db2.gz IEBBTPKFROOMDV-AAEUAGOBSA-N 0 3 289.297 2.982 20 10 CFCDHN CCC[C@H](O)CCNCc1cc(F)c(N(C)C)cc1F ZINC000922819501 626373586 /nfs/dbraw/zinc/37/35/86/626373586.db2.gz XOADWWQJVKZLHK-LBPRGKRZSA-N 0 3 286.366 2.672 20 10 CFCDHN CCc1onc(C)c1CNCc1ccc(OC)cc1O ZINC000922988052 626439672 /nfs/dbraw/zinc/43/96/72/626439672.db2.gz JJVCJZQCPVQEBJ-UHFFFAOYSA-N 0 3 276.336 2.549 20 10 CFCDHN C[C@H](O)CCC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000788605312 626483529 /nfs/dbraw/zinc/48/35/29/626483529.db2.gz OWGCVMJLOYIVEK-SCVCMEIPSA-N 0 3 267.344 2.830 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000839147815 626526198 /nfs/dbraw/zinc/52/61/98/626526198.db2.gz RSICXVGNHZHNIW-TXEJJXNPSA-N 0 3 285.771 2.711 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCSCC2)c([O-])c1 ZINC000757876392 626566161 /nfs/dbraw/zinc/56/61/61/626566161.db2.gz RRUKLAUKARRBJI-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCSCC2)c([O-])c1 ZINC000757876392 626566164 /nfs/dbraw/zinc/56/61/64/626566164.db2.gz RRUKLAUKARRBJI-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN CC[NH+](CC)[C@H](CNC(=O)c1cc([O-])cs1)CC(C)C ZINC000759274523 626641512 /nfs/dbraw/zinc/64/15/12/626641512.db2.gz TWKFAGCONORFGL-LBPRGKRZSA-N 0 3 298.452 2.940 20 10 CFCDHN CC[NH+](CC)CCN(CC(C)C)C(=O)c1cc([O-])cs1 ZINC000760172110 626717573 /nfs/dbraw/zinc/71/75/73/626717573.db2.gz JBIOYAOZDVWSLA-UHFFFAOYSA-N 0 3 298.452 2.894 20 10 CFCDHN CCN(CC)CCN(CC(C)C)C(=O)C1=CC(=O)CS1 ZINC000760172110 626717574 /nfs/dbraw/zinc/71/75/74/626717574.db2.gz JBIOYAOZDVWSLA-UHFFFAOYSA-N 0 3 298.452 2.894 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@H]2OC)c1[O-] ZINC000761216586 626816634 /nfs/dbraw/zinc/81/66/34/626816634.db2.gz SWRWIQSGAIVMMD-ZWNOBZJWSA-N 0 3 299.798 2.959 20 10 CFCDHN CCO[C@H]1COCC[C@@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000761223931 626817638 /nfs/dbraw/zinc/81/76/38/626817638.db2.gz VIZJQSBIXPXROI-KBPBESRZSA-N 0 3 299.798 2.638 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000762785676 626937189 /nfs/dbraw/zinc/93/71/89/626937189.db2.gz GDTKEMCCGZJZKT-ZWNOBZJWSA-N 0 3 289.354 2.645 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)C[C@H](O)c1ccco1 ZINC000763524828 626994850 /nfs/dbraw/zinc/99/48/50/626994850.db2.gz MRAGLDBZIPHMMB-FZMZJTMJSA-N 0 3 291.347 2.596 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CC2(CC2)C(=O)O1 ZINC000763697619 627006215 /nfs/dbraw/zinc/00/62/15/627006215.db2.gz NZDNNAOAAZYOHN-CQSZACIVSA-N 0 3 289.375 2.700 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CC2(CC2)C(=O)O1 ZINC000763697619 627006218 /nfs/dbraw/zinc/00/62/18/627006218.db2.gz NZDNNAOAAZYOHN-CQSZACIVSA-N 0 3 289.375 2.700 20 10 CFCDHN CC[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768448437 627343818 /nfs/dbraw/zinc/34/38/18/627343818.db2.gz UXABBWNJKVYARL-WBMJQRKESA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768448437 627343822 /nfs/dbraw/zinc/34/38/22/627343822.db2.gz UXABBWNJKVYARL-WBMJQRKESA-N 0 3 291.391 2.830 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000770739822 627545458 /nfs/dbraw/zinc/54/54/58/627545458.db2.gz SKCJUIGGUWUSTD-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](OCC)C2)c([O-])c1 ZINC000771941131 627652060 /nfs/dbraw/zinc/65/20/60/627652060.db2.gz YEIFIYSONQHKLG-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](OCC)C2)c([O-])c1 ZINC000771941131 627652064 /nfs/dbraw/zinc/65/20/64/627652064.db2.gz YEIFIYSONQHKLG-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@H]1CCCO1)c1ccccc1[O-] ZINC000775414672 628023082 /nfs/dbraw/zinc/02/30/82/628023082.db2.gz KDTAOUWPTORYHU-UKRRQHHQSA-N 0 3 279.380 2.629 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@@H]1CCCO1)c1ccccc1[O-] ZINC000775414673 628023388 /nfs/dbraw/zinc/02/33/88/628023388.db2.gz KDTAOUWPTORYHU-ZFWWWQNUSA-N 0 3 279.380 2.629 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCC(C)(C)O)c2c1c(F)ccc2[O-] ZINC000775585536 628043301 /nfs/dbraw/zinc/04/33/01/628043301.db2.gz GVIXTHXXKOWNFP-GXSJLCMTSA-N 0 3 267.344 2.830 20 10 CFCDHN CCC[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000776173899 628111088 /nfs/dbraw/zinc/11/10/88/628111088.db2.gz CVRZHJCFKGXOBR-AWEZNQCLSA-N 0 3 271.788 2.995 20 10 CFCDHN COC(=O)CC[N@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000778995524 628344302 /nfs/dbraw/zinc/34/43/02/628344302.db2.gz BEQMEKXPDDKJQP-UHFFFAOYSA-N 0 3 299.370 2.958 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000778995524 628344306 /nfs/dbraw/zinc/34/43/06/628344306.db2.gz BEQMEKXPDDKJQP-UHFFFAOYSA-N 0 3 299.370 2.958 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2CCO)c1[O-] ZINC000779201172 628360215 /nfs/dbraw/zinc/36/02/15/628360215.db2.gz AZZIBFKTTBTLHS-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2CCO)c1[O-] ZINC000779201172 628360217 /nfs/dbraw/zinc/36/02/17/628360217.db2.gz AZZIBFKTTBTLHS-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN COC(C[N@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000781886753 628589381 /nfs/dbraw/zinc/58/93/81/628589381.db2.gz RBCGIHXDOVXWCA-UHFFFAOYSA-N 0 3 279.380 2.756 20 10 CFCDHN COC(C[N@@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000781886753 628589382 /nfs/dbraw/zinc/58/93/82/628589382.db2.gz RBCGIHXDOVXWCA-UHFFFAOYSA-N 0 3 279.380 2.756 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000783504578 628714052 /nfs/dbraw/zinc/71/40/52/628714052.db2.gz PCGYGNJSDJVXDM-GOEBONIOSA-N 0 3 285.387 2.894 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783510494 628714402 /nfs/dbraw/zinc/71/44/02/628714402.db2.gz PFKXPCACSZSPJU-HUBLWGQQSA-N 0 3 251.370 2.840 20 10 CFCDHN CO[C@@H](C[NH2+][C@H](C)c1ccccc1[O-])C(F)(F)F ZINC000783523327 628716429 /nfs/dbraw/zinc/71/64/29/628716429.db2.gz IEEUQVQLFNXQFQ-KCJUWKMLSA-N 0 3 263.259 2.620 20 10 CFCDHN CCOc1ccc(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000784686720 628837196 /nfs/dbraw/zinc/83/71/96/628837196.db2.gz NNSAYDKXBKXZIO-DLBZAZTESA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000785989175 628928442 /nfs/dbraw/zinc/92/84/42/628928442.db2.gz TWOPEZIBYVXJHK-UHIISALHSA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000785989175 628928445 /nfs/dbraw/zinc/92/84/45/628928445.db2.gz TWOPEZIBYVXJHK-UHIISALHSA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000785989172 628928477 /nfs/dbraw/zinc/92/84/77/628928477.db2.gz TWOPEZIBYVXJHK-GYSYKLTISA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000785989172 628928480 /nfs/dbraw/zinc/92/84/80/628928480.db2.gz TWOPEZIBYVXJHK-GYSYKLTISA-N 0 3 267.344 2.513 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2cncn2C)c2c1c(F)ccc2[O-] ZINC000788258135 629053671 /nfs/dbraw/zinc/05/36/71/629053671.db2.gz UIABQRXKAXRGRS-MFKMUULPSA-N 0 3 289.354 2.645 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc(-c3cc[nH]n3)o2)c1 ZINC000788519984 629078257 /nfs/dbraw/zinc/07/82/57/629078257.db2.gz SEFVFGHSXWTUBW-UHFFFAOYSA-N 0 3 299.330 2.674 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2(CO)CCC2)c([O-])c1 ZINC000788741042 629096223 /nfs/dbraw/zinc/09/62/23/629096223.db2.gz SLTFJRLPVSMQLP-ZDUSSCGKSA-N 0 3 263.381 2.822 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000788984787 629113974 /nfs/dbraw/zinc/11/39/74/629113974.db2.gz TWUMUSQUPWHFMY-JFGNBEQYSA-N 0 3 294.370 2.536 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000788984790 629114128 /nfs/dbraw/zinc/11/41/28/629114128.db2.gz TWUMUSQUPWHFMY-SCVCMEIPSA-N 0 3 294.370 2.536 20 10 CFCDHN C[C@@H](O)CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000789347509 629149280 /nfs/dbraw/zinc/14/92/80/629149280.db2.gz GHYVRTGFIYDWLO-ZBFHGGJFSA-N 0 3 293.407 2.534 20 10 CFCDHN C[C@@H](O)CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000789347509 629149283 /nfs/dbraw/zinc/14/92/83/629149283.db2.gz GHYVRTGFIYDWLO-ZBFHGGJFSA-N 0 3 293.407 2.534 20 10 CFCDHN CN1CCCC(C)(C)[C@H]1C[NH2+]Cc1ccccc1[O-] ZINC000790485845 629242389 /nfs/dbraw/zinc/24/23/89/629242389.db2.gz OXWQUBKCKDRZMU-OAHLLOKOSA-N 0 3 262.397 2.602 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1N(C)CCCC1(C)C ZINC000790484557 629242416 /nfs/dbraw/zinc/24/24/16/629242416.db2.gz FNVIZWQAMWZOQS-INIZCTEOSA-N 0 3 292.423 2.611 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000790617701 629253189 /nfs/dbraw/zinc/25/31/89/629253189.db2.gz BUSMGQPYUIHJPQ-UHFFFAOYSA-N 0 3 267.332 2.601 20 10 CFCDHN CC(C)c1nc(CNCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835054311 629355552 /nfs/dbraw/zinc/35/55/52/629355552.db2.gz JLPUTBQKVWRZHL-AATRIKPKSA-N 0 3 299.422 2.797 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)CC2CCC2)c1[O-] ZINC000793321822 629526857 /nfs/dbraw/zinc/52/68/57/629526857.db2.gz KKRSJYNMKUZYDQ-AWEZNQCLSA-N 0 3 283.799 2.995 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000793567598 629572750 /nfs/dbraw/zinc/57/27/50/629572750.db2.gz ZMEYXQFUSPKYFT-CMPLNLGQSA-N 0 3 279.355 2.974 20 10 CFCDHN C[C@H](CCNC(=O)OC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000793602614 629577423 /nfs/dbraw/zinc/57/74/23/629577423.db2.gz ZHPYAZAGOKFVOV-GFCCVEGCSA-N 0 3 294.395 2.785 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000793624023 629580769 /nfs/dbraw/zinc/58/07/69/629580769.db2.gz KDHGENVRPQEJMF-UHFFFAOYSA-N 0 3 298.264 2.818 20 10 CFCDHN CC[C@@H]([NH2+]CC(=O)N(CC)CC)c1ccc(C)cc1[O-] ZINC000794805913 629687854 /nfs/dbraw/zinc/68/78/54/629687854.db2.gz ZDOLBWHZDJFRAI-CQSZACIVSA-N 0 3 278.396 2.610 20 10 CFCDHN CC[C@H]([NH2+]CCNc1cnccn1)c1ccc(C)cc1[O-] ZINC000794810916 629688722 /nfs/dbraw/zinc/68/87/22/629688722.db2.gz NWFCSHFLUKCOAL-AWEZNQCLSA-N 0 3 286.379 2.643 20 10 CFCDHN CC[C@H]([NH2+]CC1(CCO)CC1)c1ccc(C)cc1[O-] ZINC000794811893 629689730 /nfs/dbraw/zinc/68/97/30/629689730.db2.gz ABTWWDYRIJGWCM-AWEZNQCLSA-N 0 3 263.381 2.904 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)CC(F)F)c1ccc(C)cc1[O-] ZINC000794817697 629690209 /nfs/dbraw/zinc/69/02/09/629690209.db2.gz UUJCCNXQDNCQDS-PWSUYJOCSA-N 0 3 273.323 2.757 20 10 CFCDHN CC[S@@](=O)CC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808696178 630400435 /nfs/dbraw/zinc/40/04/35/630400435.db2.gz STZLPRAXTIYMSU-MLCYQJTMSA-N 0 3 289.828 2.773 20 10 CFCDHN CCCCNC(=O)CN(CCCC)Cc1ccccc1O ZINC000801597220 630461315 /nfs/dbraw/zinc/46/13/15/630461315.db2.gz DQZWNXNPLVGPAY-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN COc1cc(C)cc(CN2CC[C@H](OC(F)F)C2)c1O ZINC000802748055 630542684 /nfs/dbraw/zinc/54/26/84/630542684.db2.gz YRXLREDZUOIWHO-NSHDSACASA-N 0 3 287.306 2.523 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)c2cccnc2)c([O-])c1 ZINC000806178909 630780364 /nfs/dbraw/zinc/78/03/64/630780364.db2.gz LGOHWWAOTBARKU-ZFWWWQNUSA-N 0 3 286.375 2.522 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccnn2C)c1[O-] ZINC000808675889 631026803 /nfs/dbraw/zinc/02/68/03/631026803.db2.gz WVKNBTYYCFRQCV-JTQLQIEISA-N 0 3 279.771 2.938 20 10 CFCDHN CCNC(=O)[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672696 631026941 /nfs/dbraw/zinc/02/69/41/631026941.db2.gz RJRPWTBUCFWICQ-VHSXEESVSA-N 0 3 284.787 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H](C)O)c1[O-] ZINC000808694546 631030178 /nfs/dbraw/zinc/03/01/78/631030178.db2.gz AEVCIQLBJKRMJX-ZJUUUORDSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCC(=O)N(C)C2)c1[O-] ZINC000808697283 631031176 /nfs/dbraw/zinc/03/11/76/631031176.db2.gz BGADVGVXHDRZSH-PWSUYJOCSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCOC2)c1[O-] ZINC000808708854 631032228 /nfs/dbraw/zinc/03/22/28/631032228.db2.gz RAQOYVDUGLWKQL-MWLCHTKSSA-N 0 3 255.745 2.794 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCCn2ccnn2)c1[O-] ZINC000808712149 631033390 /nfs/dbraw/zinc/03/33/90/631033390.db2.gz CDIOUDAYXBLZMY-NSHDSACASA-N 0 3 294.786 2.686 20 10 CFCDHN CO[C@]1(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000808712673 631033744 /nfs/dbraw/zinc/03/37/44/631033744.db2.gz AMGHSHOIFPOSLX-ABAIWWIYSA-N 0 3 299.798 2.810 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1cc(F)ccc1[O-] ZINC000840886670 631251767 /nfs/dbraw/zinc/25/17/67/631251767.db2.gz LNVJORJPKBUZBH-DYLAAIIWSA-N 0 3 289.297 2.731 20 10 CFCDHN CN(C)CCC[N@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC000809729232 631272381 /nfs/dbraw/zinc/27/23/81/631272381.db2.gz BQKXOPYCJQXIRZ-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CN(C)CCC[N@@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC000809729232 631272387 /nfs/dbraw/zinc/27/23/87/631272387.db2.gz BQKXOPYCJQXIRZ-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CN(CCC[NH+](C)C)Cc1cc(Cl)cc(F)c1[O-] ZINC000809729232 631272389 /nfs/dbraw/zinc/27/23/89/631272389.db2.gz BQKXOPYCJQXIRZ-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@H](O)C2CC2)c1[O-] ZINC000809752315 631280740 /nfs/dbraw/zinc/28/07/40/631280740.db2.gz QKLHOTYGMYCHNM-ZDUSSCGKSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@H](O)C2CC2)c1[O-] ZINC000809752315 631280743 /nfs/dbraw/zinc/28/07/43/631280743.db2.gz QKLHOTYGMYCHNM-ZDUSSCGKSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@H](C3CCC3)C2)c1 ZINC000840954965 631282459 /nfs/dbraw/zinc/28/24/59/631282459.db2.gz OCJFSFCPPVXMOW-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1c(F)cccc1CN1CC[NH2+]Cc2ccccc21 ZINC000841034960 631315241 /nfs/dbraw/zinc/31/52/41/631315241.db2.gz FGLKGPJQDNSAJH-UHFFFAOYSA-N 0 3 272.323 2.641 20 10 CFCDHN C[C@@H](NCc1cc(Cl)cc(Cl)c1[O-])[C@H](C)[NH3+] ZINC000841081534 631333449 /nfs/dbraw/zinc/33/34/49/631333449.db2.gz SNINWCPHIWLBHC-NKWVEPMBSA-N 0 3 263.168 2.524 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)CN(C)C(C)C)c([O-])c1 ZINC000810173065 631339442 /nfs/dbraw/zinc/33/94/42/631339442.db2.gz WBQWUULWXAOWPJ-CYBMUJFWSA-N 0 3 280.412 2.609 20 10 CFCDHN C[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1C[NH3+] ZINC000841099363 631339986 /nfs/dbraw/zinc/33/99/86/631339986.db2.gz IVFRGUSYLBFPLD-VHSXEESVSA-N 0 3 286.778 2.601 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2cn[nH]c2)c2c1c(F)ccc2[O-] ZINC000810248502 631349298 /nfs/dbraw/zinc/34/92/98/631349298.db2.gz WVKBSTWRZBLLMX-SKDRFNHKSA-N 0 3 275.327 2.635 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCOC)COC)c1ccc(C)cc1[O-] ZINC000810256484 631350962 /nfs/dbraw/zinc/35/09/62/631350962.db2.gz AORSVBLMRCDGGL-HIFRSBDPSA-N 0 3 281.396 2.793 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(CC(F)F)C2)c([O-])c1 ZINC000841764160 631468903 /nfs/dbraw/zinc/46/89/03/631468903.db2.gz DHNQIAUMKPXZIH-NWDGAFQWSA-N 0 3 284.350 2.691 20 10 CFCDHN CN(C)C(=O)c1ccccc1CN(C)Cc1ccccc1O ZINC000841834295 631477905 /nfs/dbraw/zinc/47/79/05/631477905.db2.gz LWEUQYWJDAWFRA-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN CN(C)C(=O)c1ccccc1C[N@H+](C)Cc1ccccc1[O-] ZINC000841834295 631477908 /nfs/dbraw/zinc/47/79/08/631477908.db2.gz LWEUQYWJDAWFRA-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN CN(C)C(=O)c1ccccc1C[N@@H+](C)Cc1ccccc1[O-] ZINC000841834295 631477910 /nfs/dbraw/zinc/47/79/10/631477910.db2.gz LWEUQYWJDAWFRA-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](CC(C)C)OC)c([O-])c1 ZINC000841888828 631488422 /nfs/dbraw/zinc/48/84/22/631488422.db2.gz SGZWDRPOZYIJQV-OAHLLOKOSA-N 0 3 281.396 2.942 20 10 CFCDHN COc1cccc(O)c1CN1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000811510652 631574963 /nfs/dbraw/zinc/57/49/63/631574963.db2.gz MIUYIJKXSUVWSW-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000811510652 631574967 /nfs/dbraw/zinc/57/49/67/631574967.db2.gz MIUYIJKXSUVWSW-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000811510652 631574969 /nfs/dbraw/zinc/57/49/69/631574969.db2.gz MIUYIJKXSUVWSW-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc(O)c(CNCc2ccnn2CC(C)C)c1 ZINC000842680055 631705310 /nfs/dbraw/zinc/70/53/10/631705310.db2.gz AXJWEIBRVFXIBU-UHFFFAOYSA-N 0 3 289.379 2.543 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CO)C[C@H](C)CC)c([O-])c1 ZINC000842753145 631728544 /nfs/dbraw/zinc/72/85/44/631728544.db2.gz CFBYUSLKARBPQA-TZMCWYRMSA-N 0 3 281.396 2.678 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCOC1 ZINC000812780588 631770291 /nfs/dbraw/zinc/77/02/91/631770291.db2.gz JTLJDIUFFQCFTP-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCOC1 ZINC000812780588 631770304 /nfs/dbraw/zinc/77/03/04/631770304.db2.gz JTLJDIUFFQCFTP-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000812772042 631770510 /nfs/dbraw/zinc/77/05/10/631770510.db2.gz PGJXYLZMVJZDFB-UHFFFAOYSA-N 0 3 297.358 2.577 20 10 CFCDHN COCC1(CC[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000842891191 631774170 /nfs/dbraw/zinc/77/41/70/631774170.db2.gz PKWQLVYJRKYHRQ-ZDUSSCGKSA-N 0 3 261.365 2.786 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000842913365 631780477 /nfs/dbraw/zinc/78/04/77/631780477.db2.gz BHABRULHMLBQHS-GMXVVIOVSA-N 0 3 269.360 2.979 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@@H]1SC ZINC000842925553 631782853 /nfs/dbraw/zinc/78/28/53/631782853.db2.gz YHMIDDJEMIHARF-BTQDYEIMSA-N 0 3 281.421 2.952 20 10 CFCDHN [NH3+][C@@H]1CCC[C@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@@H]21 ZINC000843059412 631822256 /nfs/dbraw/zinc/82/22/56/631822256.db2.gz LIYUYUOQJDUTRH-DUFXMDAXSA-N 0 3 298.789 2.744 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843415177 631947232 /nfs/dbraw/zinc/94/72/32/631947232.db2.gz BBKGDBNUKZILTB-DOMZBBRYSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843415177 631947235 /nfs/dbraw/zinc/94/72/35/631947235.db2.gz BBKGDBNUKZILTB-DOMZBBRYSA-N 0 3 279.355 2.922 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000843431617 631957417 /nfs/dbraw/zinc/95/74/17/631957417.db2.gz IYMYVXNLTLCCSM-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000843431617 631957419 /nfs/dbraw/zinc/95/74/19/631957419.db2.gz IYMYVXNLTLCCSM-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@@H]1CC2(C[N@@H+]1Cc1ccccc1[O-])CCOCC2 ZINC000843432170 631957567 /nfs/dbraw/zinc/95/75/67/631957567.db2.gz RTENLPQNVPVUEG-CYBMUJFWSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H]1CC2(C[N@H+]1Cc1ccccc1[O-])CCOCC2 ZINC000843432170 631957568 /nfs/dbraw/zinc/95/75/68/631957568.db2.gz RTENLPQNVPVUEG-CYBMUJFWSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1cccc(CN2C[C@@H](C)OC3(CCCC3)C2)c1O ZINC000843435462 631959823 /nfs/dbraw/zinc/95/98/23/631959823.db2.gz UNZJTAGGVSDGER-CYBMUJFWSA-N 0 3 291.391 2.934 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1c([O-])cccc1OC)OC ZINC000813793146 631960025 /nfs/dbraw/zinc/96/00/25/631960025.db2.gz KAHPGLYHZLLMKG-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1[O-])CN(C)C ZINC000813877316 631971585 /nfs/dbraw/zinc/97/15/85/631971585.db2.gz RPVITWCJTXQAFZ-MNOVXSKESA-N 0 3 270.804 2.894 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC2(OC)CCC2)c([O-])c1 ZINC000815148258 632217701 /nfs/dbraw/zinc/21/77/01/632217701.db2.gz PYQAWBSRDOEMJL-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CC(=O)N1CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])CC1 ZINC000815554741 632289006 /nfs/dbraw/zinc/28/90/06/632289006.db2.gz HPSWYPKMGZXRLI-ZDUSSCGKSA-N 0 3 290.407 2.671 20 10 CFCDHN CCN1CC[NH+](Cc2ccc3ccccc3c2[O-])CC1 ZINC000816480147 632467473 /nfs/dbraw/zinc/46/74/73/632467473.db2.gz DVBYAILCVUVORD-UHFFFAOYSA-N 0 3 270.376 2.683 20 10 CFCDHN CN1CCC([NH2+]Cc2ccc3ccccc3c2[O-])CC1 ZINC000816530336 632479026 /nfs/dbraw/zinc/47/90/26/632479026.db2.gz DVVPSNASSQXWHG-UHFFFAOYSA-N 0 3 270.376 2.729 20 10 CFCDHN CN(C)[C@H]1CC[N@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC000816610439 632493775 /nfs/dbraw/zinc/49/37/75/632493775.db2.gz KJLCPAAPEJMINH-HNNXBMFYSA-N 0 3 270.376 2.681 20 10 CFCDHN CN(C)[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC000816610439 632493776 /nfs/dbraw/zinc/49/37/76/632493776.db2.gz KJLCPAAPEJMINH-HNNXBMFYSA-N 0 3 270.376 2.681 20 10 CFCDHN COC[C@H](CC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000845928695 632598931 /nfs/dbraw/zinc/59/89/31/632598931.db2.gz FMMZHVNHXKUKCZ-ZDUSSCGKSA-N 0 3 251.370 2.933 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cnc(C3CC3)nc2)c1 ZINC000845973031 632607322 /nfs/dbraw/zinc/60/73/22/632607322.db2.gz WBQKMXZGTACDKX-LLVKDONJSA-N 0 3 299.374 2.919 20 10 CFCDHN CO[C@@H]1[C@@H](C)[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000817407980 632622025 /nfs/dbraw/zinc/62/20/25/632622025.db2.gz BQZZUAWVYHRCER-CUOATXAZSA-N 0 3 267.344 2.680 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](CO)C[C@H](C)C2)c1[O-] ZINC000817412510 632624106 /nfs/dbraw/zinc/62/41/06/632624106.db2.gz MBRUNHOJWHOWJW-WDEREUQCSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c1[O-] ZINC000817412510 632624109 /nfs/dbraw/zinc/62/41/09/632624109.db2.gz MBRUNHOJWHOWJW-WDEREUQCSA-N 0 3 299.798 2.505 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCO[C@H](CC)C2)c([O-])c1 ZINC000817415702 632626649 /nfs/dbraw/zinc/62/66/49/632626649.db2.gz WYKZYSZLUPFWHH-ZIAGYGMSSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc([C@H](C)NCc2ccc(F)cn2)c1O ZINC000846149549 632648226 /nfs/dbraw/zinc/64/82/26/632648226.db2.gz IUVUGFHNVPSWMM-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](CO)CCF)c1[O-] ZINC000846209377 632660406 /nfs/dbraw/zinc/66/04/06/632660406.db2.gz QQPZEWZZGHISEY-MWLCHTKSSA-N 0 3 275.751 2.725 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@]1(O)CCCOC1)c1ccc(C)cc1[O-] ZINC000846215201 632662950 /nfs/dbraw/zinc/66/29/50/632662950.db2.gz ZCXIPSYZUFCLOH-WBVHZDCISA-N 0 3 293.407 2.673 20 10 CFCDHN CC[C@@H]1C[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)CCO1 ZINC000817587483 632672535 /nfs/dbraw/zinc/67/25/35/632672535.db2.gz YGYIVXGSHYIAOW-MCIONIFRSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@@H](NC[C@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1[O-] ZINC000817953009 632752815 /nfs/dbraw/zinc/75/28/15/632752815.db2.gz KFYAJJHRULYJFM-NXEZZACHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@H](CN)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817966844 632766317 /nfs/dbraw/zinc/76/63/17/632766317.db2.gz WXVLXGRDFFXDLO-RQJHMYQMSA-N 0 3 263.168 2.697 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1cc(Cl)ccc1[O-] ZINC000817977223 632774882 /nfs/dbraw/zinc/77/48/82/632774882.db2.gz FBZHHQNFLNPZEQ-LNLATYFQSA-N 0 3 256.777 2.822 20 10 CFCDHN CCOc1ccc(O)c(CN[C@H]2c3ccccc3C[C@@H]2O)c1 ZINC000848567359 633291539 /nfs/dbraw/zinc/29/15/39/633291539.db2.gz GGQMIJYFEMYCSC-ROUUACIJSA-N 0 3 299.370 2.539 20 10 CFCDHN CCc1cccc(C[NH2+][C@H]2CCC[C@H]2CCO)c1[O-] ZINC000848904097 633391248 /nfs/dbraw/zinc/39/12/48/633391248.db2.gz KKZZLWUKSPRVCR-ZFWWWQNUSA-N 0 3 263.381 2.595 20 10 CFCDHN CCc1cccc(CN2C[C@H](C)O[C@@H](C)[C@H]2C)c1O ZINC000848905380 633392069 /nfs/dbraw/zinc/39/20/69/633392069.db2.gz JVAHEYUKMHTBQN-XQQFMLRXSA-N 0 3 263.381 2.952 20 10 CFCDHN CCc1cccc(CN2C[C@@H](C3CC3)O[C@@H](C)C2)c1O ZINC000848907693 633394304 /nfs/dbraw/zinc/39/43/04/633394304.db2.gz HDMNDDFZBZIXRG-LRDDRELGSA-N 0 3 275.392 2.954 20 10 CFCDHN CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000848925841 633408478 /nfs/dbraw/zinc/40/84/78/633408478.db2.gz FQILNDRBKZHBJB-JOCQHMNTSA-N 0 3 267.344 2.967 20 10 CFCDHN [NH3+]C1(CNCc2c([O-])ccc(Cl)c2F)CCCC1 ZINC000849350037 633625697 /nfs/dbraw/zinc/62/56/97/633625697.db2.gz NYTFULKXHZDSME-UHFFFAOYSA-N 0 3 272.751 2.546 20 10 CFCDHN COc1cncc(CNCc2ccc(N(C)C)cc2C)c1 ZINC000850136619 633851379 /nfs/dbraw/zinc/85/13/79/633851379.db2.gz BDVNXNWFPUVXGV-UHFFFAOYSA-N 0 3 285.391 2.754 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(COC)CCCC2)c([O-])c1 ZINC000850345255 633947626 /nfs/dbraw/zinc/94/76/26/633947626.db2.gz PTMHOFDXNMSRSL-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN COc1ccc(N2CC[C@@H]([NH2+]Cc3ccccc3[O-])C2)cc1 ZINC000850346850 633948400 /nfs/dbraw/zinc/94/84/00/633948400.db2.gz YQODGVOAHANPRK-OAHLLOKOSA-N 0 3 298.386 2.769 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccoc3C)C2)cc1 ZINC000850347158 633948848 /nfs/dbraw/zinc/94/88/48/633948848.db2.gz OVXRVOAFXQSCQS-HNNXBMFYSA-N 0 3 286.375 2.965 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C1CCC1)c1ccc(C)cc1[O-] ZINC000850487165 634014961 /nfs/dbraw/zinc/01/49/61/634014961.db2.gz FSBBXQULRBJSLB-LSDHHAIUSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)C2(CO)CC2)c([O-])c1 ZINC000850513165 634024937 /nfs/dbraw/zinc/02/49/37/634024937.db2.gz CPXJKXZFLVDDQW-OLZOCXBDSA-N 0 3 263.381 2.821 20 10 CFCDHN CN(Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1O ZINC000109771516 634233317 /nfs/dbraw/zinc/23/33/17/634233317.db2.gz SFJNTXGCTMJALF-UHFFFAOYSA-N 0 3 272.304 2.932 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1cccc(F)c1 ZINC000109772712 634234852 /nfs/dbraw/zinc/23/48/52/634234852.db2.gz FAURKFRILJYELU-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1cccc(F)c1 ZINC000109772712 634234853 /nfs/dbraw/zinc/23/48/53/634234853.db2.gz FAURKFRILJYELU-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCOCCF)c2c1c(F)ccc2[O-] ZINC000853238403 634948382 /nfs/dbraw/zinc/94/83/82/634948382.db2.gz ICJCZAWDKFUBIP-KOLCDFICSA-N 0 3 271.307 2.655 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CNC)c1cccc(Cl)c1[O-] ZINC000854231641 635267799 /nfs/dbraw/zinc/26/77/99/635267799.db2.gz IJGLMDKEPUEEKJ-BXKDBHETSA-N 0 3 256.777 2.694 20 10 CFCDHN CC[C@@H](N[C@H](C)C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000854231641 635267804 /nfs/dbraw/zinc/26/78/04/635267804.db2.gz IJGLMDKEPUEEKJ-BXKDBHETSA-N 0 3 256.777 2.694 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CNC)c1cccc(Cl)c1[O-] ZINC000854231643 635268325 /nfs/dbraw/zinc/26/83/25/635268325.db2.gz IJGLMDKEPUEEKJ-JOYOIKCWSA-N 0 3 256.777 2.694 20 10 CFCDHN CC[C@@H](N[C@@H](C)C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000854231643 635268327 /nfs/dbraw/zinc/26/83/27/635268327.db2.gz IJGLMDKEPUEEKJ-JOYOIKCWSA-N 0 3 256.777 2.694 20 10 CFCDHN Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccccc3[O-])C2)nc1 ZINC000858010596 636113141 /nfs/dbraw/zinc/11/31/41/636113141.db2.gz CVUHNLZPEBUBCU-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccccc3[O-])C2)nc1 ZINC000858010596 636113147 /nfs/dbraw/zinc/11/31/47/636113147.db2.gz CVUHNLZPEBUBCU-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2CCSC2)cc1F ZINC000858147037 636139314 /nfs/dbraw/zinc/13/93/14/636139314.db2.gz GCKFAPUNTASAHF-SNVBAGLBSA-N 0 3 272.364 2.626 20 10 CFCDHN CO[C@H](CNCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858168401 636146434 /nfs/dbraw/zinc/14/64/34/636146434.db2.gz URWHJUQKVQWBHH-OAHLLOKOSA-N 0 3 284.350 2.545 20 10 CFCDHN Cc1ccc(O)c(CNCc2cc(C(F)(F)F)n[nH]2)c1 ZINC000858239586 636160622 /nfs/dbraw/zinc/16/06/22/636160622.db2.gz QGHPHSYURKWHFS-UHFFFAOYSA-N 0 3 285.269 2.732 20 10 CFCDHN COC(=O)C1=CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000858475046 636262703 /nfs/dbraw/zinc/26/27/03/636262703.db2.gz XAWWLKYVDZGOQP-AAEUAGOBSA-N 0 3 275.348 2.613 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000858484967 636268070 /nfs/dbraw/zinc/26/80/70/636268070.db2.gz HHGPNZGNGDGDRW-OLZOCXBDSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@@H]1[C@H](CO)CCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862384799 637347488 /nfs/dbraw/zinc/34/74/88/637347488.db2.gz KHJGLJFCWIWPRX-XHDPSFHLSA-N 0 3 298.377 2.624 20 10 CFCDHN Oc1ccccc1CN1CCc2c(O)cccc2C1 ZINC000862529480 637408791 /nfs/dbraw/zinc/40/87/91/637408791.db2.gz LRAPVSXORMNCHP-UHFFFAOYSA-N 0 3 255.317 2.656 20 10 CFCDHN C[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1ccc2ccccc2c1[O-] ZINC000863546559 637692858 /nfs/dbraw/zinc/69/28/58/637692858.db2.gz KYAQZFLDMWLRJP-MQIPJXDCSA-N 0 3 270.376 2.946 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccnn1CC1CCC1 ZINC000865442787 638338931 /nfs/dbraw/zinc/33/89/31/638338931.db2.gz SWCPCLCNLJVGOT-UHFFFAOYSA-N 0 3 271.364 2.679 20 10 CFCDHN c1csc(SCCCNCc2cn(C3CC3)cn2)n1 ZINC000865468546 638355143 /nfs/dbraw/zinc/35/51/43/638355143.db2.gz ILALOSIKPDGBCL-UHFFFAOYSA-N 0 3 294.449 2.947 20 10 CFCDHN Cc1ncc([C@H](C)NCc2cc3c(cc2O)OCO3)s1 ZINC000865700991 638525046 /nfs/dbraw/zinc/52/50/46/638525046.db2.gz DUWKQAPCKZCXBJ-QMMMGPOBSA-N 0 3 292.360 2.737 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]Cc1cccc2c1CCOC2 ZINC000865725090 638537740 /nfs/dbraw/zinc/53/77/40/638537740.db2.gz CYQFEWJKXXROPP-UHFFFAOYSA-N 0 3 299.370 2.763 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@@H](O)C1CCCC1)CC2 ZINC000866638435 638859649 /nfs/dbraw/zinc/85/96/49/638859649.db2.gz HTESZALNKXEJFD-HUUCEWRRSA-N 0 3 275.392 2.910 20 10 CFCDHN CN(C)Cc1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 ZINC000871202366 641241512 /nfs/dbraw/zinc/24/15/12/641241512.db2.gz FSKOIGQDLLQVLN-UHFFFAOYSA-N 0 3 296.370 2.610 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCOC2=O)c([O-])c1 ZINC000872112593 641643789 /nfs/dbraw/zinc/64/37/89/641643789.db2.gz KLVWSUXEENQQDF-OLZOCXBDSA-N 0 3 277.364 2.695 20 10 CFCDHN Cc1nccnc1[C@@H](C)N[C@H](C)c1ccccc1O ZINC000872134687 641662819 /nfs/dbraw/zinc/66/28/19/641662819.db2.gz UGJAVMXVJSEKFK-ZYHUDNBSSA-N 0 3 257.337 2.902 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cccc(Cl)c1[O-])CN1CCCC1 ZINC000124715742 642302642 /nfs/dbraw/zinc/30/26/42/642302642.db2.gz ZCNVTOSXOBDMMX-LBPRGKRZSA-N 0 3 282.815 2.867 20 10 CFCDHN COc1cccc(CC[NH2+]Cc2ccccc2[O-])c1 ZINC000083422057 650763567 /nfs/dbraw/zinc/76/35/67/650763567.db2.gz GIRHQLGNSOVZMJ-UHFFFAOYSA-N 0 3 257.333 2.733 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])Cc1cccn(C(F)F)c1=O ZINC000876615570 642945889 /nfs/dbraw/zinc/94/58/89/642945889.db2.gz IBRVKUQJEDRWNR-UHFFFAOYSA-N 0 3 294.301 2.581 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])Cc1cccn(C(F)F)c1=O ZINC000876615570 642945894 /nfs/dbraw/zinc/94/58/94/642945894.db2.gz IBRVKUQJEDRWNR-UHFFFAOYSA-N 0 3 294.301 2.581 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000876626635 642950619 /nfs/dbraw/zinc/95/06/19/642950619.db2.gz DSOYDQCQOSIKQT-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000876626635 642950621 /nfs/dbraw/zinc/95/06/21/642950621.db2.gz DSOYDQCQOSIKQT-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1ccc(C)cc1[O-])C1CC1 ZINC000876640816 642954661 /nfs/dbraw/zinc/95/46/61/642954661.db2.gz GLAAJZKLTRDZHJ-UHFFFAOYSA-N 0 3 277.364 2.618 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1ccc(C)cc1[O-])C1CC1 ZINC000876640816 642954664 /nfs/dbraw/zinc/95/46/64/642954664.db2.gz GLAAJZKLTRDZHJ-UHFFFAOYSA-N 0 3 277.364 2.618 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000876679710 642970253 /nfs/dbraw/zinc/97/02/53/642970253.db2.gz JGDCCCREFAEUQU-CQSZACIVSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000876679710 642970255 /nfs/dbraw/zinc/97/02/55/642970255.db2.gz JGDCCCREFAEUQU-CQSZACIVSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000876741848 642989574 /nfs/dbraw/zinc/98/95/74/642989574.db2.gz UDDHEQYEYXHUFL-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000876781132 643005665 /nfs/dbraw/zinc/00/56/65/643005665.db2.gz KAGSOCXMYRHDTQ-UONOGXRCSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000876781132 643005668 /nfs/dbraw/zinc/00/56/68/643005668.db2.gz KAGSOCXMYRHDTQ-UONOGXRCSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876783361 643007939 /nfs/dbraw/zinc/00/79/39/643007939.db2.gz ZYEOCLGYENAMMZ-DZGCQCFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000876783361 643007944 /nfs/dbraw/zinc/00/79/44/643007944.db2.gz ZYEOCLGYENAMMZ-DZGCQCFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000876812653 643019782 /nfs/dbraw/zinc/01/97/82/643019782.db2.gz XTNSXHODSPGWSV-GJZGRUSLSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000876812653 643019789 /nfs/dbraw/zinc/01/97/89/643019789.db2.gz XTNSXHODSPGWSV-GJZGRUSLSA-N 0 3 275.392 2.949 20 10 CFCDHN COc1ccccc1OCC[NH2+]Cc1c(C)cccc1[O-] ZINC000876881755 643048279 /nfs/dbraw/zinc/04/82/79/643048279.db2.gz OLKHDALCAZLJML-UHFFFAOYSA-N 0 3 287.359 2.878 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCN(C)Cc1ccccc1 ZINC000876963748 643084966 /nfs/dbraw/zinc/08/49/66/643084966.db2.gz VMBGHZFPLIJIMF-UHFFFAOYSA-N 0 3 284.403 2.922 20 10 CFCDHN COc1cccc2c1OC[C@H]([NH2+]Cc1ccc(C)cc1[O-])C2 ZINC000877007135 643102284 /nfs/dbraw/zinc/10/22/84/643102284.db2.gz DSECLPQUHIKTAM-OAHLLOKOSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCC(C)(C)CO ZINC000877058490 643126297 /nfs/dbraw/zinc/12/62/97/643126297.db2.gz JAPRHNUZQJEQOA-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN COC(C)(C)C[C@H](C)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877064228 643129185 /nfs/dbraw/zinc/12/91/85/643129185.db2.gz OUUVUMNIXGUETL-LBPRGKRZSA-N 0 3 251.370 2.994 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877065813 643131683 /nfs/dbraw/zinc/13/16/83/643131683.db2.gz WQKBTHCOBZWTAG-TZMCWYRMSA-N 0 3 251.370 2.587 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])C(C)(C)C ZINC000877068069 643132010 /nfs/dbraw/zinc/13/20/10/643132010.db2.gz PYFRAJRQXXXFBZ-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)c([O-])c1 ZINC000877086063 643144661 /nfs/dbraw/zinc/14/46/61/643144661.db2.gz MFDRQUGINVFOOR-SQWLQELKSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([C@@H](O)C[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877090759 643146791 /nfs/dbraw/zinc/14/67/91/643146791.db2.gz BIGGODCZQUAIOU-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000877089558 643146880 /nfs/dbraw/zinc/14/68/80/643146880.db2.gz OADHVGRVHVISPM-ZDUSSCGKSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2COC3(CCCCC3)O2)c([O-])c1 ZINC000877136658 643171521 /nfs/dbraw/zinc/17/15/21/643171521.db2.gz JFUAKAUXWFMWMQ-HNNXBMFYSA-N 0 3 291.391 2.866 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877438525 643272729 /nfs/dbraw/zinc/27/27/29/643272729.db2.gz KGIUQPQCOMJNQR-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877438525 643272735 /nfs/dbraw/zinc/27/27/35/643272735.db2.gz KGIUQPQCOMJNQR-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CO[C@H](CC[NH2+]Cc1ccc(C)cc1[O-])C(F)(F)F ZINC000877466526 643287159 /nfs/dbraw/zinc/28/71/59/643287159.db2.gz LVMGTWQJSCSAJV-GFCCVEGCSA-N 0 3 277.286 2.758 20 10 CFCDHN C[N@H+](CCCN1CCCC1)Cc1ccc(F)c(F)c1[O-] ZINC000877496561 643308849 /nfs/dbraw/zinc/30/88/49/643308849.db2.gz UYJBNTZCZLXDCZ-UHFFFAOYSA-N 0 3 284.350 2.588 20 10 CFCDHN C[N@@H+](CCCN1CCCC1)Cc1ccc(F)c(F)c1[O-] ZINC000877496561 643308854 /nfs/dbraw/zinc/30/88/54/643308854.db2.gz UYJBNTZCZLXDCZ-UHFFFAOYSA-N 0 3 284.350 2.588 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877496884 643308866 /nfs/dbraw/zinc/30/88/66/643308866.db2.gz XXLBBYCXHKGJJP-OCCSQVGLSA-N 0 3 277.364 2.522 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC000877508097 643317976 /nfs/dbraw/zinc/31/79/76/643317976.db2.gz RYKKRBBNYNUPHY-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC000877508097 643317982 /nfs/dbraw/zinc/31/79/82/643317982.db2.gz RYKKRBBNYNUPHY-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCCSC1 ZINC000877533808 643336150 /nfs/dbraw/zinc/33/61/50/643336150.db2.gz WJFBKENNAKDNMJ-LBPRGKRZSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1cnn([C@H]2CC[N@H+](Cc3ccc(C)cc3[O-])C2)c1 ZINC000877540978 643343924 /nfs/dbraw/zinc/34/39/24/643343924.db2.gz CNXLVDHWHSXXTI-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(C)cc3[O-])C2)c1 ZINC000877540978 643343931 /nfs/dbraw/zinc/34/39/31/643343931.db2.gz CNXLVDHWHSXXTI-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000877543454 643345192 /nfs/dbraw/zinc/34/51/92/643345192.db2.gz BFHYGFGQJMKNEL-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000877543454 643345196 /nfs/dbraw/zinc/34/51/96/643345196.db2.gz BFHYGFGQJMKNEL-IBGZPJMESA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000877552953 643354464 /nfs/dbraw/zinc/35/44/64/643354464.db2.gz UPOZBDSAFPHUAC-HNNXBMFYSA-N 0 3 277.408 2.979 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1ccc(C)cc1[O-])OC ZINC000877559543 643360293 /nfs/dbraw/zinc/36/02/93/643360293.db2.gz YWYZOADRQBJIKY-DOMZBBRYSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000877573004 643371165 /nfs/dbraw/zinc/37/11/65/643371165.db2.gz MUYIWSJUTYODCE-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000877573004 643371171 /nfs/dbraw/zinc/37/11/71/643371171.db2.gz MUYIWSJUTYODCE-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])[C@H](O)C(C)C ZINC000877591631 643384719 /nfs/dbraw/zinc/38/47/19/643384719.db2.gz WJBSNXORGFPEQN-UKRRQHHQSA-N 0 3 251.370 2.586 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)cc1[O-])[C@H](O)C(C)C ZINC000877591629 643385297 /nfs/dbraw/zinc/38/52/97/643385297.db2.gz WJBSNXORGFPEQN-DZGCQCFKSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(CO)CCc3ccccc32)c([O-])c1 ZINC000877610007 643396607 /nfs/dbraw/zinc/39/66/07/643396607.db2.gz QASUUWYFNUEANM-IBGZPJMESA-N 0 3 297.398 2.667 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC([C@@H](C)CO)CC1 ZINC000877612869 643399989 /nfs/dbraw/zinc/39/99/89/643399989.db2.gz PQSOVMVWFKCPNY-ZDUSSCGKSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCN2C(C)(C)C)c([O-])c1 ZINC000877619744 643406267 /nfs/dbraw/zinc/40/62/67/643406267.db2.gz KRGPUPQKHAYDSP-CQSZACIVSA-N 0 3 262.397 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCCN2CC(F)F)c([O-])c1 ZINC000877651849 643432264 /nfs/dbraw/zinc/43/22/64/643432264.db2.gz MLLJDEAGUWPBCH-CYBMUJFWSA-N 0 3 284.350 2.520 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2c3ccccc3C(=O)N2C)c([O-])c1 ZINC000877657142 643437313 /nfs/dbraw/zinc/43/73/13/643437313.db2.gz WWEJZAMUHNDPTQ-MRXNPFEDSA-N 0 3 296.370 2.617 20 10 CFCDHN CC[C@@]1(O)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000877691968 643458191 /nfs/dbraw/zinc/45/81/91/643458191.db2.gz YXHCZBDFNFXYQK-MRXNPFEDSA-N 0 3 280.387 2.629 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H]2CN3CCC2CC3)cc1Cl ZINC000877706052 643472327 /nfs/dbraw/zinc/47/23/27/643472327.db2.gz FNPQYQGKBPLFBT-HNNXBMFYSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H]2CN3CCC2CC3)cc1Cl ZINC000877706052 643472333 /nfs/dbraw/zinc/47/23/33/643472333.db2.gz FNPQYQGKBPLFBT-HNNXBMFYSA-N 0 3 294.826 2.880 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877741575 643511137 /nfs/dbraw/zinc/51/11/37/643511137.db2.gz WENRECLKUWVKEP-ZIAGYGMSSA-N 0 3 293.432 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877741575 643511142 /nfs/dbraw/zinc/51/11/42/643511142.db2.gz WENRECLKUWVKEP-ZIAGYGMSSA-N 0 3 293.432 2.976 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877741719 643513394 /nfs/dbraw/zinc/51/33/94/643513394.db2.gz ZFFXHABTLCDXDZ-QWHCGFSZSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877741719 643513397 /nfs/dbraw/zinc/51/33/97/643513397.db2.gz ZFFXHABTLCDXDZ-QWHCGFSZSA-N 0 3 263.406 2.886 20 10 CFCDHN C[C@@H](NCc1ncc(CN(C)C)s1)c1ccccc1O ZINC000877755631 643535926 /nfs/dbraw/zinc/53/59/26/643535926.db2.gz ISDCGCIVODDGAI-LLVKDONJSA-N 0 3 291.420 2.761 20 10 CFCDHN COCc1ccc(CN[C@@H](C)c2ccccc2O)o1 ZINC000877757038 643536501 /nfs/dbraw/zinc/53/65/01/643536501.db2.gz BPGALRNCOHWGLF-NSHDSACASA-N 0 3 261.321 2.982 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@H](O)C1CCCC1 ZINC000877777413 643553405 /nfs/dbraw/zinc/55/34/05/643553405.db2.gz ABCSEQSEHRWATP-HNNXBMFYSA-N 0 3 267.344 2.562 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)c([O-])c1 ZINC000877807178 643569640 /nfs/dbraw/zinc/56/96/40/643569640.db2.gz VIHNVRDXKLIKNM-IVMMDQJWSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000877807581 643570326 /nfs/dbraw/zinc/57/03/26/643570326.db2.gz XIILRKSNFGVBTB-HEHGZKQESA-N 0 3 261.365 2.748 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[O-])CCN1C ZINC000090721339 650880466 /nfs/dbraw/zinc/88/04/66/650880466.db2.gz CBBLCKFJKAFMDF-MFKMUULPSA-N 0 3 268.788 2.618 20 10 CFCDHN CC(C)C[C@H](C)N(C)C(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648385 644362015 /nfs/dbraw/zinc/36/20/15/644362015.db2.gz MILSQKFANFJUQZ-UONOGXRCSA-N 0 3 292.423 2.936 20 10 CFCDHN C[C@@H](NCc1cc(-c2cnn(C)c2)no1)c1ccccc1O ZINC000879649423 644362629 /nfs/dbraw/zinc/36/26/29/644362629.db2.gz SEVOPBDWNAWLSX-LLVKDONJSA-N 0 3 298.346 2.632 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)C(=O)N1CCC(C)CC1)c1ccccc1[O-] ZINC000879649332 644363031 /nfs/dbraw/zinc/36/30/31/644363031.db2.gz QQILMRMDMSKPOD-KGLIPLIRSA-N 0 3 290.407 2.690 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1C[C@@H](C)C[C@H](C)C1)c1ccccc1[O-] ZINC000879653282 644366183 /nfs/dbraw/zinc/36/61/83/644366183.db2.gz MODHKISOLJJKCH-IHRRRGAJSA-N 0 3 290.407 2.547 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC[C@H]2CO)cc1F ZINC000092455747 650920516 /nfs/dbraw/zinc/92/05/16/650920516.db2.gz VZYXASJHDAZIPS-AWEZNQCLSA-N 0 3 280.387 2.629 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC(C)CC1)c1cc(F)ccc1[O-] ZINC000094617829 650960148 /nfs/dbraw/zinc/96/01/48/650960148.db2.gz VXTPQGZBJGLMPA-ZDUSSCGKSA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@H](NCc1ccncc1N)c1ccc(N(C)C)cc1 ZINC000883091918 645601641 /nfs/dbraw/zinc/60/16/41/645601641.db2.gz AIGCFCZXQAEGNE-LBPRGKRZSA-N 0 3 270.380 2.581 20 10 CFCDHN CCN1CC[C@@H]1C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000883354928 645760032 /nfs/dbraw/zinc/76/00/32/645760032.db2.gz FMARDRWERWHEBR-DMDPSCGWSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)C(F)(F)C(F)(F)F)c1ccccc1[O-] ZINC000883359496 645766008 /nfs/dbraw/zinc/76/60/08/645766008.db2.gz HSQJTZGHZJVDKU-OIBJUYFYSA-N 0 3 299.239 2.601 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)C(F)(F)C(F)(F)F)c1ccccc1[O-] ZINC000883359498 645766142 /nfs/dbraw/zinc/76/61/42/645766142.db2.gz HSQJTZGHZJVDKU-XVKPBYJWSA-N 0 3 299.239 2.601 20 10 CFCDHN COC[C@H](C)[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000132564322 645935427 /nfs/dbraw/zinc/93/54/27/645935427.db2.gz YOCMWQIBOIUJBE-VIFPVBQESA-N 0 3 288.185 2.588 20 10 CFCDHN C[C@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)CCO1 ZINC000028754390 645955760 /nfs/dbraw/zinc/95/57/60/645955760.db2.gz IBCTWRNJDYLMOH-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)CCO1 ZINC000028754390 645955764 /nfs/dbraw/zinc/95/57/64/645955764.db2.gz IBCTWRNJDYLMOH-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@H]1CN(Cc2c(O)ccc3ccccc32)CCO1 ZINC000028754390 645955765 /nfs/dbraw/zinc/95/57/65/645955765.db2.gz IBCTWRNJDYLMOH-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000134225926 646309099 /nfs/dbraw/zinc/30/90/99/646309099.db2.gz BJVREXMSXYKRCC-UHFFFAOYSA-N 0 3 270.332 2.640 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1c([O-])cccc1F ZINC000886524915 647029141 /nfs/dbraw/zinc/02/91/41/647029141.db2.gz TZZFHJSKXFFLPK-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN CC1(C)O[C@@H]2C[C@@H]([NH2+][C@@H]3CCc4cccc([O-])c43)C[C@@H]2O1 ZINC000927057787 648693119 /nfs/dbraw/zinc/69/31/19/648693119.db2.gz UDVUUYMDKLOTLN-GBOPCIDUSA-N 0 3 289.375 2.652 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1cc(F)ccc1[O-] ZINC000927061691 648694263 /nfs/dbraw/zinc/69/42/63/648694263.db2.gz VUCYJJDNMJYIFQ-VGKMCQHDSA-N 0 3 295.354 2.864 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCOC1CC1)C[C@H]1CCCO1 ZINC000929971169 649158594 /nfs/dbraw/zinc/15/85/94/649158594.db2.gz MSDQMKVPWMXPDI-MRXNPFEDSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCOC1CC1)C[C@H]1CCCO1 ZINC000929971169 649158598 /nfs/dbraw/zinc/15/85/98/649158598.db2.gz MSDQMKVPWMXPDI-MRXNPFEDSA-N 0 3 291.391 2.552 20 10 CFCDHN CCN(C)c1ccc(CN2CCc3nccc(N)c3C2)cc1 ZINC000931517106 649445543 /nfs/dbraw/zinc/44/55/43/649445543.db2.gz FREBRCNFQPEUGQ-UHFFFAOYSA-N 0 3 296.418 2.678 20 10 CFCDHN CCN(Cc1ccc(C(F)(F)F)cc1[O-])[C@H]1CC[NH2+]C1 ZINC001235970493 778633371 /nfs/dbraw/zinc/63/33/71/778633371.db2.gz KHOBVYSWENHVEJ-LBPRGKRZSA-N 0 3 288.313 2.595 20 10 CFCDHN CCC1([NH3+])CN(Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001236186571 778729990 /nfs/dbraw/zinc/72/99/90/778729990.db2.gz PEOFJXHACALMCX-UHFFFAOYSA-N 0 3 282.387 2.982 20 10 CFCDHN C[C@H]([NH2+]CCO[C@H]1CC1(F)F)c1cc(F)ccc1[O-] ZINC000690725619 770778462 /nfs/dbraw/zinc/77/84/62/770778462.db2.gz GQCASPPLRUIJEI-UFBFGSQYSA-N 0 3 275.270 2.606 20 10 CFCDHN CCN(Cc1ccc(N(C)C)cc1Cl)CC(C)(C)O ZINC001140924388 775654225 /nfs/dbraw/zinc/65/42/25/775654225.db2.gz ICBFWUUUCWPCFN-UHFFFAOYSA-N 0 3 284.831 2.999 20 10 CFCDHN C[C@@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(F)ccc1[O-] ZINC000396559949 775939308 /nfs/dbraw/zinc/93/93/08/775939308.db2.gz WEXLXICLWLHQNX-MWLCHTKSSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1cccc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)n1 ZINC000296548324 776041525 /nfs/dbraw/zinc/04/15/25/776041525.db2.gz STEXTADDHLQZBR-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000722401024 776617244 /nfs/dbraw/zinc/61/72/44/776617244.db2.gz MLSBKOIFHLTPDA-CMPLNLGQSA-N 0 3 293.260 2.731 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCc2nccn2CC1 ZINC001231590506 777270512 /nfs/dbraw/zinc/27/05/12/777270512.db2.gz FJGFDXDDZQHCSM-UHFFFAOYSA-N 0 3 293.370 2.800 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCc2nccn2CC1 ZINC001231590506 777270521 /nfs/dbraw/zinc/27/05/21/777270521.db2.gz FJGFDXDDZQHCSM-UHFFFAOYSA-N 0 3 293.370 2.800 20 10 CFCDHN COc1cc(CN2CCCC[C@](C)(F)C2)c(O)cc1O ZINC001231635393 777287413 /nfs/dbraw/zinc/28/74/13/777287413.db2.gz XWUSGYIZVAQTHJ-HNNXBMFYSA-N 0 3 283.343 2.821 20 10 CFCDHN Cc1cc(C)c(CN2CCC(=O)[C@H](C)CC2)c(O)c1 ZINC001231843002 777344989 /nfs/dbraw/zinc/34/49/89/777344989.db2.gz RRRXXAHVJZLWOO-GFCCVEGCSA-N 0 3 261.365 2.810 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@@H](OC(C)C)C1 ZINC001231854778 777352330 /nfs/dbraw/zinc/35/23/30/777352330.db2.gz LWYDQTDXNHWWCV-MRXNPFEDSA-N 0 3 292.423 2.761 20 10 CFCDHN [O-]c1c(C[NH+]2CCN(CCF)CC2)ccc2ccccc21 ZINC001231880471 777363536 /nfs/dbraw/zinc/36/35/36/777363536.db2.gz GKUROKRKRPQGBF-UHFFFAOYSA-N 0 3 288.366 2.633 20 10 CFCDHN CN(C1CC1)[C@@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])C1 ZINC001231914407 777382939 /nfs/dbraw/zinc/38/29/39/777382939.db2.gz LFHGWKREAVSVRK-CYBMUJFWSA-N 0 3 280.799 2.714 20 10 CFCDHN CN(C1CC1)[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2[O-])C1 ZINC001231914407 777382942 /nfs/dbraw/zinc/38/29/42/777382942.db2.gz LFHGWKREAVSVRK-CYBMUJFWSA-N 0 3 280.799 2.714 20 10 CFCDHN CCN(Cc1n[nH]c2c1CCC2)Cc1ccc(N(C)C)cc1 ZINC001232429774 777558629 /nfs/dbraw/zinc/55/86/29/777558629.db2.gz BSZRQQOHXUYHNL-UHFFFAOYSA-N 0 3 298.434 2.987 20 10 CFCDHN Cc1ccc(CN(C)Cc2ccc(N(C)C)cc2O)cn1 ZINC001232840981 777689808 /nfs/dbraw/zinc/68/98/08/777689808.db2.gz OZQOLNJBNTYFQE-UHFFFAOYSA-N 0 3 285.391 2.794 20 10 CFCDHN [O-]c1c(C[NH+]2CCCC2)cccc1OC(F)(F)F ZINC001233727841 778057026 /nfs/dbraw/zinc/05/70/26/778057026.db2.gz PNBLNMMPWXGTKJ-UHFFFAOYSA-N 0 3 261.243 2.887 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3C[C@H](O)C[C@H]3C)c2c1 ZINC001234525281 778243798 /nfs/dbraw/zinc/24/37/98/778243798.db2.gz DPEYGLWZOXMVQA-DGCLKSJQSA-N 0 3 287.359 2.509 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3C[C@H](O)C[C@H]3C)c2c1 ZINC001234525281 778243805 /nfs/dbraw/zinc/24/38/05/778243805.db2.gz DPEYGLWZOXMVQA-DGCLKSJQSA-N 0 3 287.359 2.509 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CCCC34COC4)c2c1 ZINC001234552837 778250985 /nfs/dbraw/zinc/25/09/85/778250985.db2.gz KKJZDUJAPZGKLD-UHFFFAOYSA-N 0 3 299.370 2.919 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CCCC34COC4)c2c1 ZINC001234552837 778250991 /nfs/dbraw/zinc/25/09/91/778250991.db2.gz KKJZDUJAPZGKLD-UHFFFAOYSA-N 0 3 299.370 2.919 20 10 CFCDHN COc1ccc2ccc(O)c(CN3CCCC34COC4)c2c1 ZINC001234552837 778250997 /nfs/dbraw/zinc/25/09/97/778250997.db2.gz KKJZDUJAPZGKLD-UHFFFAOYSA-N 0 3 299.370 2.919 20 10 CFCDHN CCO[C@@H](C)COc1ccc(N2CCN(CC)CC2)cc1 ZINC001234660258 778280521 /nfs/dbraw/zinc/28/05/21/778280521.db2.gz FMUKRPJKSYQTRM-HNNXBMFYSA-N 0 3 292.423 2.632 20 10 CFCDHN CN(Cc1ccc(C(F)(F)F)cc1[O-])[C@@H]1CCC[NH2+]C1 ZINC001235347150 778463861 /nfs/dbraw/zinc/46/38/61/778463861.db2.gz MYSDBEQVADSKBW-GFCCVEGCSA-N 0 3 288.313 2.595 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@H]1O ZINC001235674634 778532780 /nfs/dbraw/zinc/53/27/80/778532780.db2.gz HIHGLRYBXHJLGP-IUODEOHRSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@H]1O ZINC001235674634 778532788 /nfs/dbraw/zinc/53/27/88/778532788.db2.gz HIHGLRYBXHJLGP-IUODEOHRSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235674966 778532967 /nfs/dbraw/zinc/53/29/67/778532967.db2.gz JWOYHMIKSKHDJI-OCCSQVGLSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235674966 778532972 /nfs/dbraw/zinc/53/29/72/778532972.db2.gz JWOYHMIKSKHDJI-OCCSQVGLSA-N 0 3 277.408 2.892 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]([NH3+])CC[C@@H]2C)cc1Cl ZINC001235905570 778603729 /nfs/dbraw/zinc/60/37/29/778603729.db2.gz MQMANCKRHVVIEM-JQWIXIFHSA-N 0 3 268.788 2.666 20 10 CFCDHN CCC[C@H]1CN(Cc2cc(Cl)c(OC)cc2[O-])CC[NH2+]1 ZINC001236179470 778727856 /nfs/dbraw/zinc/72/78/56/778727856.db2.gz YHOJNTHEWWIXMB-LBPRGKRZSA-N 0 3 298.814 2.628 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@H]2CCCC[C@H]2[NH3+])c(Cl)c1 ZINC001236214609 778739400 /nfs/dbraw/zinc/73/94/00/778739400.db2.gz GNYNKRDHEZWMRU-KGLIPLIRSA-N 0 3 298.814 2.756 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN(C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238345 778747931 /nfs/dbraw/zinc/74/79/31/778747931.db2.gz CPCBKVQCTKATRO-AWEZNQCLSA-N 0 3 280.799 2.762 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)c(O)cc1[O-])C1CCN(C)CC1 ZINC001232261044 778914322 /nfs/dbraw/zinc/91/43/22/778914322.db2.gz AMIKWEKVJAZOFH-UHFFFAOYSA-N 0 3 298.814 2.667 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)c(O)cc1[O-])C1CCN(C)CC1 ZINC001232261044 778914331 /nfs/dbraw/zinc/91/43/31/778914331.db2.gz AMIKWEKVJAZOFH-UHFFFAOYSA-N 0 3 298.814 2.667 20 10 CFCDHN CC[N@H+](Cc1ccc(N)nc1C)Cc1ccccc1[O-] ZINC001232342967 778928595 /nfs/dbraw/zinc/92/85/95/778928595.db2.gz SMTQDQPPEKITCV-UHFFFAOYSA-N 0 3 271.364 2.700 20 10 CFCDHN CC[N@@H+](Cc1ccc(N)nc1C)Cc1ccccc1[O-] ZINC001232342967 778928601 /nfs/dbraw/zinc/92/86/01/778928601.db2.gz SMTQDQPPEKITCV-UHFFFAOYSA-N 0 3 271.364 2.700 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](CO)CC[C@H]2C)c([O-])c1 ZINC001236782754 778934279 /nfs/dbraw/zinc/93/42/79/778934279.db2.gz DPVCGAIMHMOTQF-TZMCWYRMSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](CO)CC[C@H]2C)c([O-])c1 ZINC001236782754 778934285 /nfs/dbraw/zinc/93/42/85/778934285.db2.gz DPVCGAIMHMOTQF-TZMCWYRMSA-N 0 3 263.381 2.547 20 10 CFCDHN CCCO[C@H]1CC[N@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236789815 778937732 /nfs/dbraw/zinc/93/77/32/778937732.db2.gz SDZIPKRFKJYKMJ-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCCO[C@H]1CC[N@@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236789815 778937736 /nfs/dbraw/zinc/93/77/36/778937736.db2.gz SDZIPKRFKJYKMJ-HNNXBMFYSA-N 0 3 263.381 2.956 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236807225 778946923 /nfs/dbraw/zinc/94/69/23/778946923.db2.gz DTXYVWHVQBGTSC-CXAGYDPISA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236807225 778946927 /nfs/dbraw/zinc/94/69/27/778946927.db2.gz DTXYVWHVQBGTSC-CXAGYDPISA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(CN2CCc3cc(O)ccc3C2)c(O)c1 ZINC001236809280 778949137 /nfs/dbraw/zinc/94/91/37/778949137.db2.gz QFZPLVXEPPMDNV-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001236816045 778950593 /nfs/dbraw/zinc/95/05/93/778950593.db2.gz QGZGEAWOIGCJLP-WFASDCNBSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001236816045 778950595 /nfs/dbraw/zinc/95/05/95/778950595.db2.gz QGZGEAWOIGCJLP-WFASDCNBSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)CCSC)c([O-])c1 ZINC001236820244 778954063 /nfs/dbraw/zinc/95/40/63/778954063.db2.gz HUOAQHFWCOHFJY-UHFFFAOYSA-N 0 3 255.383 2.504 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)CCSC)c([O-])c1 ZINC001236820244 778954066 /nfs/dbraw/zinc/95/40/66/778954066.db2.gz HUOAQHFWCOHFJY-UHFFFAOYSA-N 0 3 255.383 2.504 20 10 CFCDHN COc1cc(C)c(CN2CC3(C2)C[C@H](F)CS3)c(O)c1 ZINC001236822156 778954146 /nfs/dbraw/zinc/95/41/46/778954146.db2.gz YCFILJWBLYEURF-NSHDSACASA-N 0 3 297.395 2.739 20 10 CFCDHN CC(=O)N1CCN(Cc2cc3ccccc3cc2O)C[C@H]1C ZINC001236836612 778960219 /nfs/dbraw/zinc/96/02/19/778960219.db2.gz LPLZKVGYQOHWGX-CYBMUJFWSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236836494 778960445 /nfs/dbraw/zinc/96/04/45/778960445.db2.gz KCYNFJCBCRCRGW-HNNXBMFYSA-N 0 3 269.344 2.956 20 10 CFCDHN CC(=O)[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236836494 778960438 /nfs/dbraw/zinc/96/04/38/778960438.db2.gz KCYNFJCBCRCRGW-HNNXBMFYSA-N 0 3 269.344 2.956 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@]3(CCO3)C2)c([O-])c1 ZINC001237044842 778997915 /nfs/dbraw/zinc/99/79/15/778997915.db2.gz VBUILSVQCDMRFL-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@]3(CCO3)C2)c([O-])c1 ZINC001237044842 778997917 /nfs/dbraw/zinc/99/79/17/778997917.db2.gz VBUILSVQCDMRFL-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c([O-])c1 ZINC001237049072 778999113 /nfs/dbraw/zinc/99/91/13/778999113.db2.gz CXZUMPUJRJZMNQ-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@]3(C2)CCCCO3)c([O-])c1 ZINC001237049072 778999115 /nfs/dbraw/zinc/99/91/15/778999115.db2.gz CXZUMPUJRJZMNQ-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](CO)[C@H]2C)c([O-])c1 ZINC001237046306 778999333 /nfs/dbraw/zinc/99/93/33/778999333.db2.gz SZGFCDQWJLVHJI-DOMZBBRYSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](CO)[C@H]2C)c([O-])c1 ZINC001237046306 778999335 /nfs/dbraw/zinc/99/93/35/778999335.db2.gz SZGFCDQWJLVHJI-DOMZBBRYSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC3(CN(C)C3)C2)c([O-])c1 ZINC001237054758 779002326 /nfs/dbraw/zinc/00/23/26/779002326.db2.gz GGFFOURLJVTGSD-UHFFFAOYSA-N 0 3 274.408 2.653 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC3(CN(C)C3)C2)c([O-])c1 ZINC001237054758 779002328 /nfs/dbraw/zinc/00/23/28/779002328.db2.gz GGFFOURLJVTGSD-UHFFFAOYSA-N 0 3 274.408 2.653 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@H](O)C1 ZINC001237135307 779023236 /nfs/dbraw/zinc/02/32/36/779023236.db2.gz HPYGSMORZRIXKX-LBPRGKRZSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@H](O)C1 ZINC001237135307 779023244 /nfs/dbraw/zinc/02/32/44/779023244.db2.gz HPYGSMORZRIXKX-LBPRGKRZSA-N 0 3 289.297 2.758 20 10 CFCDHN Cc1cc(F)cc(CN2CCNC3=CCCC[C@@H]32)c1O ZINC001237229928 779056824 /nfs/dbraw/zinc/05/68/24/779056824.db2.gz QZABFSCNDCYUBS-HNNXBMFYSA-N 0 3 276.355 2.681 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1Cl ZINC001237406364 779100114 /nfs/dbraw/zinc/10/01/14/779100114.db2.gz UMPFPCUXNGPJQM-WFASDCNBSA-N 0 3 294.826 2.928 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@](C)(CO)CC1 ZINC001237484305 779117946 /nfs/dbraw/zinc/11/79/46/779117946.db2.gz BCJZFZDNLYDOPF-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@](C)(CO)CC1 ZINC001237484305 779117949 /nfs/dbraw/zinc/11/79/49/779117949.db2.gz BCJZFZDNLYDOPF-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@](C)(O)[C@H](C)C1 ZINC001237486082 779118278 /nfs/dbraw/zinc/11/82/78/779118278.db2.gz VKAFQSBUZFKJRJ-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@](C)(O)[C@H](C)C1 ZINC001237486082 779118281 /nfs/dbraw/zinc/11/82/81/779118281.db2.gz VKAFQSBUZFKJRJ-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@](C)(O)[C@H](C)C1 ZINC001237485904 779118299 /nfs/dbraw/zinc/11/82/99/779118299.db2.gz VKAFQSBUZFKJRJ-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@](C)(O)[C@H](C)C1 ZINC001237485904 779118301 /nfs/dbraw/zinc/11/83/01/779118301.db2.gz VKAFQSBUZFKJRJ-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(O)c1CN1CC(N2CCC(F)(F)CC2)C1 ZINC001237487456 779119263 /nfs/dbraw/zinc/11/92/63/779119263.db2.gz IWOWDSBFSGUHHX-UHFFFAOYSA-N 0 3 296.361 2.616 20 10 CFCDHN CC(=O)N1CC[C@@H]([N@@H+](Cc2c(C)cccc2[O-])C(C)C)C1 ZINC001237493404 779120591 /nfs/dbraw/zinc/12/05/91/779120591.db2.gz YALXBYUJLIACCU-OAHLLOKOSA-N 0 3 290.407 2.532 20 10 CFCDHN CC(=O)N1CC[C@@H]([N@H+](Cc2c(C)cccc2[O-])C(C)C)C1 ZINC001237493404 779120592 /nfs/dbraw/zinc/12/05/92/779120592.db2.gz YALXBYUJLIACCU-OAHLLOKOSA-N 0 3 290.407 2.532 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001237682066 779160650 /nfs/dbraw/zinc/16/06/50/779160650.db2.gz WKDAYVDWCXVMOT-XHDPSFHLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001237682066 779160654 /nfs/dbraw/zinc/16/06/54/779160654.db2.gz WKDAYVDWCXVMOT-XHDPSFHLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](O)CC2)c1[O-] ZINC001237682070 779161526 /nfs/dbraw/zinc/16/15/26/779161526.db2.gz WMCDBLSIYCAKSE-YGRLFVJLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](O)CC2)c1[O-] ZINC001237682070 779161530 /nfs/dbraw/zinc/16/15/30/779161530.db2.gz WMCDBLSIYCAKSE-YGRLFVJLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](O)(CF)CC2)c1[O-] ZINC001238055751 779240924 /nfs/dbraw/zinc/24/09/24/779240924.db2.gz DEEGWYDAKGWUAX-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](O)(CF)CC2)c1[O-] ZINC001238055751 779240930 /nfs/dbraw/zinc/24/09/30/779240930.db2.gz DEEGWYDAKGWUAX-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN COC1(C)CC[NH+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238058315 779241551 /nfs/dbraw/zinc/24/15/51/779241551.db2.gz QHTQJQUTTXSKJH-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN CC(=O)C1CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238061924 779242259 /nfs/dbraw/zinc/24/22/59/779242259.db2.gz LQJQCQMMMFEWMY-UHFFFAOYSA-N 0 3 265.328 2.641 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@H]1C ZINC001238071427 779246542 /nfs/dbraw/zinc/24/65/42/779246542.db2.gz XGBDOKDVUOTCAS-SMDDNHRTSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@H]1C ZINC001238071427 779246546 /nfs/dbraw/zinc/24/65/46/779246546.db2.gz XGBDOKDVUOTCAS-SMDDNHRTSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@@]1(C)CCC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238071131 779246694 /nfs/dbraw/zinc/24/66/94/779246694.db2.gz SOHJKGKKZRKQFT-INIZCTEOSA-N 0 3 295.354 2.615 20 10 CFCDHN COC(=O)[C@@]1(C)CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238071131 779246699 /nfs/dbraw/zinc/24/66/99/779246699.db2.gz SOHJKGKKZRKQFT-INIZCTEOSA-N 0 3 295.354 2.615 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(C)(C(=O)OC)CC2)c([O-])c1 ZINC001236794316 779638577 /nfs/dbraw/zinc/63/85/77/779638577.db2.gz KZBHJDKDXGQULK-UHFFFAOYSA-N 0 3 291.391 2.730 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccccc1[O-] ZINC000690299830 779822821 /nfs/dbraw/zinc/82/28/21/779822821.db2.gz NXWMOMPDSFRQNQ-QWHCGFSZSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccccc1[O-] ZINC000690299825 779824078 /nfs/dbraw/zinc/82/40/78/779824078.db2.gz NXWMOMPDSFRQNQ-CHWSQXEVSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCC2(C1)OCCO2)c1ccccc1[O-] ZINC000715714441 780316967 /nfs/dbraw/zinc/31/69/67/780316967.db2.gz CPBRSNVMSNAKHJ-STQMWFEESA-N 0 3 277.364 2.729 20 10 CFCDHN CCc1noc([C@@H]2CC[C@@H]([NH2+]Cc3ccccc3[O-])C2)n1 ZINC000922865637 780574461 /nfs/dbraw/zinc/57/44/61/780574461.db2.gz JYRQWTMRUQQYJL-DGCLKSJQSA-N 0 3 287.363 2.764 20 10 CFCDHN NCc1ccc(C2=CCN(c3ccccc3)CC2)cn1 ZINC001241355947 780804920 /nfs/dbraw/zinc/80/49/20/780804920.db2.gz ZHFNZTHXKYDMAK-UHFFFAOYSA-N 0 3 265.360 2.834 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)c1 ZINC000711869010 781483243 /nfs/dbraw/zinc/48/32/43/781483243.db2.gz JDJZRHDGMLEARP-RHSMWYFYSA-N 0 3 275.392 2.995 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C(C)(C)O ZINC000295106691 199348836 /nfs/dbraw/zinc/34/88/36/199348836.db2.gz WTXPCDNARQWXES-SMDDNHRTSA-N 0 3 251.370 2.901 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC1=CCCCC1)OCO2 ZINC000295136199 199365896 /nfs/dbraw/zinc/36/58/96/199365896.db2.gz PGHBKWLPBJTMEJ-UHFFFAOYSA-N 0 3 261.321 2.711 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@H](CO)C1 ZINC000092763654 347645521 /nfs/dbraw/zinc/64/55/21/347645521.db2.gz LUDNORUEXHMWIT-AWEZNQCLSA-N 0 3 283.371 2.873 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@H](CO)C1 ZINC000092763654 347645522 /nfs/dbraw/zinc/64/55/22/347645522.db2.gz LUDNORUEXHMWIT-AWEZNQCLSA-N 0 3 283.371 2.873 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCc3ccccc3[C@H]2CO)c1 ZINC000093455601 347675072 /nfs/dbraw/zinc/67/50/72/347675072.db2.gz TUJYRQJCSOKAMC-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCc3ccccc3[C@H]2CO)c1 ZINC000093455601 347675075 /nfs/dbraw/zinc/67/50/75/347675075.db2.gz TUJYRQJCSOKAMC-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1ccc(O)c(CN2CCc3ccccc3[C@H]2CO)c1 ZINC000093455601 347675079 /nfs/dbraw/zinc/67/50/79/347675079.db2.gz TUJYRQJCSOKAMC-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cc(OC)c(OC)cc1[O-])OC ZINC000292798757 348359575 /nfs/dbraw/zinc/35/95/75/348359575.db2.gz NGFGNWXBRKTCDZ-UHFFFAOYSA-N 0 3 297.395 2.704 20 10 CFCDHN CC[C@@H](CSC)[N@H+](C)Cc1cc(OC)ccc1[O-] ZINC000290609444 522603656 /nfs/dbraw/zinc/60/36/56/522603656.db2.gz WJIFKWHUODAWRP-LBPRGKRZSA-N 0 3 269.410 2.974 20 10 CFCDHN CC[C@@H](CSC)[N@@H+](C)Cc1cc(OC)ccc1[O-] ZINC000290609444 522603666 /nfs/dbraw/zinc/60/36/66/522603666.db2.gz WJIFKWHUODAWRP-LBPRGKRZSA-N 0 3 269.410 2.974 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H]1C[C@@H](O)C1 ZINC000294740101 199161829 /nfs/dbraw/zinc/16/18/29/199161829.db2.gz CFJJJCIISCIJQJ-IYBDPMFKSA-N 0 3 269.344 2.672 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)CCCO)c1ccccc1[O-] ZINC000294759327 199170157 /nfs/dbraw/zinc/17/01/57/199170157.db2.gz IXADLFUUGAASEP-OCCSQVGLSA-N 0 3 251.370 2.842 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CCCCO)c1 ZINC000294925287 199252436 /nfs/dbraw/zinc/25/24/36/199252436.db2.gz BEVJGQHTUGXIRJ-NEPJUHHUSA-N 0 3 267.369 2.603 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](OC)C(C)(C)C2)c1[O-] ZINC000294934910 199258057 /nfs/dbraw/zinc/25/80/57/199258057.db2.gz GNMRHVLNSRMQGY-CQSZACIVSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c1[O-] ZINC000294934910 199258059 /nfs/dbraw/zinc/25/80/59/199258059.db2.gz GNMRHVLNSRMQGY-CQSZACIVSA-N 0 3 279.380 2.648 20 10 CFCDHN C[C@@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1cccs1 ZINC000297549151 200225056 /nfs/dbraw/zinc/22/50/56/200225056.db2.gz FLMUSOVAXVBPNI-MLGOLLRUSA-N 0 3 289.400 2.938 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000297737714 200271518 /nfs/dbraw/zinc/27/15/18/200271518.db2.gz NVUZRNHCEPUBQC-NVXWUHKLSA-N 0 3 299.370 2.711 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)CN(C)C)c([O-])c1 ZINC000020087885 372227079 /nfs/dbraw/zinc/22/70/79/372227079.db2.gz YGROXHUSFCGIGN-ZDUSSCGKSA-N 0 3 264.413 2.939 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)Cn1ccnc1)c1ccccc1[O-] ZINC000037157340 372660511 /nfs/dbraw/zinc/66/05/11/372660511.db2.gz FWTUSJKDFUYDQE-JSGCOSHPSA-N 0 3 259.353 2.718 20 10 CFCDHN Cc1n[nH]cc1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000038011436 372763199 /nfs/dbraw/zinc/76/31/99/372763199.db2.gz YIBVLEMNVUKVAQ-LLVKDONJSA-N 0 3 258.369 2.635 20 10 CFCDHN CN(C)C(=O)CC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263657121 383685622 /nfs/dbraw/zinc/68/56/22/383685622.db2.gz GEZNEUMDPDBFSM-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000091964601 375073820 /nfs/dbraw/zinc/07/38/20/375073820.db2.gz JRUAVFCHXLPFEK-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000091964601 375073829 /nfs/dbraw/zinc/07/38/29/375073829.db2.gz JRUAVFCHXLPFEK-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN COc1ccc(CN(C)Cc2ccccc2O)cc1O ZINC000091956741 375074215 /nfs/dbraw/zinc/07/42/15/375074215.db2.gz UTWLZERJBPWVQH-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN CCN1CC[C@H]([N@H+](C)Cc2cccc(OC)c2[O-])[C@H](C)C1 ZINC000093639353 375275973 /nfs/dbraw/zinc/27/59/73/375275973.db2.gz KWTWKZRCDDELQE-HIFRSBDPSA-N 0 3 292.423 2.563 20 10 CFCDHN CCN1CC[C@H]([N@@H+](C)Cc2cccc(OC)c2[O-])[C@H](C)C1 ZINC000093639353 375275979 /nfs/dbraw/zinc/27/59/79/375275979.db2.gz KWTWKZRCDDELQE-HIFRSBDPSA-N 0 3 292.423 2.563 20 10 CFCDHN CC[N@H+](CCc1nccs1)Cc1cccc(OC)c1[O-] ZINC000093764623 375308394 /nfs/dbraw/zinc/30/83/94/375308394.db2.gz YKZZDQVDUKRPIJ-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CC[N@@H+](CCc1nccs1)Cc1cccc(OC)c1[O-] ZINC000093764623 375308398 /nfs/dbraw/zinc/30/83/98/375308398.db2.gz YKZZDQVDUKRPIJ-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1ccc(O)c(CN(C)CCOCC2CC2)c1 ZINC000093818652 375315614 /nfs/dbraw/zinc/31/56/14/375315614.db2.gz PAPIDSOQSBFWOI-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC000093505960 375258467 /nfs/dbraw/zinc/25/84/67/375258467.db2.gz WKEGWJYAZWUUEF-UKRRQHHQSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC000093505960 375258471 /nfs/dbraw/zinc/25/84/71/375258471.db2.gz WKEGWJYAZWUUEF-UKRRQHHQSA-N 0 3 291.391 2.792 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@](C)(O)c1ccccc1 ZINC000111235952 375833381 /nfs/dbraw/zinc/83/33/81/375833381.db2.gz JRRDNLRGLZVXRN-QGZVFWFLSA-N 0 3 271.360 2.732 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@](C)(O)c1ccccc1 ZINC000111235952 375833387 /nfs/dbraw/zinc/83/33/87/375833387.db2.gz JRRDNLRGLZVXRN-QGZVFWFLSA-N 0 3 271.360 2.732 20 10 CFCDHN C[N@H+](Cc1ccc2c(c1)CCO2)Cc1ccccc1[O-] ZINC000111235167 375833710 /nfs/dbraw/zinc/83/37/10/375833710.db2.gz JGCHAQKNKPLGDD-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN C[N@@H+](Cc1ccc2c(c1)CCO2)Cc1ccccc1[O-] ZINC000111235167 375833713 /nfs/dbraw/zinc/83/37/13/375833713.db2.gz JGCHAQKNKPLGDD-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN CN(C)[C@H]1CCC[N@H+](Cc2cccc(Cl)c2[O-])C1 ZINC000124586709 377067031 /nfs/dbraw/zinc/06/70/31/377067031.db2.gz JTMXNOICOFTPJO-LBPRGKRZSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(C)[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2[O-])C1 ZINC000124586709 377067041 /nfs/dbraw/zinc/06/70/41/377067041.db2.gz JTMXNOICOFTPJO-LBPRGKRZSA-N 0 3 268.788 2.572 20 10 CFCDHN COC[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000124730762 377081712 /nfs/dbraw/zinc/08/17/12/377081712.db2.gz HETWYOXBIYPXCA-AWEZNQCLSA-N 0 3 280.387 2.750 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CC1CC1)C[C@H]1CCCO1 ZINC000126957334 377257197 /nfs/dbraw/zinc/25/71/97/377257197.db2.gz VNCLUIJPFSUCEO-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CC1CC1)C[C@H]1CCCO1 ZINC000126957334 377257207 /nfs/dbraw/zinc/25/72/07/377257207.db2.gz VNCLUIJPFSUCEO-OAHLLOKOSA-N 0 3 261.365 2.783 20 10 CFCDHN CN(C)c1ccc(CN(C)C[C@H]2CCCO2)cc1F ZINC000128029437 377312433 /nfs/dbraw/zinc/31/24/33/377312433.db2.gz HVUSWPVFANJHCV-CYBMUJFWSA-N 0 3 266.360 2.503 20 10 CFCDHN Cc1nc(CC[N@@H+](C)Cc2ccccc2[O-])cs1 ZINC000128391676 377335282 /nfs/dbraw/zinc/33/52/82/377335282.db2.gz QXEYDQFGUSBSRM-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1nc(CC[N@H+](C)Cc2ccccc2[O-])cs1 ZINC000128391676 377335284 /nfs/dbraw/zinc/33/52/84/377335284.db2.gz QXEYDQFGUSBSRM-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000133132204 377906058 /nfs/dbraw/zinc/90/60/58/377906058.db2.gz VHGYNWDWRMMEFS-CQSZACIVSA-N 0 3 261.365 2.974 20 10 CFCDHN COCc1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000134226086 377995077 /nfs/dbraw/zinc/99/50/77/377995077.db2.gz SASOBSFLHNPZQT-UHFFFAOYSA-N 0 3 257.333 2.828 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+]Cc2ccccc2[O-])C12CCC2 ZINC000135200177 378097334 /nfs/dbraw/zinc/09/73/34/378097334.db2.gz XTHWKOYTKYFVJY-CABCVRRESA-N 0 3 261.365 2.830 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)[C@@H](CO)SC)cc1 ZINC000152466163 378417944 /nfs/dbraw/zinc/41/79/44/378417944.db2.gz VFHFVVGVKBZHKC-XJKSGUPXSA-N 0 3 296.480 2.735 20 10 CFCDHN COc1ccc2c(c1)C[N@@H+](Cc1ccccc1[O-])CC2 ZINC000179563650 380556595 /nfs/dbraw/zinc/55/65/95/380556595.db2.gz QBVSVBJRKWWVKN-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1ccc2c(c1)C[N@H+](Cc1ccccc1[O-])CC2 ZINC000179563650 380556599 /nfs/dbraw/zinc/55/65/99/380556599.db2.gz QBVSVBJRKWWVKN-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN CCCC(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179565743 380558360 /nfs/dbraw/zinc/55/83/60/380558360.db2.gz UQINOOBAAGJZFW-CQSZACIVSA-N 0 3 290.407 2.521 20 10 CFCDHN CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179565743 380558364 /nfs/dbraw/zinc/55/83/64/380558364.db2.gz UQINOOBAAGJZFW-CQSZACIVSA-N 0 3 290.407 2.521 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2ccccc2[O-])C[C@@H]1n1ccnc1 ZINC000179586139 380560302 /nfs/dbraw/zinc/56/03/02/380560302.db2.gz UTZHPBPQVFNEKU-ZFWWWQNUSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@@H]1n1ccnc1 ZINC000179586139 380560307 /nfs/dbraw/zinc/56/03/07/380560307.db2.gz UTZHPBPQVFNEKU-ZFWWWQNUSA-N 0 3 271.364 2.672 20 10 CFCDHN COCCCOC1CC[NH+](Cc2cccc(C)c2[O-])CC1 ZINC000180353928 380648000 /nfs/dbraw/zinc/64/80/00/380648000.db2.gz BAYYFBCZJXZTEF-UHFFFAOYSA-N 0 3 293.407 2.718 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(c2ccccc2)C1=O)c1ccccc1[O-] ZINC000179875099 380590401 /nfs/dbraw/zinc/59/04/01/380590401.db2.gz OOAQJIFXKZTODD-BBRMVZONSA-N 0 3 296.370 2.848 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@@H](C)C1)c1ccccc1[O-] ZINC000179899972 380594080 /nfs/dbraw/zinc/59/40/80/380594080.db2.gz PNSAAQZBXQWELS-KGLIPLIRSA-N 0 3 262.397 2.775 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000179902965 380596417 /nfs/dbraw/zinc/59/64/17/380596417.db2.gz KTEVSFPBNSKMRT-SJCJKPOMSA-N 0 3 287.359 2.785 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@]3(CCOC3)C2)c1[O-] ZINC000180616263 380682641 /nfs/dbraw/zinc/68/26/41/380682641.db2.gz PHYLPYCTPKTSPZ-HNNXBMFYSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@]3(CCOC3)C2)c1[O-] ZINC000180616263 380682647 /nfs/dbraw/zinc/68/26/47/380682647.db2.gz PHYLPYCTPKTSPZ-HNNXBMFYSA-N 0 3 281.783 2.966 20 10 CFCDHN COc1ccc(CNCc2cccc(C)c2O)cc1O ZINC000181377415 380784467 /nfs/dbraw/zinc/78/44/67/380784467.db2.gz WOVCPAXNWIUMFS-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@](CO)(C(C)C)C2)c1[O-] ZINC000367966812 380869903 /nfs/dbraw/zinc/86/99/03/380869903.db2.gz RHVKPVZNULEHQK-INIZCTEOSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@](CO)(C(C)C)C2)c1[O-] ZINC000367966812 380869908 /nfs/dbraw/zinc/86/99/08/380869908.db2.gz RHVKPVZNULEHQK-INIZCTEOSA-N 0 3 263.381 2.541 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOC[C@@H]1CCOC ZINC000368270297 380977477 /nfs/dbraw/zinc/97/74/77/380977477.db2.gz VESOARYNCMRQRW-ZFWWWQNUSA-N 0 3 279.380 2.581 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOC[C@@H]1CCOC ZINC000368270297 380977488 /nfs/dbraw/zinc/97/74/88/380977488.db2.gz VESOARYNCMRQRW-ZFWWWQNUSA-N 0 3 279.380 2.581 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCCCC[C@H]2O)c([O-])c1 ZINC000288533620 381015931 /nfs/dbraw/zinc/01/59/31/381015931.db2.gz VWWBYPDIAFQXQP-HZPDHXFCSA-N 0 3 293.407 2.964 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2COc3ccc(F)cc3C2)c1[O-] ZINC000289250682 381027922 /nfs/dbraw/zinc/02/79/22/381027922.db2.gz AYPMFUUHMPQSFE-OAHLLOKOSA-N 0 3 287.334 2.933 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1cc(OC)ccc1[O-] ZINC000182409298 381083641 /nfs/dbraw/zinc/08/36/41/381083641.db2.gz IUURCMOTOVQDMM-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN C[C@@H](CC(C)(C)O)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000295854088 381118306 /nfs/dbraw/zinc/11/83/06/381118306.db2.gz BDIYZBFGIGULMZ-UWVGGRQHSA-N 0 3 255.333 2.731 20 10 CFCDHN C[C@H]1CCCCN1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295920646 381159400 /nfs/dbraw/zinc/15/94/00/381159400.db2.gz JSQWAVRBCVQCNL-DZGCQCFKSA-N 0 3 274.408 2.844 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCOCC3(CCC3)C2)c1 ZINC000368974419 381171304 /nfs/dbraw/zinc/17/13/04/381171304.db2.gz PAQYZVXNPJCBNV-ZDUSSCGKSA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCOCC3(CCC3)C2)c1 ZINC000368974419 381171312 /nfs/dbraw/zinc/17/13/12/381171312.db2.gz PAQYZVXNPJCBNV-ZDUSSCGKSA-N 0 3 291.391 2.964 20 10 CFCDHN CCCN1CC[C@@H](C[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000295976978 381194774 /nfs/dbraw/zinc/19/47/74/381194774.db2.gz MZCTZPYKPVXYLY-DZGCQCFKSA-N 0 3 274.408 2.701 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](CCO)C1CCCCC1 ZINC000183246413 381244289 /nfs/dbraw/zinc/24/42/89/381244289.db2.gz PKBVIKIQGUKAIP-UHFFFAOYSA-N 0 3 267.344 2.658 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](CCO)C1CCCCC1 ZINC000183246413 381244299 /nfs/dbraw/zinc/24/42/99/381244299.db2.gz PKBVIKIQGUKAIP-UHFFFAOYSA-N 0 3 267.344 2.658 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)N1CCCCCC1)c1ccccc1[O-] ZINC000183473635 381275529 /nfs/dbraw/zinc/27/55/29/381275529.db2.gz YVLZQEVZTJMMTH-AWEZNQCLSA-N 0 3 290.407 2.836 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccccc1[O-] ZINC000183518328 381281652 /nfs/dbraw/zinc/28/16/52/381281652.db2.gz AXUYWNWIHXRKTA-VXGBXAGGSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCc3cccc([O-])c32)cc1O ZINC000296233213 381311690 /nfs/dbraw/zinc/31/16/90/381311690.db2.gz ALNKRIJEFZAJFE-ZDUSSCGKSA-N 0 3 285.343 2.884 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCCCN1C1CC1)CC2 ZINC000296249876 381320477 /nfs/dbraw/zinc/32/04/77/381320477.db2.gz BFKAAKJLKVGQPL-HZPDHXFCSA-N 0 3 286.419 2.986 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC[C@@H](CO)C1)c1ccc(C)cc1[O-] ZINC000296315037 381344913 /nfs/dbraw/zinc/34/49/13/381344913.db2.gz GONFFEPDELJSGC-VNHYZAJKSA-N 0 3 263.381 2.902 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCOC[C@@H](C)C2)c([O-])c1 ZINC000370052517 381373630 /nfs/dbraw/zinc/37/36/30/381373630.db2.gz HSBILGILWHPPBE-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCOC[C@@H](C)C2)c([O-])c1 ZINC000370052517 381373639 /nfs/dbraw/zinc/37/36/39/381373639.db2.gz HSBILGILWHPPBE-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000296393580 381375980 /nfs/dbraw/zinc/37/59/80/381375980.db2.gz JZDOWZXJSVEMFT-SJORKVTESA-N 0 3 297.398 2.881 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296503877 381425394 /nfs/dbraw/zinc/42/53/94/381425394.db2.gz QFTGIVJSGCSOBF-TZMCWYRMSA-N 0 3 262.397 2.699 20 10 CFCDHN COC[C@@H](C)[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184682364 381460592 /nfs/dbraw/zinc/46/05/92/381460592.db2.gz ILZZALFALLNGKX-SECBINFHSA-N 0 3 273.760 2.521 20 10 CFCDHN COC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184682364 381460598 /nfs/dbraw/zinc/46/05/98/381460598.db2.gz ILZZALFALLNGKX-SECBINFHSA-N 0 3 273.760 2.521 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184701166 381463552 /nfs/dbraw/zinc/46/35/52/381463552.db2.gz IIPFDVBUMYCOBN-LLVKDONJSA-N 0 3 299.798 2.913 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184701166 381463556 /nfs/dbraw/zinc/46/35/56/381463556.db2.gz IIPFDVBUMYCOBN-LLVKDONJSA-N 0 3 299.798 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCOC2)c1[O-] ZINC000184706289 381464668 /nfs/dbraw/zinc/46/46/68/381464668.db2.gz RMVNQOOTJCVFCG-JTQLQIEISA-N 0 3 285.771 2.570 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000185030100 381516713 /nfs/dbraw/zinc/51/67/13/381516713.db2.gz BQCJPDLIRBTWIN-CQSZACIVSA-N 0 3 292.423 3.000 20 10 CFCDHN C[C@@H]([NH2+]CCn1ccnc1)c1cc2c(cc1[O-])CCCC2 ZINC000184868694 381491537 /nfs/dbraw/zinc/49/15/37/381491537.db2.gz HGUUQVHFTRILKJ-CYBMUJFWSA-N 0 3 285.391 2.818 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCN(c3ccccn3)C1)CC2 ZINC000297144870 381553003 /nfs/dbraw/zinc/55/30/03/381553003.db2.gz ZRLPZHHHYPYUFT-LSDHHAIUSA-N 0 3 295.386 2.643 20 10 CFCDHN CCCN1CC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000185112776 381539310 /nfs/dbraw/zinc/53/93/10/381539310.db2.gz KBEXTNOYDXOSFR-STQMWFEESA-N 0 3 280.387 2.914 20 10 CFCDHN CCC[N@H+](CCc1cncn1C)Cc1ccccc1[O-] ZINC000297979101 381575108 /nfs/dbraw/zinc/57/51/08/381575108.db2.gz XYROYHIMIQONDE-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN CCC[N@@H+](CCc1cncn1C)Cc1ccccc1[O-] ZINC000297979101 381575114 /nfs/dbraw/zinc/57/51/14/381575114.db2.gz XYROYHIMIQONDE-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN COC1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCC1 ZINC000297300602 381557826 /nfs/dbraw/zinc/55/78/26/381557826.db2.gz MJBAZJOPZRUDJV-ZDUSSCGKSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCNC(=O)c2ccccc2)c([O-])c1 ZINC000185203386 381563315 /nfs/dbraw/zinc/56/33/15/381563315.db2.gz UASGCFLHLMADBM-AWEZNQCLSA-N 0 3 298.386 2.781 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185424571 381627982 /nfs/dbraw/zinc/62/79/82/381627982.db2.gz KSVNCHFEKGEDLZ-ZBEGNZNMSA-N 0 3 281.396 2.849 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c1 ZINC000185475011 381644649 /nfs/dbraw/zinc/64/46/49/381644649.db2.gz JZKICPYQGQAUOA-PRWKNARSSA-N 0 3 299.436 2.599 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000185535097 381660154 /nfs/dbraw/zinc/66/01/54/381660154.db2.gz UWJTVBDWXBNCNB-QFEPDWEUSA-N 0 3 279.355 2.995 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCO[C@H]2CCOC2)c1 ZINC000185702267 381709824 /nfs/dbraw/zinc/70/98/24/381709824.db2.gz AWJXEIGQPGRVKN-KBPBESRZSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c([O-])c1 ZINC000185672492 381699615 /nfs/dbraw/zinc/69/96/15/381699615.db2.gz CYJZYHSHYBENRF-MJBXVCDLSA-N 0 3 274.408 2.976 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185671993 381699962 /nfs/dbraw/zinc/69/99/62/381699962.db2.gz JULNFZHBOKVGFW-BFHYXJOUSA-N 0 3 274.408 2.976 20 10 CFCDHN Oc1ccc2ccccc2c1CN1CC(n2cccn2)C1 ZINC000359972943 381704501 /nfs/dbraw/zinc/70/45/01/381704501.db2.gz HNYUHILGWHRPMD-UHFFFAOYSA-N 0 3 279.343 2.799 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@@H](CC)c2ccccc2[O-])C1 ZINC000186424556 381907468 /nfs/dbraw/zinc/90/74/68/381907468.db2.gz VKSCDHSRDCXONR-JSGCOSHPSA-N 0 3 292.379 2.664 20 10 CFCDHN CCOC(=O)N1CC[C@H]([NH2+][C@H](C)c2cc(C)ccc2[O-])C1 ZINC000186457588 381916876 /nfs/dbraw/zinc/91/68/76/381916876.db2.gz PVNNIFNFQZTWRD-OLZOCXBDSA-N 0 3 292.379 2.582 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000373229275 381956413 /nfs/dbraw/zinc/95/64/13/381956413.db2.gz PXFYPCLAIWRBRO-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000373229275 381956422 /nfs/dbraw/zinc/95/64/22/381956422.db2.gz PXFYPCLAIWRBRO-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN Cc1nc([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)no1 ZINC000373126591 381933232 /nfs/dbraw/zinc/93/32/32/381933232.db2.gz QUOVJJZFQACBQA-NSHDSACASA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1nc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)no1 ZINC000373126591 381933237 /nfs/dbraw/zinc/93/32/37/381933237.db2.gz QUOVJJZFQACBQA-NSHDSACASA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000375015901 382064920 /nfs/dbraw/zinc/06/49/20/382064920.db2.gz DBYNJKNGERBFJF-CABCVRRESA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000375015901 382064926 /nfs/dbraw/zinc/06/49/26/382064926.db2.gz DBYNJKNGERBFJF-CABCVRRESA-N 0 3 261.365 2.844 20 10 CFCDHN COc1cccc(CN2CCC[C@H](OCC3CC3)C2)c1O ZINC000373530260 382018596 /nfs/dbraw/zinc/01/85/96/382018596.db2.gz AFTCNLCREYEKES-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1[O-] ZINC000373530260 382018600 /nfs/dbraw/zinc/01/86/00/382018600.db2.gz AFTCNLCREYEKES-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1[O-] ZINC000373530260 382018605 /nfs/dbraw/zinc/01/86/05/382018605.db2.gz AFTCNLCREYEKES-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1[O-] ZINC000375805479 382103639 /nfs/dbraw/zinc/10/36/39/382103639.db2.gz MDRYQTKCEVSVIR-TZMCWYRMSA-N 0 3 289.354 2.853 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1[O-] ZINC000375805478 382104497 /nfs/dbraw/zinc/10/44/97/382104497.db2.gz MDRYQTKCEVSVIR-OCCSQVGLSA-N 0 3 289.354 2.853 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c1 ZINC000187292926 382147782 /nfs/dbraw/zinc/14/77/82/382147782.db2.gz JQKKOGWHQXCEDW-KLZCAUPSSA-N 0 3 261.365 2.919 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000293546062 382167810 /nfs/dbraw/zinc/16/78/10/382167810.db2.gz DKRKQCQSXHZRPE-AWEZNQCLSA-N 0 3 281.371 2.810 20 10 CFCDHN Cc1cc(Cl)cc(CN(C)[C@@H](C)C[S@](C)=O)c1O ZINC000187828728 382279591 /nfs/dbraw/zinc/27/95/91/382279591.db2.gz FSUFVVHBEMOGCX-YPMLDQLKSA-N 0 3 289.828 2.553 20 10 CFCDHN COc1ccc(F)c(CNCc2cccc(OC)c2O)c1 ZINC000293798772 382284770 /nfs/dbraw/zinc/28/47/70/382284770.db2.gz DDANAWSLTQWPDD-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000363843112 382248274 /nfs/dbraw/zinc/24/82/74/382248274.db2.gz FBRJNJFCQQCNJR-HNNXBMFYSA-N 0 3 261.365 2.641 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000293768002 382270432 /nfs/dbraw/zinc/27/04/32/382270432.db2.gz RVRAUQLEBMEVBV-ZIAGYGMSSA-N 0 3 292.423 2.904 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@H](O)C2)c1[O-] ZINC000187982598 382314999 /nfs/dbraw/zinc/31/49/99/382314999.db2.gz RLNDOCHHNXJNRL-MFKMUULPSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1 ZINC000293937680 382343806 /nfs/dbraw/zinc/34/38/06/382343806.db2.gz YIZAQBKFSCGLHH-ZDUSSCGKSA-N 0 3 264.413 3.000 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000188267236 382379829 /nfs/dbraw/zinc/37/98/29/382379829.db2.gz HXAQNXUKSBERJK-KRWDZBQOSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC1([NH2+]Cc2cc3c(cc2[O-])OCO3)CCCC1 ZINC000294177730 382447325 /nfs/dbraw/zinc/44/73/25/382447325.db2.gz DDKCQRWZDXSMIW-UHFFFAOYSA-N 0 3 263.337 2.933 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c1[O-] ZINC000378439871 382461309 /nfs/dbraw/zinc/46/13/09/382461309.db2.gz WJOLJISQVOFBPR-CQSZACIVSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1[O-] ZINC000378439871 382461316 /nfs/dbraw/zinc/46/13/16/382461316.db2.gz WJOLJISQVOFBPR-CQSZACIVSA-N 0 3 283.375 2.870 20 10 CFCDHN CCOc1cccc(C[NH2+]CCC(C)(F)F)c1[O-] ZINC000294247242 382475864 /nfs/dbraw/zinc/47/58/64/382475864.db2.gz PSEHRVYNBAJZEY-UHFFFAOYSA-N 0 3 259.296 2.926 20 10 CFCDHN COC(CN(C)Cc1ccc(N2CCCCC2)cc1)OC ZINC000188943601 382510031 /nfs/dbraw/zinc/51/00/31/382510031.db2.gz DPHRAQJQZKUSGI-UHFFFAOYSA-N 0 3 292.423 2.728 20 10 CFCDHN Cc1cccnc1CCC[NH2+]Cc1ccccc1[O-] ZINC000295104317 382576979 /nfs/dbraw/zinc/57/69/79/382576979.db2.gz VIODCYVHFRTGCT-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@H](C(=O)OC)C(C)(C)C1 ZINC000367316920 382564573 /nfs/dbraw/zinc/56/45/73/382564573.db2.gz FYVAPVCWOGAJTI-ZIAGYGMSSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@H](C(=O)OC)C(C)(C)C1 ZINC000367316920 382564579 /nfs/dbraw/zinc/56/45/79/382564579.db2.gz FYVAPVCWOGAJTI-ZIAGYGMSSA-N 0 3 291.391 2.974 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1 ZINC000295253359 382600388 /nfs/dbraw/zinc/60/03/88/382600388.db2.gz QNQQPVMYKCMPGN-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c1 ZINC000295253359 382600392 /nfs/dbraw/zinc/60/03/92/382600392.db2.gz QNQQPVMYKCMPGN-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000189968443 382647616 /nfs/dbraw/zinc/64/76/16/382647616.db2.gz YAACVJFCGWKEDH-CJNGLKHVSA-N 0 3 293.407 2.822 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@](CC)(CO)C2)c1 ZINC000190229032 382657931 /nfs/dbraw/zinc/65/79/31/382657931.db2.gz LFUDJQGXPZFTHB-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@](CC)(CO)C2)c1 ZINC000190229032 382657933 /nfs/dbraw/zinc/65/79/33/382657933.db2.gz LFUDJQGXPZFTHB-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1ccccc1[O-] ZINC000246862238 383114046 /nfs/dbraw/zinc/11/40/46/383114046.db2.gz DSVIBOAPIOQPGF-AEGPPILISA-N 0 3 263.381 2.984 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 ZINC000248529060 383253353 /nfs/dbraw/zinc/25/33/53/383253353.db2.gz WNDMTYPBJJYHHM-PBXWNFIWSA-N 0 3 291.391 2.865 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1O)c1cc(F)ccc1[O-] ZINC000248521307 383253955 /nfs/dbraw/zinc/25/39/55/383253955.db2.gz RKLAXSJHUQSVMA-UDTVLSCZSA-N 0 3 287.334 2.840 20 10 CFCDHN C[C@H]1CN2CCCC[C@H]2C[N@@H+]1Cc1cccc(F)c1[O-] ZINC000252780310 383434966 /nfs/dbraw/zinc/43/49/66/383434966.db2.gz SRYYGSGQIAFOEU-JSGCOSHPSA-N 0 3 278.371 2.590 20 10 CFCDHN C[C@H]1CN2CCCC[C@H]2C[N@H+]1Cc1cccc(F)c1[O-] ZINC000252780310 383434969 /nfs/dbraw/zinc/43/49/69/383434969.db2.gz SRYYGSGQIAFOEU-JSGCOSHPSA-N 0 3 278.371 2.590 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+]C12CCC2)c1ccccc1[O-] ZINC000530216952 383768506 /nfs/dbraw/zinc/76/85/06/383768506.db2.gz RACPKOSTWZJLSA-UKRRQHHQSA-N 0 3 260.381 2.718 20 10 CFCDHN Cc1ccc([C@H](C)N[C@@H]2CC[NH2+]C23CCC3)c([O-])c1 ZINC000530217052 383768536 /nfs/dbraw/zinc/76/85/36/383768536.db2.gz SBESJRYVFALFCG-SWLSCSKDSA-N 0 3 260.381 2.636 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCc3cn[nH]c32)cc1F ZINC000268883948 384684489 /nfs/dbraw/zinc/68/44/89/384684489.db2.gz YPWUBPYIMABVRI-CQSZACIVSA-N 0 3 288.370 2.782 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)c2cn[nH]c2)c([O-])c1 ZINC000270261605 385035645 /nfs/dbraw/zinc/03/56/45/385035645.db2.gz WEMFNMIGLRECBI-NSHDSACASA-N 0 3 275.352 2.755 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)=O)C1)c1ccccc1[O-] ZINC000281260548 385186424 /nfs/dbraw/zinc/18/64/24/385186424.db2.gz WMHFUWCENNCZRK-GDBMZVCRSA-N 0 3 290.407 2.691 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)CC1CCC1)c1ccccc1[O-] ZINC000281312046 385189238 /nfs/dbraw/zinc/18/92/38/385189238.db2.gz ZEVFFEDBXVEAJH-HIFRSBDPSA-N 0 3 263.381 2.984 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])[C@@H](C)C1 ZINC000282180285 385238431 /nfs/dbraw/zinc/23/84/31/385238431.db2.gz FQEUMVUMHXUIRW-GXFFZTMASA-N 0 3 253.317 2.531 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])[C@@H](C)C1 ZINC000282180285 385238436 /nfs/dbraw/zinc/23/84/36/385238436.db2.gz FQEUMVUMHXUIRW-GXFFZTMASA-N 0 3 253.317 2.531 20 10 CFCDHN COCC1(C[NH2+]Cc2cc(C)c(C)cc2[O-])CCC1 ZINC000282009286 385206123 /nfs/dbraw/zinc/20/61/23/385206123.db2.gz MPSZNANLQRGCRA-UHFFFAOYSA-N 0 3 263.381 2.915 20 10 CFCDHN CCCCN(Cc1ccnn1C)Cc1ccccc1O ZINC000282328474 385284506 /nfs/dbraw/zinc/28/45/06/385284506.db2.gz ASGMIIWTGDKFBJ-UHFFFAOYSA-N 0 3 273.380 2.928 20 10 CFCDHN CCCC[N@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000282375092 385296679 /nfs/dbraw/zinc/29/66/79/385296679.db2.gz FLEWQAQETVGYOQ-UHFFFAOYSA-N 0 3 273.380 2.928 20 10 CFCDHN CCCC[N@@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000282375092 385296682 /nfs/dbraw/zinc/29/66/82/385296682.db2.gz FLEWQAQETVGYOQ-UHFFFAOYSA-N 0 3 273.380 2.928 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](C(=O)OC)C2)cc1 ZINC000271099475 385335817 /nfs/dbraw/zinc/33/58/17/385335817.db2.gz OQRZUAWXQFXZIJ-HNNXBMFYSA-N 0 3 290.407 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c1 ZINC000271184136 385366206 /nfs/dbraw/zinc/36/62/06/385366206.db2.gz MDLLLOUGMBYASM-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c1 ZINC000271184136 385366210 /nfs/dbraw/zinc/36/62/10/385366210.db2.gz MDLLLOUGMBYASM-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H]2CCO[C@H](C)C2)c1 ZINC000271569574 385385146 /nfs/dbraw/zinc/38/51/46/385385146.db2.gz WXOFIGOLAFRWNZ-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN CC(C)[C@@H](O)C1(CNCc2ccc(N(C)C)c(F)c2)CC1 ZINC000271955046 385410471 /nfs/dbraw/zinc/41/04/71/385410471.db2.gz DYXRUHRBZVIDHH-MRXNPFEDSA-N 0 3 294.414 2.778 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC(=O)NC23CCC3)c1 ZINC000283346705 385457886 /nfs/dbraw/zinc/45/78/86/385457886.db2.gz MCHKZEFLAYQPIF-SWLSCSKDSA-N 0 3 288.391 2.553 20 10 CFCDHN Cc1cc(C)cc([C@@H](O)C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000283059356 385430183 /nfs/dbraw/zinc/43/01/83/385430183.db2.gz PNIOAEBXGVYJAC-KRWDZBQOSA-N 0 3 289.350 2.971 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000272241947 385484676 /nfs/dbraw/zinc/48/46/76/385484676.db2.gz GTNLRPVSDDDHIE-UHFFFAOYSA-N 0 3 295.354 2.697 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1CCN(C2CCC2)CC1 ZINC000272469382 385544955 /nfs/dbraw/zinc/54/49/55/385544955.db2.gz RPOKDFGUQKNOJA-UHFFFAOYSA-N 0 3 278.371 2.638 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)N(C)C)c([O-])c1 ZINC000283967229 385519287 /nfs/dbraw/zinc/51/92/87/385519287.db2.gz GJACGNXKHXSGPZ-OLZOCXBDSA-N 0 3 250.386 2.610 20 10 CFCDHN COCC1([NH2+]Cc2cc(Cl)cc(OC)c2[O-])CCC1 ZINC000284859145 385549741 /nfs/dbraw/zinc/54/97/41/385549741.db2.gz DAGIFAFJWKERHQ-UHFFFAOYSA-N 0 3 285.771 2.713 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285336366 385553736 /nfs/dbraw/zinc/55/37/36/385553736.db2.gz UOAAORYMAOBZMG-ZIAGYGMSSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2([S@](C)=O)CC2)c([O-])c1 ZINC000285298389 385554679 /nfs/dbraw/zinc/55/46/79/385554679.db2.gz RXSAPPWXEMBWIE-BUXKBTBVSA-N 0 3 281.421 2.571 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c([O-])c1 ZINC000285414313 385555555 /nfs/dbraw/zinc/55/55/55/385555555.db2.gz XXAKQANZCZCTDM-GXFFZTMASA-N 0 3 291.313 2.973 20 10 CFCDHN CCC[C@@]1([NH2+]Cc2cccc(OCC)c2[O-])CCOC1 ZINC000285462177 385555733 /nfs/dbraw/zinc/55/57/33/385555733.db2.gz JUMSTMXCIQLXCF-MRXNPFEDSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c1 ZINC000272593359 385572256 /nfs/dbraw/zinc/57/22/56/385572256.db2.gz ICFHSEATBLFFAZ-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c1 ZINC000272593359 385572259 /nfs/dbraw/zinc/57/22/59/385572259.db2.gz ICFHSEATBLFFAZ-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)cc1C ZINC000272704529 385592389 /nfs/dbraw/zinc/59/23/89/385592389.db2.gz ZKMWRXHTTUIKSV-ZBFHGGJFSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)cc1C ZINC000272704529 385592391 /nfs/dbraw/zinc/59/23/91/385592391.db2.gz ZKMWRXHTTUIKSV-ZBFHGGJFSA-N 0 3 277.408 2.992 20 10 CFCDHN CN(C)c1ccc(CN2CCC(CCCO)CC2)cc1F ZINC000272811164 385621406 /nfs/dbraw/zinc/62/14/06/385621406.db2.gz AMZCONQLLZFNKK-UHFFFAOYSA-N 0 3 294.414 2.876 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@@H](C(=O)N(C)C)C1)c1ccccc1[O-] ZINC000272843564 385631346 /nfs/dbraw/zinc/63/13/46/385631346.db2.gz JWHBCDWVSRHFOK-BFHYXJOUSA-N 0 3 290.407 2.690 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000273161144 385672091 /nfs/dbraw/zinc/67/20/91/385672091.db2.gz UGLGDCAQDNDSRS-IAGOWNOFSA-N 0 3 291.391 2.838 20 10 CFCDHN COC[C@@H](C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2)OC ZINC000273381568 385680951 /nfs/dbraw/zinc/68/09/51/385680951.db2.gz CEFHRTGHWADCRG-IUODEOHRSA-N 0 3 293.407 2.583 20 10 CFCDHN COCCN(C)CCC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273396218 385681436 /nfs/dbraw/zinc/68/14/36/385681436.db2.gz LWLSENGLOHFCCM-HNNXBMFYSA-N 0 3 294.439 2.628 20 10 CFCDHN C[C@H]([NH2+]CCc1cnn(C)c1)c1cc2c(cc1[O-])CCCC2 ZINC000273425031 385682309 /nfs/dbraw/zinc/68/23/09/385682309.db2.gz TXLMQEPCQYHSHQ-ZDUSSCGKSA-N 0 3 299.418 2.898 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000273440186 385682931 /nfs/dbraw/zinc/68/29/31/385682931.db2.gz YGKJZEAXYJCSLD-CHWSQXEVSA-N 0 3 280.412 2.782 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273513135 385685631 /nfs/dbraw/zinc/68/56/31/385685631.db2.gz SDMYCKUDGIHIQY-ZDUSSCGKSA-N 0 3 292.423 2.822 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273584311 385689591 /nfs/dbraw/zinc/68/95/91/385689591.db2.gz NISFJJDQZAGSQY-WFASDCNBSA-N 0 3 251.370 2.821 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(CCO)CCCC2)c1 ZINC000273591895 385689692 /nfs/dbraw/zinc/68/96/92/385689692.db2.gz PKQQQWYDRKQPKQ-CYBMUJFWSA-N 0 3 293.407 2.994 20 10 CFCDHN O[C@@H](CCc1ccccc1)CNCc1ccc2c(c1)CCO2 ZINC000273064869 385669782 /nfs/dbraw/zinc/66/97/82/385669782.db2.gz FXPMFSIXBIACHW-SFHVURJKSA-N 0 3 297.398 2.705 20 10 CFCDHN COc1ccc(CN[C@@H]2COc3ccccc3[C@H]2O)cc1C ZINC000288504574 197097167 /nfs/dbraw/zinc/09/71/67/197097167.db2.gz IGIDNTWRHYYLPT-CRAIPNDOSA-N 0 3 299.370 2.588 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1c3ccccc3C[C@H]1O)CC2 ZINC000296225356 285397642 /nfs/dbraw/zinc/39/76/42/285397642.db2.gz AHEAWXPBPQQZEN-QGPMSJSTSA-N 0 3 281.355 2.627 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCSC(C)(C)C2)c1 ZINC000180315838 393478730 /nfs/dbraw/zinc/47/87/30/393478730.db2.gz KEAIFGCOPXZUPS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCSC(C)(C)C2)c1 ZINC000180315838 393478734 /nfs/dbraw/zinc/47/87/34/393478734.db2.gz KEAIFGCOPXZUPS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc(O)c(CN2CCSC(C)(C)C2)c1 ZINC000180315838 393478738 /nfs/dbraw/zinc/47/87/38/393478738.db2.gz KEAIFGCOPXZUPS-UHFFFAOYSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCOC(C)(C)C1)c1ccccc1[O-] ZINC000186176273 393540434 /nfs/dbraw/zinc/54/04/34/393540434.db2.gz JYIRPVLDADCCAA-OAHLLOKOSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000374255805 393490749 /nfs/dbraw/zinc/49/07/49/393490749.db2.gz SPINTTGEUUOGSR-KBPBESRZSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000374255805 393490757 /nfs/dbraw/zinc/49/07/57/393490757.db2.gz SPINTTGEUUOGSR-KBPBESRZSA-N 0 3 277.364 2.544 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000312704256 393522192 /nfs/dbraw/zinc/52/21/92/393522192.db2.gz OIFPIWUPZYYZIK-DOTOQJQBSA-N 0 3 274.408 2.871 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000312704256 393522196 /nfs/dbraw/zinc/52/21/96/393522196.db2.gz OIFPIWUPZYYZIK-DOTOQJQBSA-N 0 3 274.408 2.871 20 10 CFCDHN CCC1(C[NH2+]Cc2cc(C)ccc2[O-])CCOCC1 ZINC000266653797 393983016 /nfs/dbraw/zinc/98/30/16/393983016.db2.gz ZIBYZSBQCYRYMC-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562595 394030599 /nfs/dbraw/zinc/03/05/99/394030599.db2.gz FAGRMVDNPDHUOR-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562595 394030603 /nfs/dbraw/zinc/03/06/03/394030603.db2.gz FAGRMVDNPDHUOR-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562595 394030606 /nfs/dbraw/zinc/03/06/06/394030606.db2.gz FAGRMVDNPDHUOR-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562595 394030609 /nfs/dbraw/zinc/03/06/09/394030609.db2.gz FAGRMVDNPDHUOR-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1cccc(OC)c1[O-] ZINC000290447338 394229190 /nfs/dbraw/zinc/22/91/90/394229190.db2.gz MDYMVQPDSXXLGI-UHFFFAOYSA-N 0 3 280.412 2.565 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1cccc(OC)c1[O-] ZINC000290447338 394229191 /nfs/dbraw/zinc/22/91/91/394229191.db2.gz MDYMVQPDSXXLGI-UHFFFAOYSA-N 0 3 280.412 2.565 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1ccccc1[O-] ZINC000020122210 171002964 /nfs/dbraw/zinc/00/29/64/171002964.db2.gz JTMWZKOOIZQYFU-OCCSQVGLSA-N 0 3 274.364 2.939 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccncc2)c1 ZINC000020140031 171026847 /nfs/dbraw/zinc/02/68/47/171026847.db2.gz OPPJIAABVXYJPT-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN CC(C)N1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000020189094 171054941 /nfs/dbraw/zinc/05/49/41/171054941.db2.gz YTSUDXJWCMKEOW-CYBMUJFWSA-N 0 3 262.397 2.916 20 10 CFCDHN CC(C)[C@@H](C[NH2+]Cc1ccccc1[O-])N1CCCC1 ZINC000020200662 171064869 /nfs/dbraw/zinc/06/48/69/171064869.db2.gz UTYNFWODUOXTID-OAHLLOKOSA-N 0 3 262.397 2.602 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](C)c2cnn(C)c2C)c1 ZINC000037167671 260072882 /nfs/dbraw/zinc/07/28/82/260072882.db2.gz PPWOROGTYFTYLO-GHMZBOCLSA-N 0 3 289.379 2.855 20 10 CFCDHN CN(C)[C@H](CNCc1ccc2c(c1)CCO2)c1ccco1 ZINC000037362747 260095048 /nfs/dbraw/zinc/09/50/48/260095048.db2.gz AJRBCHROJNGFQP-OAHLLOKOSA-N 0 3 286.375 2.607 20 10 CFCDHN CCN(CC)CC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000035628638 260152188 /nfs/dbraw/zinc/15/21/88/260152188.db2.gz KYOUDLGWWHSTQI-CYBMUJFWSA-N 0 3 250.386 2.693 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc2n1CCCC2)c1cc(F)ccc1[O-] ZINC000367438656 262116392 /nfs/dbraw/zinc/11/63/92/262116392.db2.gz ONEULIFFMLYKDD-LLVKDONJSA-N 0 3 289.354 2.915 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000367438177 267090351 /nfs/dbraw/zinc/09/03/51/267090351.db2.gz LEFWELAIWPFHCO-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000367438177 267090352 /nfs/dbraw/zinc/09/03/52/267090352.db2.gz LEFWELAIWPFHCO-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@]3(CCOC3)C2)c([O-])c1 ZINC000369902198 267275606 /nfs/dbraw/zinc/27/56/06/267275606.db2.gz LCRIKMDAFQPLDJ-ZQIUZPCESA-N 0 3 291.391 2.689 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H]2CCN(C)[C@@H]2C1 ZINC000369930741 267276960 /nfs/dbraw/zinc/27/69/60/267276960.db2.gz OOYBWGVBOWVQER-NUEKZKHPSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H]2CCN(C)[C@@H]2C1 ZINC000369930741 267276961 /nfs/dbraw/zinc/27/69/61/267276961.db2.gz OOYBWGVBOWVQER-NUEKZKHPSA-N 0 3 274.408 2.869 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2CCc3ccccc3OC2)c1 ZINC000376081375 267936688 /nfs/dbraw/zinc/93/66/88/267936688.db2.gz JVVSBHZBSUUAQC-OAHLLOKOSA-N 0 3 299.370 2.884 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000035628702 276379575 /nfs/dbraw/zinc/37/95/75/276379575.db2.gz IJMACXIEDMCDRM-KBPBESRZSA-N 0 3 262.397 2.836 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H](CO)CC(C)C)c1[O-] ZINC000290486731 276379677 /nfs/dbraw/zinc/37/96/77/276379677.db2.gz OIBMHDZBJAEVPV-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H](CO)CC(C)C)c1[O-] ZINC000290486731 276379679 /nfs/dbraw/zinc/37/96/79/276379679.db2.gz OIBMHDZBJAEVPV-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1cccc(CN2CCSC[C@H]2C)c1O ZINC000179663307 276379927 /nfs/dbraw/zinc/37/99/27/276379927.db2.gz MFQMKAVOBLSVAO-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccccc3[C@H]2O)c([O-])c1 ZINC000290399817 280980392 /nfs/dbraw/zinc/98/03/92/280980392.db2.gz SUZGEZDCEDVIML-WBHUJUFNSA-N 0 3 299.370 2.846 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@H]3COC[C@H]32)c1 ZINC000368044788 327221085 /nfs/dbraw/zinc/22/10/85/327221085.db2.gz UFOMDALLPADNNN-SLEUVZQESA-N 0 3 277.364 2.573 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@H]3COC[C@H]32)c1 ZINC000368044788 327221086 /nfs/dbraw/zinc/22/10/86/327221086.db2.gz UFOMDALLPADNNN-SLEUVZQESA-N 0 3 277.364 2.573 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]CC1COC1 ZINC000527816352 330285190 /nfs/dbraw/zinc/28/51/90/330285190.db2.gz BEDHELSSJHGEJC-UHFFFAOYSA-N 0 3 269.344 2.795 20 10 CFCDHN O=C1Nc2ccccc2C[C@@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000527999112 330299725 /nfs/dbraw/zinc/29/97/25/330299725.db2.gz ONMFLIUJWGSUTM-CABCVRRESA-N 0 3 294.354 2.533 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2Cc3ccccc3NC2=O)c([O-])c1 ZINC000528000719 330299904 /nfs/dbraw/zinc/29/99/04/330299904.db2.gz NWWJUSDMWIELJA-MLGOLLRUSA-N 0 3 296.370 2.915 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1ccccc1[O-] ZINC000528001951 330300211 /nfs/dbraw/zinc/30/02/11/330300211.db2.gz QIERBHSXNHEJDQ-GDBMZVCRSA-N 0 3 296.370 2.996 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000528008954 330303753 /nfs/dbraw/zinc/30/37/53/330303753.db2.gz ULHZMZNGUZFTPN-XPLGWORNSA-N 0 3 261.365 2.781 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000272835549 519822588 /nfs/dbraw/zinc/82/25/88/519822588.db2.gz IQVIBLXSBYHMJD-DOMZBBRYSA-N 0 3 263.381 2.840 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000290247236 521320082 /nfs/dbraw/zinc/32/00/82/521320082.db2.gz VILHRQVVVYBKQU-HNNXBMFYSA-N 0 3 267.344 2.516 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000290247236 521320089 /nfs/dbraw/zinc/32/00/89/521320089.db2.gz VILHRQVVVYBKQU-HNNXBMFYSA-N 0 3 267.344 2.516 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2c([O-])cccc2Cl)CC1 ZINC000277485177 522097939 /nfs/dbraw/zinc/09/79/39/522097939.db2.gz MYYRFQDXPHRPGO-LBPRGKRZSA-N 0 3 282.815 2.962 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](CO)CC2CCC2)c1[O-] ZINC000279677833 522541378 /nfs/dbraw/zinc/54/13/78/522541378.db2.gz IRNHMZMLIGGZJY-ZDUSSCGKSA-N 0 3 299.798 2.695 20 10 CFCDHN CC[C@H]([NH2+]CC1(C)OCCO1)c1ccc(C)cc1[O-] ZINC000280175846 522570469 /nfs/dbraw/zinc/57/04/69/522570469.db2.gz RKKKDXPFQHJGMQ-ZDUSSCGKSA-N 0 3 265.353 2.504 20 10 CFCDHN CC(C)C(=O)N1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000037142669 519458475 /nfs/dbraw/zinc/45/84/75/519458475.db2.gz UVTPKMADHNVKKM-ZDUSSCGKSA-N 0 3 290.407 2.690 20 10 CFCDHN CCC1(O)CC[NH+](Cc2cc(C)c(C)cc2[O-])CC1 ZINC000266111170 519846758 /nfs/dbraw/zinc/84/67/58/519846758.db2.gz SUXLHRLOIXCUQZ-UHFFFAOYSA-N 0 3 263.381 2.746 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC23CCOCC3)c([O-])c1 ZINC000365818915 520349326 /nfs/dbraw/zinc/34/93/26/520349326.db2.gz UDMYXONKSNMCRG-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC23CCOCC3)c([O-])c1 ZINC000365818915 520349333 /nfs/dbraw/zinc/34/93/33/520349333.db2.gz UDMYXONKSNMCRG-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCOC[C@@H]2C)c([O-])c1 ZINC000278041601 520372569 /nfs/dbraw/zinc/37/25/69/520372569.db2.gz XMMCSTRYJFVPIB-SWLSCSKDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](C)[C@H](CO)C2)cc1F ZINC000191725935 520895471 /nfs/dbraw/zinc/89/54/71/520895471.db2.gz KKSOMTQUTAUJHX-HIFRSBDPSA-N 0 3 294.414 2.732 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cncn2C)cc1 ZINC000171129561 520907887 /nfs/dbraw/zinc/90/78/87/520907887.db2.gz RDKLVBUCTIGHIR-UHFFFAOYSA-N 0 3 272.396 2.556 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H]2CCN(C)C[C@H]2C)c1 ZINC000290529130 521144063 /nfs/dbraw/zinc/14/40/63/521144063.db2.gz QNZYPDFDCORNDF-CJNGLKHVSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H]2CCN(C)C[C@H]2C)c1 ZINC000290529130 521144067 /nfs/dbraw/zinc/14/40/67/521144067.db2.gz QNZYPDFDCORNDF-CJNGLKHVSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC(C)(C)COC)c1 ZINC000291728555 521150192 /nfs/dbraw/zinc/15/01/92/521150192.db2.gz NLDBGWHZDDXGRM-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN CCC(C)(C)C[NH2+]Cc1cc(OC)c(OC)cc1[O-] ZINC000192026271 521288738 /nfs/dbraw/zinc/28/87/38/521288738.db2.gz MPXPZNGHAFEXOG-UHFFFAOYSA-N 0 3 267.369 2.935 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@H]2CCCOC2)c1[O-] ZINC000156031498 521332029 /nfs/dbraw/zinc/33/20/29/521332029.db2.gz NBSBRCUNORYBHE-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@H]2CCCOC2)c1[O-] ZINC000156031498 521332040 /nfs/dbraw/zinc/33/20/40/521332040.db2.gz NBSBRCUNORYBHE-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC000279655588 521340691 /nfs/dbraw/zinc/34/06/91/521340691.db2.gz LDORBFFWOAVXEA-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC000279655588 521340698 /nfs/dbraw/zinc/34/06/98/521340698.db2.gz LDORBFFWOAVXEA-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC000245792677 521344424 /nfs/dbraw/zinc/34/44/24/521344424.db2.gz WKEGWJYAZWUUEF-ZFWWWQNUSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC000245792677 521344436 /nfs/dbraw/zinc/34/44/36/521344436.db2.gz WKEGWJYAZWUUEF-ZFWWWQNUSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[NH2+]CCOCCC(C)C)c1[O-] ZINC000045093894 521365019 /nfs/dbraw/zinc/36/50/19/521365019.db2.gz PYSDPRSCUJWONR-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2CCOC(C)(C)C2)c1[O-] ZINC000160466611 521371455 /nfs/dbraw/zinc/37/14/55/521371455.db2.gz TYGMVNDOCDEYJO-CYBMUJFWSA-N 0 3 279.380 2.838 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2[O-])C1 ZINC000246201903 521717649 /nfs/dbraw/zinc/71/76/49/521717649.db2.gz LVRBEJTXZDZJKO-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2c([O-])cccc2Cl)C1 ZINC000156071057 522039882 /nfs/dbraw/zinc/03/98/82/522039882.db2.gz KNIJTCJUYQFENM-LLVKDONJSA-N 0 3 268.788 2.572 20 10 CFCDHN CC[C@H](C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000290789273 522193702 /nfs/dbraw/zinc/19/37/02/522193702.db2.gz DMHIDPYLZHJTLF-LLVKDONJSA-N 0 3 273.760 2.569 20 10 CFCDHN CC[C@@H](C)[C@@H](O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000155807757 522325807 /nfs/dbraw/zinc/32/58/07/522325807.db2.gz UEYUQJAPAOWACI-ZLDLUXBVSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2ccccn2)c1[O-] ZINC000228668953 522541673 /nfs/dbraw/zinc/54/16/73/522541673.db2.gz ZTRRXNXVRCZXLP-UHFFFAOYSA-N 0 3 292.766 2.782 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H]2C2CC2)c1[O-] ZINC000230935414 522542983 /nfs/dbraw/zinc/54/29/83/522542983.db2.gz PNXLCKAFBHZUFW-WFASDCNBSA-N 0 3 297.782 2.711 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649233 522616583 /nfs/dbraw/zinc/61/65/83/522616583.db2.gz JRAAACJKTCWZNW-BBRMVZONSA-N 0 3 274.408 2.917 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CC[C@@H](O)C1)c1ccc(C)cc1[O-] ZINC000280208114 522636438 /nfs/dbraw/zinc/63/64/38/522636438.db2.gz TYWOGKVMLDAIFH-GUTXKFCHSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)n(C)c1=O)c1ccccc1[O-] ZINC000279412853 522644863 /nfs/dbraw/zinc/64/48/63/522644863.db2.gz DZFLXOSRXLACRX-HNNXBMFYSA-N 0 3 286.375 2.640 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000156297455 522692047 /nfs/dbraw/zinc/69/20/47/522692047.db2.gz YTCHIVNUXHGURS-GUTXKFCHSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C(C)C)C1=O)c1ccc(C)cc1[O-] ZINC000279942926 522717567 /nfs/dbraw/zinc/71/75/67/522717567.db2.gz BHYSFHJDTOLABD-LSDHHAIUSA-N 0 3 290.407 2.751 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CC[C@@H](C)[C@H]2C)cc1OC ZINC000160352924 522776693 /nfs/dbraw/zinc/77/66/93/522776693.db2.gz FBTYEMPKAMEFST-GHMZBOCLSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CC[C@@H](C)[C@H]2C)cc1OC ZINC000160352924 522776703 /nfs/dbraw/zinc/77/67/03/522776703.db2.gz FBTYEMPKAMEFST-GHMZBOCLSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CC2CC(F)(F)C2)cc1OC ZINC000292773484 522779855 /nfs/dbraw/zinc/77/98/55/522779855.db2.gz KSYKUMLZLBZABX-UHFFFAOYSA-N 0 3 287.306 2.544 20 10 CFCDHN CC[C@@H]([NH2+]CC[S@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000155872951 522843102 /nfs/dbraw/zinc/84/31/02/522843102.db2.gz IEYBTBZQRHPJAL-BFUOFWGJSA-N 0 3 283.437 2.980 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)c(C)cc1[O-])C(C)(C)O ZINC000293229056 522868810 /nfs/dbraw/zinc/86/88/10/522868810.db2.gz ZFDGVLQPUMVUJF-CQSZACIVSA-N 0 3 251.370 2.648 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCc2n[nH]cc2C1)c1ccccc1[O-] ZINC000156735892 522928707 /nfs/dbraw/zinc/92/87/07/522928707.db2.gz JHFOERZXUGXNIK-TZMCWYRMSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@@H](c1ccccc1O)N1CCO[C@@H](COC(C)C)C1 ZINC000372516581 523105378 /nfs/dbraw/zinc/10/53/78/523105378.db2.gz ROXQKCIOGKOTRF-ZBFHGGJFSA-N 0 3 293.407 2.969 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCCO1 ZINC000226563272 523179611 /nfs/dbraw/zinc/17/96/11/523179611.db2.gz XPVLYTGSJSSYKC-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@H]1CCCCO1 ZINC000226563272 523179618 /nfs/dbraw/zinc/17/96/18/523179618.db2.gz XPVLYTGSJSSYKC-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CO[C@H](C)C[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000191204619 523885049 /nfs/dbraw/zinc/88/50/49/523885049.db2.gz BRFRDNVYXYZRSH-SECBINFHSA-N 0 3 288.185 2.588 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273303149 523968527 /nfs/dbraw/zinc/96/85/27/523968527.db2.gz CDBIYWIYEVWKAF-GXTWGEPZSA-N 0 3 292.423 2.964 20 10 CFCDHN C[C@@H]1CCC[C@@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000044418166 524315667 /nfs/dbraw/zinc/31/56/67/524315667.db2.gz DZTPNOBOHRGNRR-ZYHUDNBSSA-N 0 3 263.337 2.789 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290577405 524393849 /nfs/dbraw/zinc/39/38/49/524393849.db2.gz UGDRVBBQYKLLOW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@]2(C)CCCO)c1[O-] ZINC000290577405 524393859 /nfs/dbraw/zinc/39/38/59/524393859.db2.gz UGDRVBBQYKLLOW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc(CN2CC[C@@H](n3cc(Cl)cn3)C2)c1O ZINC000290974070 524403220 /nfs/dbraw/zinc/40/32/20/524403220.db2.gz SRSJGOHTLCCRID-CQSZACIVSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1cccc(CN2C[C@H](C)O[C@@H](C3CC3)C2)c1O ZINC000280307622 524410253 /nfs/dbraw/zinc/41/02/53/524410253.db2.gz BSSWBSKTNMZTSV-SWLSCSKDSA-N 0 3 261.365 2.700 20 10 CFCDHN C[C@H](CO)CCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230669796 524524153 /nfs/dbraw/zinc/52/41/53/524524153.db2.gz OAGZPWSPBNKABN-QWRGUYRKSA-N 0 3 255.333 2.591 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H]2CSCCS2)c1 ZINC000168818838 524763154 /nfs/dbraw/zinc/76/31/54/524763154.db2.gz QSXLNBKRCJAJMY-ZYHUDNBSSA-N 0 3 299.461 2.900 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@](C)(OC)C2CC2)c1 ZINC000291370592 524764449 /nfs/dbraw/zinc/76/44/49/524764449.db2.gz YSJLZXSXDMGNNU-BDJLRTHQSA-N 0 3 279.380 2.867 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2cccnc2)c1 ZINC000037717790 524764825 /nfs/dbraw/zinc/76/48/25/524764825.db2.gz ABOXPLPRBZENGY-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](CO)c2ccccc2)c1 ZINC000062999300 524765689 /nfs/dbraw/zinc/76/56/89/524765689.db2.gz IMOUEOXLPKIPAJ-WBMJQRKESA-N 0 3 287.359 2.785 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCCCCC2)c1 ZINC000040767253 524769491 /nfs/dbraw/zinc/76/94/91/524769491.db2.gz HUQNYFMKDSVBSA-AWEZNQCLSA-N 0 3 292.423 2.927 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCCSC2)c1 ZINC000168815739 524775386 /nfs/dbraw/zinc/77/53/86/524775386.db2.gz MMFDPCFUXMQVPF-WDEREUQCSA-N 0 3 267.394 2.947 20 10 CFCDHN C[C@@H](CO)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263724783 524776141 /nfs/dbraw/zinc/77/61/41/524776141.db2.gz WVPSIUKCJMWFDX-CYBMUJFWSA-N 0 3 271.360 2.777 20 10 CFCDHN Cc1cc(CN[C@H](C)c2cnn(C)c2)ccc1N(C)C ZINC000271542980 524778005 /nfs/dbraw/zinc/77/80/05/524778005.db2.gz UQAWHTMMCGOZLU-CYBMUJFWSA-N 0 3 272.396 2.645 20 10 CFCDHN C[C@H]([NH2+]C1CCN(c2cccnn2)CC1)c1ccccc1[O-] ZINC000277163019 525295944 /nfs/dbraw/zinc/29/59/44/525295944.db2.gz RHBINYOWAOKMCF-ZDUSSCGKSA-N 0 3 298.390 2.502 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC(CCCO)CC2)cc1C ZINC000272906393 525316210 /nfs/dbraw/zinc/31/62/10/525316210.db2.gz GWLIXRMMWVIVCV-UHFFFAOYSA-N 0 3 277.408 2.994 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@H](O)Cc2ccccc2)cc1C ZINC000290160579 525322098 /nfs/dbraw/zinc/32/20/98/525322098.db2.gz PZPQHTRJLAMZJV-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1cc(O)c(CN[C@@H](CC(N)=O)c2ccccc2)cc1C ZINC000293045290 525322393 /nfs/dbraw/zinc/32/23/93/525322393.db2.gz RAQMLHYBVAVASR-INIZCTEOSA-N 0 3 298.386 2.715 20 10 CFCDHN Cc1ccc(O)c(CNCc2cccc3c2OCO3)c1 ZINC000071408273 525351606 /nfs/dbraw/zinc/35/16/06/525351606.db2.gz ZYPSBTVSHPPGIX-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCC[C@@H](C)CO)c1 ZINC000230669681 525360552 /nfs/dbraw/zinc/36/05/52/525360552.db2.gz UXZAJFGWFSURGK-CHWSQXEVSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CCCCC2)c1 ZINC000049574806 525361600 /nfs/dbraw/zinc/36/16/00/525361600.db2.gz XZGZYDFGXZDYHZ-AWEZNQCLSA-N 0 3 262.397 2.837 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](CCO)C(C)C)c1 ZINC000230664130 525363191 /nfs/dbraw/zinc/36/31/91/525363191.db2.gz DWMVYDPZGUSVEL-TZMCWYRMSA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(F)cc1[O-] ZINC000062747648 525393217 /nfs/dbraw/zinc/39/32/17/525393217.db2.gz NJONNSWYGJGYBT-RYUDHWBXSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1cc(F)ccc1[O-] ZINC000278891685 525398164 /nfs/dbraw/zinc/39/81/64/525398164.db2.gz DSTWOEPAUNGVIF-RYUDHWBXSA-N 0 3 289.354 2.641 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)CCCO)c1ccccc1[O-] ZINC000228796451 525414129 /nfs/dbraw/zinc/41/41/29/525414129.db2.gz QYTMCOXIHHMHOT-GFCCVEGCSA-N 0 3 251.370 2.842 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H](O)c1cccc(F)c1 ZINC000272239340 525433745 /nfs/dbraw/zinc/43/37/45/525433745.db2.gz AJZOTPNQNWZXLJ-QFYYESIMSA-N 0 3 293.313 2.882 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1cc(F)ccc1[O-] ZINC000278891677 525485132 /nfs/dbraw/zinc/48/51/32/525485132.db2.gz DSTWOEPAUNGVIF-NEPJUHHUSA-N 0 3 289.354 2.641 20 10 CFCDHN C[C@@H](NCc1ccn(C)c1)c1ccc(N2CCOCC2)cc1 ZINC000158436416 525543783 /nfs/dbraw/zinc/54/37/83/525543783.db2.gz KEERFPLBEICJIN-OAHLLOKOSA-N 0 3 299.418 2.713 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000094618182 525625972 /nfs/dbraw/zinc/62/59/72/525625972.db2.gz DFEPYPNVFOZGIB-IUODEOHRSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@@H](C)CO)c([O-])c1 ZINC000230669769 525725580 /nfs/dbraw/zinc/72/55/80/525725580.db2.gz MJYXNSFTGGOCRW-CHWSQXEVSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CO)C2CCCC2)c([O-])c1 ZINC000290203133 525745990 /nfs/dbraw/zinc/74/59/90/525745990.db2.gz PHOBFRDVEGMQIQ-IUODEOHRSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000278634170 525781149 /nfs/dbraw/zinc/78/11/49/525781149.db2.gz IJMWOLMIQULXKH-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN C[C@@H](O)C[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000291101805 525782439 /nfs/dbraw/zinc/78/24/39/525782439.db2.gz RIYJMJQNCFUAOJ-CYBMUJFWSA-N 0 3 271.360 2.872 20 10 CFCDHN C[C@@H](O)C[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000291101805 525782448 /nfs/dbraw/zinc/78/24/48/525782448.db2.gz RIYJMJQNCFUAOJ-CYBMUJFWSA-N 0 3 271.360 2.872 20 10 CFCDHN C[C@@]1(CCCO)CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000290622305 525826417 /nfs/dbraw/zinc/82/64/17/525826417.db2.gz XITMIBDBYBTYFH-HNNXBMFYSA-N 0 3 267.344 2.658 20 10 CFCDHN C[C@@]1(CCCO)CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000290622305 525826422 /nfs/dbraw/zinc/82/64/22/525826422.db2.gz XITMIBDBYBTYFH-HNNXBMFYSA-N 0 3 267.344 2.658 20 10 CFCDHN COc1cccc(CN2CC(C)(C)[C@@H]2[C@H]2CCCO2)c1O ZINC000291665691 525931947 /nfs/dbraw/zinc/93/19/47/525931947.db2.gz VSHZDKQTZYXCOQ-ZBFHGGJFSA-N 0 3 291.391 2.790 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c([O-])c1 ZINC000168841201 525933078 /nfs/dbraw/zinc/93/30/78/525933078.db2.gz LLZPTMXKARTILD-OAVHHTNSSA-N 0 3 269.410 2.508 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H](CSC)C2)c1[O-] ZINC000292821814 525937432 /nfs/dbraw/zinc/93/74/32/525937432.db2.gz QCGSCYOYWYBYED-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H](CSC)C2)c1[O-] ZINC000292821814 525937440 /nfs/dbraw/zinc/93/74/40/525937440.db2.gz QCGSCYOYWYBYED-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000374255807 525940434 /nfs/dbraw/zinc/94/04/34/525940434.db2.gz SPINTTGEUUOGSR-UONOGXRCSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000374255807 525940444 /nfs/dbraw/zinc/94/04/44/525940444.db2.gz SPINTTGEUUOGSR-UONOGXRCSA-N 0 3 277.364 2.544 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c([O-])c1 ZINC000300419635 525940780 /nfs/dbraw/zinc/94/07/80/525940780.db2.gz ZCLZJXOJGRWCIO-PEYYIBSZSA-N 0 3 261.365 2.919 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN3CCCC[C@H]23)c([O-])c1 ZINC000036996274 525945917 /nfs/dbraw/zinc/94/59/17/525945917.db2.gz VOWNHQMHNHFUGO-CWRNSKLLSA-N 0 3 274.408 2.978 20 10 CFCDHN COc1cccc(CN2CCS[C@H](C)[C@@H]2C)c1O ZINC000093501201 525950983 /nfs/dbraw/zinc/95/09/83/525950983.db2.gz HWVPPRDKPLQABP-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)c1[O-] ZINC000093501201 525950992 /nfs/dbraw/zinc/95/09/92/525950992.db2.gz HWVPPRDKPLQABP-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@H](C)[C@@H]2C)c1[O-] ZINC000093501201 525950994 /nfs/dbraw/zinc/95/09/94/525950994.db2.gz HWVPPRDKPLQABP-WDEREUQCSA-N 0 3 267.394 2.727 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 ZINC000290416285 526373491 /nfs/dbraw/zinc/37/34/91/526373491.db2.gz KJKHTLRSULGKFE-HYVNUMGLSA-N 0 3 251.329 2.820 20 10 CFCDHN Cn1cc2c(n1)CCC[C@H]2NCc1ccc2c(c1)CCO2 ZINC000280247647 527331213 /nfs/dbraw/zinc/33/12/13/527331213.db2.gz WKYSZWFLOPTYOJ-OAHLLOKOSA-N 0 3 283.375 2.522 20 10 CFCDHN Cc1nccn1CCC[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000266200293 527419883 /nfs/dbraw/zinc/41/98/83/527419883.db2.gz KVPHUKQSNBYTLQ-UHFFFAOYSA-N 0 3 273.380 2.694 20 10 CFCDHN Cc1ncsc1CC[N@@H+](C)Cc1ccccc1[O-] ZINC000172536915 527485960 /nfs/dbraw/zinc/48/59/60/527485960.db2.gz RJSFBDJFPDFFRC-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1ncsc1CC[N@H+](C)Cc1ccccc1[O-] ZINC000172536915 527485964 /nfs/dbraw/zinc/48/59/64/527485964.db2.gz RJSFBDJFPDFFRC-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756369858 574097883 /nfs/dbraw/zinc/09/78/83/574097883.db2.gz CYGJAKJSNYJTNC-ZYHUDNBSSA-N 0 3 275.327 2.566 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)CC2CC2)c([O-])c1C ZINC000756768596 574129399 /nfs/dbraw/zinc/12/93/99/574129399.db2.gz FRDCKZIRWOFSIZ-JSGCOSHPSA-N 0 3 263.381 2.821 20 10 CFCDHN CC[NH+](CC)CCC[C@H](C)NC(=O)c1cc([O-])cs1 ZINC000732275150 574149404 /nfs/dbraw/zinc/14/94/04/574149404.db2.gz FPNPOYLTUJHDAT-NSHDSACASA-N 0 3 284.425 2.694 20 10 CFCDHN CN(C)CCOc1ccc(N(C)Cc2cscn2)cc1 ZINC000732410644 574156505 /nfs/dbraw/zinc/15/65/05/574156505.db2.gz FXVXQKFLOCASHT-UHFFFAOYSA-N 0 3 291.420 2.720 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)CC2CCOCC2)c1 ZINC000747100713 574179904 /nfs/dbraw/zinc/17/99/04/574179904.db2.gz OSPGFYATPLNMMU-CYBMUJFWSA-N 0 3 263.381 2.995 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])CCC2)[C@H]1CCSC1 ZINC000755793424 574187667 /nfs/dbraw/zinc/18/76/67/574187667.db2.gz NOBCGYPQVWJWRW-AWEZNQCLSA-N 0 3 263.406 2.818 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])CCC2)[C@H]1CCSC1 ZINC000755793424 574187668 /nfs/dbraw/zinc/18/76/68/574187668.db2.gz NOBCGYPQVWJWRW-AWEZNQCLSA-N 0 3 263.406 2.818 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000756356074 574228825 /nfs/dbraw/zinc/22/88/25/574228825.db2.gz ZZODYIJGOLAOBZ-CKYFFXLPSA-N 0 3 265.328 2.848 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c([O-])c1 ZINC000756434228 574237344 /nfs/dbraw/zinc/23/73/44/574237344.db2.gz VIBNZSKEFWDIMS-IUODEOHRSA-N 0 3 262.397 2.691 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(C)C2)c([O-])c1C ZINC000756443806 574237985 /nfs/dbraw/zinc/23/79/85/574237985.db2.gz IWSYQMXHVPLUHS-ZIAGYGMSSA-N 0 3 262.397 2.754 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000756449966 574238272 /nfs/dbraw/zinc/23/82/72/574238272.db2.gz PTFPWSDRPATPER-PMVVWTBXSA-N 0 3 293.260 2.592 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000756525249 574243606 /nfs/dbraw/zinc/24/36/06/574243606.db2.gz NJTYGIGQFPGPRY-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCOc2cccnc2)c1 ZINC000756569921 574248678 /nfs/dbraw/zinc/24/86/78/574248678.db2.gz ACTGQFWZLVFZTD-GFCCVEGCSA-N 0 3 288.347 2.525 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCOc2cccnc2)c1 ZINC000756570519 574248740 /nfs/dbraw/zinc/24/87/40/574248740.db2.gz DEAZAXLRMHWBAO-CYBMUJFWSA-N 0 3 272.348 2.825 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)C2CC2)c([O-])c1C ZINC000756576302 574249443 /nfs/dbraw/zinc/24/94/43/574249443.db2.gz MDFYSUSZEXCMOA-MLGOLLRUSA-N 0 3 263.381 2.821 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000756576727 574250058 /nfs/dbraw/zinc/25/00/58/574250058.db2.gz ODUNNQYMVFMHEE-HWWQOWPSSA-N 0 3 281.396 2.849 20 10 CFCDHN CC(C)[C@H](O)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756584820 574250651 /nfs/dbraw/zinc/25/06/51/574250651.db2.gz GWBBUNAUQYBHPC-IRUJWGPZSA-N 0 3 267.344 2.686 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756591246 574251254 /nfs/dbraw/zinc/25/12/54/574251254.db2.gz FUYLCDKIMHZZIB-LKAMGYQZSA-N 0 3 299.411 2.782 20 10 CFCDHN CSC[C@@H](CCO)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756603004 574251943 /nfs/dbraw/zinc/25/19/43/574251943.db2.gz HLSFLYPWMSIIBS-QWHCGFSZSA-N 0 3 283.437 2.774 20 10 CFCDHN C[C@H](NCc1cc[nH]c1)c1ccc(N2CCOCC2)cc1 ZINC000748439568 574252780 /nfs/dbraw/zinc/25/27/80/574252780.db2.gz WFMJDEZLWNLGSV-AWEZNQCLSA-N 0 3 285.391 2.702 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@]2(O)CCSC2)c([O-])c1C ZINC000756637602 574253803 /nfs/dbraw/zinc/25/38/03/574253803.db2.gz NZQVPZAZOHIBDF-WFASDCNBSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(=O)NC(C)(C)C)c([O-])c1C ZINC000756683341 574257699 /nfs/dbraw/zinc/25/76/99/574257699.db2.gz MFZMFRVXKLNILC-ZDUSSCGKSA-N 0 3 292.423 2.964 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756734410 574259897 /nfs/dbraw/zinc/25/98/97/574259897.db2.gz WOWHCQQEGJVXCF-NTZNESFSSA-N 0 3 297.370 2.721 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2(CCO)CCC2)c1 ZINC000756765010 574261064 /nfs/dbraw/zinc/26/10/64/574261064.db2.gz LSEQZYQIQMGVRN-CYBMUJFWSA-N 0 3 263.381 2.904 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCNC(=O)C(C)C)c([O-])c1C ZINC000756775422 574261574 /nfs/dbraw/zinc/26/15/74/574261574.db2.gz HFJWOFAEVLTINR-CQSZACIVSA-N 0 3 292.423 2.822 20 10 CFCDHN CNC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756773857 574261942 /nfs/dbraw/zinc/26/19/42/574261942.db2.gz CUPCCMBRBXXXOR-CFVMTHIKSA-N 0 3 290.407 2.574 20 10 CFCDHN C[C@H]([NH2+]CCc1cnccn1)c1cc2c(cc1[O-])CCCC2 ZINC000756785958 574262784 /nfs/dbraw/zinc/26/27/84/574262784.db2.gz HDDRAIWRWRULIW-ZDUSSCGKSA-N 0 3 297.402 2.954 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]3COCC[C@@H]31)CCC2 ZINC000756884768 574270684 /nfs/dbraw/zinc/27/06/84/574270684.db2.gz JFRGNDWXOGYQMJ-RDJZCZTQSA-N 0 3 287.403 2.882 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]3COCC[C@@H]31)CCC2 ZINC000756884768 574270685 /nfs/dbraw/zinc/27/06/85/574270685.db2.gz JFRGNDWXOGYQMJ-RDJZCZTQSA-N 0 3 287.403 2.882 20 10 CFCDHN CCOc1cccc(CNC(C)(C)c2cnn(C)c2)c1O ZINC000742374017 574325679 /nfs/dbraw/zinc/32/56/79/574325679.db2.gz OXRHLSDJJLFGDM-UHFFFAOYSA-N 0 3 289.379 2.549 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](CC)C[C@@H](C)CO)c1[O-] ZINC000743499992 574367267 /nfs/dbraw/zinc/36/72/67/574367267.db2.gz SJTJOJNRSVRDSG-TZMCWYRMSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+]C2(CCO)CCCCC2)c1[O-] ZINC000751151866 574370109 /nfs/dbraw/zinc/37/01/09/574370109.db2.gz GVADFKRGQUECHL-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@H](OC)C2(C)C)c([O-])c1 ZINC000753372451 574401724 /nfs/dbraw/zinc/40/17/24/574401724.db2.gz FJLXNDMLMFMKRD-GJZGRUSLSA-N 0 3 279.380 2.694 20 10 CFCDHN CO[C@@H]1C[C@H]([NH2+]Cc2cc(C)c(C)cc2[O-])C1(C)C ZINC000753372823 574401820 /nfs/dbraw/zinc/40/18/20/574401820.db2.gz IYZMIQUBUXPXMR-LSDHHAIUSA-N 0 3 263.381 2.912 20 10 CFCDHN COCC[C@@H](Cc1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000753571743 574404869 /nfs/dbraw/zinc/40/48/69/574404869.db2.gz ZHFQCRYZFIBFQI-AWEZNQCLSA-N 0 3 293.338 2.862 20 10 CFCDHN Cc1cc(CN(C)Cc2ccccc2O)cnc1F ZINC000891713420 617723451 /nfs/dbraw/zinc/72/34/51/617723451.db2.gz CQVUOIJBZKNJEB-UHFFFAOYSA-N 0 3 260.312 2.867 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000307778889 618142520 /nfs/dbraw/zinc/14/25/20/618142520.db2.gz OQKYSAIPNDDSGA-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN COC[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000307778889 618142521 /nfs/dbraw/zinc/14/25/21/618142521.db2.gz OQKYSAIPNDDSGA-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccc(C)n2)c1 ZINC000051573988 618226207 /nfs/dbraw/zinc/22/62/07/618226207.db2.gz DIIZITSHZUDZJH-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCCC[C@H]2CO)c([O-])c1 ZINC000895151477 618394378 /nfs/dbraw/zinc/39/43/78/618394378.db2.gz JSXPTMMOSQFKSD-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCCC[C@H]2CO)c([O-])c1 ZINC000895151477 618394384 /nfs/dbraw/zinc/39/43/84/618394384.db2.gz JSXPTMMOSQFKSD-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000191570088 618409450 /nfs/dbraw/zinc/40/94/50/618409450.db2.gz PHQQELTWXYLPED-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CCOC(C)C ZINC000788269615 618448055 /nfs/dbraw/zinc/44/80/55/618448055.db2.gz BTCMRUVVSIDAAE-MRXNPFEDSA-N 0 3 295.423 2.780 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CCOC(C)C ZINC000788269615 618448057 /nfs/dbraw/zinc/44/80/57/618448057.db2.gz BTCMRUVVSIDAAE-MRXNPFEDSA-N 0 3 295.423 2.780 20 10 CFCDHN CC1=NO[C@H](CNC/C=C\c2ccc(N(C)C)cc2)C1 ZINC000895300770 618520233 /nfs/dbraw/zinc/52/02/33/618520233.db2.gz TXGPSYYOVJTXEJ-AWFCHZOYSA-N 0 3 273.380 2.520 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2CC=CC2)c1[O-] ZINC000169091860 618720774 /nfs/dbraw/zinc/72/07/74/618720774.db2.gz QQSBHHYTDOHGCV-UHFFFAOYSA-N 0 3 253.729 2.862 20 10 CFCDHN CCNC(=O)C(C)(C)NCc1ccc(N(CC)CC)cc1 ZINC000312825039 618954231 /nfs/dbraw/zinc/95/42/31/618954231.db2.gz PZTAXPRGVILHTI-UHFFFAOYSA-N 0 3 291.439 2.537 20 10 CFCDHN CC(C)CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000005097743 619085618 /nfs/dbraw/zinc/08/56/18/619085618.db2.gz QHTWBDPAELAJTG-MRXNPFEDSA-N 0 3 291.439 2.518 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000063218350 619162625 /nfs/dbraw/zinc/16/26/25/619162625.db2.gz WKBDAXLPXPZJCP-UKRRQHHQSA-N 0 3 271.360 2.646 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781981 619466096 /nfs/dbraw/zinc/46/60/96/619466096.db2.gz IHHJEAPZASDMHS-ABAIWWIYSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781981 619466097 /nfs/dbraw/zinc/46/60/97/619466097.db2.gz IHHJEAPZASDMHS-ABAIWWIYSA-N 0 3 296.361 2.587 20 10 CFCDHN COc1cc(C)cc(CNCc2occc2C)c1O ZINC000894842775 619480147 /nfs/dbraw/zinc/48/01/47/619480147.db2.gz CYGMYGGITKBHMW-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@]1(c2ccccc2)C[C@@H](O)C1 ZINC000895513335 619544857 /nfs/dbraw/zinc/54/48/57/619544857.db2.gz ZJJHORIQTRYCNU-WOVMCDHWSA-N 0 3 287.334 2.671 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000895528929 619547866 /nfs/dbraw/zinc/54/78/66/619547866.db2.gz BWLUCUVJWZTOED-CYBMUJFWSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCN(Cc2ccccc2O)C1 ZINC000895577598 619559004 /nfs/dbraw/zinc/55/90/04/619559004.db2.gz OFRHIGAHLPJALK-LBPRGKRZSA-N 0 3 275.270 2.545 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000895577598 619559005 /nfs/dbraw/zinc/55/90/05/619559005.db2.gz OFRHIGAHLPJALK-LBPRGKRZSA-N 0 3 275.270 2.545 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000895577598 619559006 /nfs/dbraw/zinc/55/90/06/619559006.db2.gz OFRHIGAHLPJALK-LBPRGKRZSA-N 0 3 275.270 2.545 20 10 CFCDHN COc1ccc(CN[C@H](C)c2ccns2)c(O)c1OC ZINC000895662709 619578553 /nfs/dbraw/zinc/57/85/53/619578553.db2.gz LYKZXFLSSMJLGV-SECBINFHSA-N 0 3 294.376 2.717 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@@H]2COC[C@]2(c2ccccc2)C1 ZINC000896222171 619693782 /nfs/dbraw/zinc/69/37/82/619693782.db2.gz DYPKHFIKKXBPLS-MJGOQNOKSA-N 0 3 295.382 2.792 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@@H]2COC[C@]2(c2ccccc2)C1 ZINC000896222171 619693785 /nfs/dbraw/zinc/69/37/85/619693785.db2.gz DYPKHFIKKXBPLS-MJGOQNOKSA-N 0 3 295.382 2.792 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2c([O-])cccc2F)o1 ZINC000896640719 619781504 /nfs/dbraw/zinc/78/15/04/619781504.db2.gz RJOZCNBCJXVWPN-UHFFFAOYSA-N 0 3 265.284 2.813 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(CSC)CC1 ZINC000896937316 619900351 /nfs/dbraw/zinc/90/03/51/619900351.db2.gz PANDLFMVJROVCW-UHFFFAOYSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000896962675 619905491 /nfs/dbraw/zinc/90/54/91/619905491.db2.gz QAPHOHMNLLRTQJ-AWEZNQCLSA-N 0 3 299.370 2.930 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000896962675 619905493 /nfs/dbraw/zinc/90/54/93/619905493.db2.gz QAPHOHMNLLRTQJ-AWEZNQCLSA-N 0 3 299.370 2.930 20 10 CFCDHN Cc1cccc(CNCc2cc(C3CC3)nn2C)c1O ZINC000897224323 619954062 /nfs/dbraw/zinc/95/40/62/619954062.db2.gz NSEJGXNKUZHRRO-UHFFFAOYSA-N 0 3 271.364 2.601 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc2c(cc1[O-])OCO2)C1CC1 ZINC000897442799 620173326 /nfs/dbraw/zinc/17/33/26/620173326.db2.gz JKAWAXYIWHITDD-UHFFFAOYSA-N 0 3 263.337 2.647 20 10 CFCDHN CC[C@](O)(CCC(F)(F)F)C[NH2+]Cc1ccccc1[O-] ZINC000897523208 620203961 /nfs/dbraw/zinc/20/39/61/620203961.db2.gz RSOKBMKWWMJKAE-ZDUSSCGKSA-N 0 3 291.313 2.965 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000897748781 620276185 /nfs/dbraw/zinc/27/61/85/620276185.db2.gz FCOCATOCEPRKSV-YOGCLGLASA-N 0 3 279.405 2.917 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2COC[C@H]2C2CC2)c1[O-] ZINC000898381291 620379125 /nfs/dbraw/zinc/37/91/25/620379125.db2.gz CSILFMPDKMURLJ-STQMWFEESA-N 0 3 297.782 2.569 20 10 CFCDHN CNc1ccccc1CNCc1ccc2c(c1)CCO2 ZINC000902156104 620988808 /nfs/dbraw/zinc/98/88/08/620988808.db2.gz HNKIOKAFAWJBPN-UHFFFAOYSA-N 0 3 268.360 2.953 20 10 CFCDHN N[C@@H]1c2ccccc2C[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000902432401 621078231 /nfs/dbraw/zinc/07/82/31/621078231.db2.gz HLVLIZRFTHTDFI-IIDMSEBBSA-N 0 3 280.371 2.594 20 10 CFCDHN CC[C@@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cccc(Cl)c1[O-] ZINC000902464005 621098080 /nfs/dbraw/zinc/09/80/80/621098080.db2.gz CENQQXRZQLGOPF-KQURDKLPSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1N2)c1cccc(Cl)c1[O-] ZINC000902464005 621098083 /nfs/dbraw/zinc/09/80/83/621098083.db2.gz CENQQXRZQLGOPF-KQURDKLPSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@H](N[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902470480 621101044 /nfs/dbraw/zinc/10/10/44/621101044.db2.gz YJDSLANESLAMJD-SCUASFONSA-N 0 3 280.799 2.979 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]1C1OCCO1 ZINC000902622928 621137792 /nfs/dbraw/zinc/13/77/92/621137792.db2.gz SBUZFHNPKNLKAG-MRXNPFEDSA-N 0 3 299.370 2.883 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCC[C@@H]1C1OCCO1 ZINC000902622928 621137795 /nfs/dbraw/zinc/13/77/95/621137795.db2.gz SBUZFHNPKNLKAG-MRXNPFEDSA-N 0 3 299.370 2.883 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(C3(O)CCC3)CC1)CC2 ZINC000903257385 621301228 /nfs/dbraw/zinc/30/12/28/621301228.db2.gz FTPNXQWKLLHPCW-CYBMUJFWSA-N 0 3 273.376 2.664 20 10 CFCDHN CO[C@@H]1CCOC[C@H]1[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000903296870 621312957 /nfs/dbraw/zinc/31/29/57/621312957.db2.gz OKWRJNOTIZLDHL-ZLKJLUDKSA-N 0 3 299.798 2.809 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C)[C@H]1C)c1ccc(C)cc1[O-] ZINC000903299801 621314630 /nfs/dbraw/zinc/31/46/30/621314630.db2.gz FCWXVPAJLWDBJT-QEJZJMRPSA-N 0 3 262.397 2.834 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCOC12CCOCC2)c1cc(F)ccc1[O-] ZINC000903389482 621359690 /nfs/dbraw/zinc/35/96/90/621359690.db2.gz LWYNEDJWTPMWJQ-IAQYHMDHSA-N 0 3 295.354 2.520 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183400149 625484731 /nfs/dbraw/zinc/48/47/31/625484731.db2.gz WTTDLKUUSHEOLD-NSHDSACASA-N 0 3 273.380 2.636 20 10 CFCDHN COc1cc(C)cc(CN(C)Cc2cccn2C)c1O ZINC000164503389 622958383 /nfs/dbraw/zinc/95/83/83/622958383.db2.gz HHXGXHFAFUHURV-UHFFFAOYSA-N 0 3 274.364 2.680 20 10 CFCDHN Oc1ccccc1CN[C@@H]1COCc2ccccc21 ZINC000226011884 623054054 /nfs/dbraw/zinc/05/40/54/623054054.db2.gz HDHWFJFTHRATJJ-OAHLLOKOSA-N 0 3 255.317 2.753 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000226011884 623054061 /nfs/dbraw/zinc/05/40/61/623054061.db2.gz HDHWFJFTHRATJJ-OAHLLOKOSA-N 0 3 255.317 2.753 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1ccccc1[O-] ZINC000226867515 623092154 /nfs/dbraw/zinc/09/21/54/623092154.db2.gz JPRVOMIVLCMHQA-YDHLFZDLSA-N 0 3 262.397 2.916 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H]2CCOC2)c1[O-] ZINC000169090257 623113065 /nfs/dbraw/zinc/11/30/65/623113065.db2.gz CJRSURDUOQKFJZ-NXEZZACHSA-N 0 3 285.771 2.569 20 10 CFCDHN Nc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccccc1[O-] ZINC000228408702 623143301 /nfs/dbraw/zinc/14/33/01/623143301.db2.gz RLNWFBJYDSXWDV-HNNXBMFYSA-N 0 3 254.333 2.752 20 10 CFCDHN CC(C)C[C@H](O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000230660110 623291276 /nfs/dbraw/zinc/29/12/76/623291276.db2.gz MJRHFISEIRBXKV-PWSUYJOCSA-N 0 3 255.333 2.589 20 10 CFCDHN CC(C)C[C@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230660102 623291837 /nfs/dbraw/zinc/29/18/37/623291837.db2.gz MJRHFISEIRBXKV-JQWIXIFHSA-N 0 3 255.333 2.589 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2C[C@H](OC)C2(C)C)c1[O-] ZINC000230935107 623310329 /nfs/dbraw/zinc/31/03/29/623310329.db2.gz RQIPPNRSHKCMCK-STQMWFEESA-N 0 3 299.798 2.957 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@]2(C)CCO[C@@H]2C)c1[O-] ZINC000230935794 623312322 /nfs/dbraw/zinc/31/23/22/623312322.db2.gz PFUZXHIPUJOHTG-OTYXRUKQSA-N 0 3 285.771 2.711 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCC[C@H](CO)C1)c1ccccc1[O-] ZINC000311420849 623462061 /nfs/dbraw/zinc/46/20/61/623462061.db2.gz NWPOPCGZSNXQSA-GUTXKFCHSA-N 0 3 263.381 2.984 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC(C)(F)F)c([O-])c1 ZINC000824482921 623512121 /nfs/dbraw/zinc/51/21/21/623512121.db2.gz DZXPSIOBXZLCCD-UHFFFAOYSA-N 0 3 259.296 2.926 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H](CO)c1ccccc1 ZINC000824697189 623546668 /nfs/dbraw/zinc/54/66/68/623546668.db2.gz ZRZABTLQETUNAK-HNNXBMFYSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H](CO)c1ccccc1 ZINC000824697189 623546674 /nfs/dbraw/zinc/54/66/74/623546674.db2.gz ZRZABTLQETUNAK-HNNXBMFYSA-N 0 3 275.323 2.697 20 10 CFCDHN COc1cccc(O)c1CNCc1cnc(C)cc1C ZINC000825221028 623651171 /nfs/dbraw/zinc/65/11/71/623651171.db2.gz DYODMRHAKZKXIA-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000825232050 623655051 /nfs/dbraw/zinc/65/50/51/623655051.db2.gz MESGUCYKQQIFLR-UHFFFAOYSA-N 0 3 293.407 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)C2CCC2)c1[O-] ZINC000826868738 623898849 /nfs/dbraw/zinc/89/88/49/623898849.db2.gz WMJZZHJKZCWERJ-ZDUSSCGKSA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)C2(CO)CC2)c1[O-] ZINC000826990509 623920457 /nfs/dbraw/zinc/92/04/57/623920457.db2.gz HOJYMOYSJDSUKQ-SNVBAGLBSA-N 0 3 269.772 2.605 20 10 CFCDHN COc1cc(Cl)cc(C[NH+]2C[C@H](C)C(O)[C@@H](C)C2)c1[O-] ZINC000827151701 623954898 /nfs/dbraw/zinc/95/48/98/623954898.db2.gz IHIGHGKPGFIUFJ-UWVGGRQHSA-N 0 3 299.798 2.503 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2C[C@H](O)c3ccccc32)c1 ZINC000827179363 623959955 /nfs/dbraw/zinc/95/99/55/623959955.db2.gz VUZLVUKDEYNCNV-RDJZCZTQSA-N 0 3 285.343 2.669 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000827179300 623960033 /nfs/dbraw/zinc/96/00/33/623960033.db2.gz UMQBZBGXPSGGLL-GDBMZVCRSA-N 0 3 273.307 2.799 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000827270790 623978948 /nfs/dbraw/zinc/97/89/48/623978948.db2.gz FZIFXYBXWMYASB-LBPRGKRZSA-N 0 3 267.344 2.972 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000827270790 623978951 /nfs/dbraw/zinc/97/89/51/623978951.db2.gz FZIFXYBXWMYASB-LBPRGKRZSA-N 0 3 267.344 2.972 20 10 CFCDHN C[C@@H](CN1CCC(C)CC1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000827352760 623992118 /nfs/dbraw/zinc/99/21/18/623992118.db2.gz PGRPHDJZRSFLMQ-ZDUSSCGKSA-N 0 3 280.387 2.741 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC(O)(C2CC2)C2CC2)c1[O-] ZINC000827359633 623993036 /nfs/dbraw/zinc/99/30/36/623993036.db2.gz QPQPGCVMSKSNOV-UHFFFAOYSA-N 0 3 295.810 2.995 20 10 CFCDHN CO[C@@]1(C)C[C@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000827716121 624074706 /nfs/dbraw/zinc/07/47/06/624074706.db2.gz TZGMTQSUBMHTPB-YPMHNXCESA-N 0 3 255.745 2.621 20 10 CFCDHN COc1cc(Br)cc(C[N@H+](C)C2CC2)c1[O-] ZINC000153757838 624132569 /nfs/dbraw/zinc/13/25/69/624132569.db2.gz AAMMZPSPYFOSOZ-UHFFFAOYSA-N 0 3 286.169 2.758 20 10 CFCDHN COc1cc(Br)cc(C[N@@H+](C)C2CC2)c1[O-] ZINC000153757838 624132571 /nfs/dbraw/zinc/13/25/71/624132571.db2.gz AAMMZPSPYFOSOZ-UHFFFAOYSA-N 0 3 286.169 2.758 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCOCC(F)(F)F)CC2 ZINC000834508079 625698782 /nfs/dbraw/zinc/69/87/82/625698782.db2.gz HPJSGFSTUHONLZ-NSHDSACASA-N 0 3 289.297 2.938 20 10 CFCDHN COc1ccc(O)c(CN(C)Cc2cccc(C#N)c2)c1 ZINC000179682020 624973248 /nfs/dbraw/zinc/97/32/48/624973248.db2.gz RDSPQFDLLXPGMY-UHFFFAOYSA-N 0 3 282.343 2.904 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1O ZINC000180564183 625029796 /nfs/dbraw/zinc/02/97/96/625029796.db2.gz JJWFTEQSGUSVQW-UHFFFAOYSA-N 0 3 277.295 2.535 20 10 CFCDHN C[C@@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185675011 625760367 /nfs/dbraw/zinc/76/03/67/625760367.db2.gz JQWMTTACNIOXSO-YKJXYISPSA-N 0 3 287.334 2.840 20 10 CFCDHN CO[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834722692 625802600 /nfs/dbraw/zinc/80/26/00/625802600.db2.gz XYECWFFVBQNTMP-ONGXEEELSA-N 0 3 275.270 2.546 20 10 CFCDHN C[C@H](Cc1cnn(C)c1)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000834896687 625913029 /nfs/dbraw/zinc/91/30/29/625913029.db2.gz MPZYZLATRZKLSL-GHMZBOCLSA-N 0 3 277.343 2.547 20 10 CFCDHN C[C@H](NCC1C[NH2+]C1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817965410 625966055 /nfs/dbraw/zinc/96/60/55/625966055.db2.gz PXKLVMZGHAFXEQ-ZETCQYMHSA-N 0 3 275.179 2.569 20 10 CFCDHN COc1ccc(N2CCN([C@H]3C=CCCC3)CC2)cc1 ZINC000076667798 626180910 /nfs/dbraw/zinc/18/09/10/626180910.db2.gz RIDRKRDCLWMQCS-HNNXBMFYSA-N 0 3 272.392 2.926 20 10 CFCDHN COc1ccc(CNCc2cc(N(C)C)ccn2)cc1C ZINC000922481701 626294159 /nfs/dbraw/zinc/29/41/59/626294159.db2.gz UUOFFCJHPZSOQC-UHFFFAOYSA-N 0 3 285.391 2.754 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)C(C)(C)OC)c([O-])c1 ZINC000922583408 626317643 /nfs/dbraw/zinc/31/76/43/626317643.db2.gz XCYNLEITVROQLH-LLVKDONJSA-N 0 3 267.369 2.694 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCCC2(CCC2)O1 ZINC000922814716 626369129 /nfs/dbraw/zinc/36/91/29/626369129.db2.gz ZDSKFRCFQUODOF-CQSZACIVSA-N 0 3 261.365 2.974 20 10 CFCDHN COc1ccc(CNCc2ccc3c(n2)CCC3)c(O)c1 ZINC000839067522 626522776 /nfs/dbraw/zinc/52/27/76/626522776.db2.gz WFEWWYZJWHQOTK-UHFFFAOYSA-N 0 3 284.359 2.574 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@@H](OC)C23CCC3)c([O-])c1 ZINC000839179861 626529810 /nfs/dbraw/zinc/52/98/10/626529810.db2.gz ALQUIULUAINGGI-JKSUJKDBSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C2COC(C)(C)OC2)c([O-])c1 ZINC000757705619 626559785 /nfs/dbraw/zinc/55/97/85/626559785.db2.gz RLWGDYPERMEVJE-NSHDSACASA-N 0 3 265.353 2.503 20 10 CFCDHN COC[C@H](C[N@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000851769827 634518350 /nfs/dbraw/zinc/51/83/50/634518350.db2.gz KLYCMNFKTFOKBY-INIZCTEOSA-N 0 3 293.407 2.798 20 10 CFCDHN COC[C@H](C[N@@H+](Cc1ccccc1[O-])C1CCCC1)OC ZINC000851769827 634518354 /nfs/dbraw/zinc/51/83/54/634518354.db2.gz KLYCMNFKTFOKBY-INIZCTEOSA-N 0 3 293.407 2.798 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000760885930 626781297 /nfs/dbraw/zinc/78/12/97/626781297.db2.gz MUIWHHUFAAMZPG-IVMMDQJWSA-N 0 3 279.380 2.545 20 10 CFCDHN CCN(CC)c1ccc(CN(C)C2CC(O)C2)cc1F ZINC000761221282 626816380 /nfs/dbraw/zinc/81/63/80/626816380.db2.gz DCVQIEILWVLNCG-UHFFFAOYSA-N 0 3 280.387 2.627 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000762785674 626937020 /nfs/dbraw/zinc/93/70/20/626937020.db2.gz GDTKEMCCGZJZKT-MFKMUULPSA-N 0 3 289.354 2.645 20 10 CFCDHN CCOc1ccc(C[NH2+]CCOCC2CCC2)c([O-])c1 ZINC000764981997 627110911 /nfs/dbraw/zinc/11/09/11/627110911.db2.gz YENPOUGDCCLLBU-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN Oc1cc2c(cc1CN1CC[C@@H]1c1ccccc1)[C@@H](O)CO2 ZINC000768439935 627342974 /nfs/dbraw/zinc/34/29/74/627342974.db2.gz QGEGIQKAVLKWPO-WBVHZDCISA-N 0 3 297.354 2.765 20 10 CFCDHN CCC[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768463614 627345205 /nfs/dbraw/zinc/34/52/05/627345205.db2.gz KKUJATQHRAEDPS-LRDDRELGSA-N 0 3 291.391 2.830 20 10 CFCDHN CCC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768463614 627345207 /nfs/dbraw/zinc/34/52/07/627345207.db2.gz KKUJATQHRAEDPS-LRDDRELGSA-N 0 3 291.391 2.830 20 10 CFCDHN C[N@H+](Cc1cc(Cl)ccc1[O-])[C@H]1CCN(C2CC2)C1 ZINC000769326426 627424472 /nfs/dbraw/zinc/42/44/72/627424472.db2.gz MBIJGUJFDJUDNZ-AWEZNQCLSA-N 0 3 280.799 2.714 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)ccc1[O-])[C@H]1CCN(C2CC2)C1 ZINC000769326426 627424474 /nfs/dbraw/zinc/42/44/74/627424474.db2.gz MBIJGUJFDJUDNZ-AWEZNQCLSA-N 0 3 280.799 2.714 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000769389671 627433157 /nfs/dbraw/zinc/43/31/57/627433157.db2.gz LXDWTPCQQKUOKV-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000769389671 627433158 /nfs/dbraw/zinc/43/31/58/627433158.db2.gz LXDWTPCQQKUOKV-GFCCVEGCSA-N 0 3 273.332 2.983 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000769513827 627449798 /nfs/dbraw/zinc/44/97/98/627449798.db2.gz FOEGLJWHBVPBIR-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000769513827 627449800 /nfs/dbraw/zinc/44/98/00/627449800.db2.gz FOEGLJWHBVPBIR-UKRRQHHQSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(O)c(CN[C@H](CO)c2ccsc2)c1 ZINC000769935490 627488670 /nfs/dbraw/zinc/48/86/70/627488670.db2.gz UDFXPUXOPNTTTN-CQSZACIVSA-N 0 3 293.388 2.676 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC(C)(C)OC)c([O-])c1 ZINC000770318622 627512995 /nfs/dbraw/zinc/51/29/95/627512995.db2.gz MSLWFGQZQVOABQ-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC(C)(C)OC)c([O-])c1 ZINC000770318622 627512996 /nfs/dbraw/zinc/51/29/96/627512996.db2.gz MSLWFGQZQVOABQ-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCN(C)c1ccc(CN2CCC(C(=O)OC)CC2)cc1 ZINC000773735218 627852920 /nfs/dbraw/zinc/85/29/20/627852920.db2.gz ZJPDGQFUBIALRE-UHFFFAOYSA-N 0 3 290.407 2.528 20 10 CFCDHN COCC[C@@]1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CCOC1 ZINC000775201155 627999787 /nfs/dbraw/zinc/99/97/87/627999787.db2.gz CDBPARPKNXXJAX-OAHLLOKOSA-N 0 3 299.798 2.639 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](CO)Cc1ccco1)c1ccccc1[O-] ZINC000775512860 628032958 /nfs/dbraw/zinc/03/29/58/628032958.db2.gz CTMXURTYRZYAGN-CZUORRHYSA-N 0 3 289.375 2.877 20 10 CFCDHN CC[C@H]([NH2+]CC1(CCO)CCC1)c1ccccc1[O-] ZINC000775522422 628033694 /nfs/dbraw/zinc/03/36/94/628033694.db2.gz PBJFEMDRRMDVDS-AWEZNQCLSA-N 0 3 263.381 2.986 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CCO)C1CCOCC1)c1ccccc1[O-] ZINC000775555190 628036913 /nfs/dbraw/zinc/03/69/13/628036913.db2.gz KCYHOHOKDIOJQT-HZPDHXFCSA-N 0 3 293.407 2.611 20 10 CFCDHN COc1ccc(O)c(CNCc2cc(F)cc(OC)c2)c1 ZINC000776252263 628122027 /nfs/dbraw/zinc/12/20/27/628122027.db2.gz LKOOLCQTVBDSMQ-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CO[C@@H](CN[C@@H](C)c1ccc(N(C)C)cc1)C(F)(F)F ZINC000777009005 628191215 /nfs/dbraw/zinc/19/12/15/628191215.db2.gz HMKLMHFTHBCAIP-GWCFXTLKSA-N 0 3 290.329 2.981 20 10 CFCDHN CC(C)[C@H]1C[C@H](C[NH2+]Cc2ccccc2[O-])CCO1 ZINC000778630918 628321289 /nfs/dbraw/zinc/32/12/89/628321289.db2.gz GZCCWNQFBWEFPJ-CZUORRHYSA-N 0 3 263.381 2.933 20 10 CFCDHN C[C@H]1C[NH+](Cc2cc(F)ccc2[O-])C[C@H](C)S1 ZINC000779003078 628344816 /nfs/dbraw/zinc/34/48/16/628344816.db2.gz ORVYDYKFVLWEEM-UWVGGRQHSA-N 0 3 255.358 2.857 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](CC)(CO)C2)c([O-])c1 ZINC000779218276 628361111 /nfs/dbraw/zinc/36/11/11/628361111.db2.gz WQZJIHGCJWRWMS-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](CC)(CO)C2)c([O-])c1 ZINC000779218276 628361114 /nfs/dbraw/zinc/36/11/14/628361114.db2.gz WQZJIHGCJWRWMS-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H](OC(F)F)C2)cc1 ZINC000781533043 628557232 /nfs/dbraw/zinc/55/72/32/628557232.db2.gz XCHYCVVCZPUVAG-AWEZNQCLSA-N 0 3 284.350 2.956 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000781531878 628557337 /nfs/dbraw/zinc/55/73/37/628557337.db2.gz LIFNPHYCEOOHFM-NSHDSACASA-N 0 3 257.280 2.596 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000781531878 628557340 /nfs/dbraw/zinc/55/73/40/628557340.db2.gz LIFNPHYCEOOHFM-NSHDSACASA-N 0 3 257.280 2.596 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CC(OC)OC)cc1 ZINC000781885842 628588754 /nfs/dbraw/zinc/58/87/54/628588754.db2.gz XQUDOYBQSARCGT-UHFFFAOYSA-N 0 3 280.412 2.584 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1ccccc1[O-])C(C)C ZINC000783505201 628713943 /nfs/dbraw/zinc/71/39/43/628713943.db2.gz GAJFIFPHZXZCJX-ZDUSSCGKSA-N 0 3 250.386 2.773 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783510495 628714636 /nfs/dbraw/zinc/71/46/36/628714636.db2.gz PFKXPCACSZSPJU-SLEUVZQESA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@H](C)[C@@H](C)O1 ZINC000783546827 628719495 /nfs/dbraw/zinc/71/94/95/628719495.db2.gz UFXZCNXGMDFKQV-JHJVBQTASA-N 0 3 275.392 2.879 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CCO[C@H](C)C1 ZINC000784645916 628833769 /nfs/dbraw/zinc/83/37/69/628833769.db2.gz CUEBZWCDPIVDND-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](OC)C2)c([O-])c1 ZINC000784667111 628835842 /nfs/dbraw/zinc/83/58/42/628835842.db2.gz DYKLUDVNNDITOZ-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](C)[C@H](OC)C2)c([O-])c1 ZINC000784667111 628835843 /nfs/dbraw/zinc/83/58/43/628835843.db2.gz DYKLUDVNNDITOZ-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOC(CC[NH2+][C@H](C)c1cc(F)ccc1[O-])OCC ZINC000786969901 628986984 /nfs/dbraw/zinc/98/69/84/628986984.db2.gz GZANJJKCGOAVCK-LLVKDONJSA-N 0 3 285.359 2.971 20 10 CFCDHN COCC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCOC1 ZINC000787335427 629008280 /nfs/dbraw/zinc/00/82/80/629008280.db2.gz PXULNZLUSKOHGQ-CQSZACIVSA-N 0 3 299.798 2.591 20 10 CFCDHN COCC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H]1CCOC1 ZINC000787335427 629008283 /nfs/dbraw/zinc/00/82/83/629008283.db2.gz PXULNZLUSKOHGQ-CQSZACIVSA-N 0 3 299.798 2.591 20 10 CFCDHN C[C@H](O)CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000789347507 629149394 /nfs/dbraw/zinc/14/93/94/629149394.db2.gz GHYVRTGFIYDWLO-GOEBONIOSA-N 0 3 293.407 2.534 20 10 CFCDHN C[C@H](O)CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000789347507 629149398 /nfs/dbraw/zinc/14/93/98/629149398.db2.gz GHYVRTGFIYDWLO-GOEBONIOSA-N 0 3 293.407 2.534 20 10 CFCDHN C[C@H]1C[C@H](NCc2c([O-])ccc(Cl)c2F)CC[N@@H+]1C ZINC000790972725 629276062 /nfs/dbraw/zinc/27/60/62/629276062.db2.gz GDUBEYZGEZJWFW-VHSXEESVSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@H]1C[C@H](NCc2c([O-])ccc(Cl)c2F)CC[N@H+]1C ZINC000790972725 629276066 /nfs/dbraw/zinc/27/60/66/629276066.db2.gz GDUBEYZGEZJWFW-VHSXEESVSA-N 0 3 286.778 2.757 20 10 CFCDHN CN(C)c1ccc(/C=C\CN(C)C[C@@H]2CCCO2)cc1 ZINC000835025027 629320900 /nfs/dbraw/zinc/32/09/00/629320900.db2.gz FWSXUDSUBXMWET-AATOQMJSSA-N 0 3 274.408 2.877 20 10 CFCDHN CCc1nc([C@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835043197 629337381 /nfs/dbraw/zinc/33/73/81/629337381.db2.gz QSRAEMOFBKGGDT-YBJDMEARSA-N 0 3 299.422 2.797 20 10 CFCDHN Cc1cc(CNC/C=C\c2ccc(N(C)C)cc2)n(C)n1 ZINC000835050129 629349590 /nfs/dbraw/zinc/34/95/90/629349590.db2.gz PBBXAEXVAAMFDX-WAYWQWQTSA-N 0 3 284.407 2.598 20 10 CFCDHN CO[C@]1(C)CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000793216505 629507063 /nfs/dbraw/zinc/50/70/63/629507063.db2.gz HVGKWEDQQPGCHJ-MRXNPFEDSA-N 0 3 280.387 2.893 20 10 CFCDHN FC1(F)CCN(Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000793358901 629530298 /nfs/dbraw/zinc/53/02/98/629530298.db2.gz KAJHQWCFVPLUGG-UHFFFAOYSA-N 0 3 296.361 2.754 20 10 CFCDHN COC[C@H](CC(C)C)[NH2+]Cc1ccc(OC)cc1[O-] ZINC000793388759 629536079 /nfs/dbraw/zinc/53/60/79/629536079.db2.gz IPKHSKPWABQUQV-ZDUSSCGKSA-N 0 3 267.369 2.552 20 10 CFCDHN Cc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)n(C)n1 ZINC000793561997 629572172 /nfs/dbraw/zinc/57/21/72/629572172.db2.gz SMGJNRCRXJMTSX-ZANVPECISA-N 0 3 289.354 2.911 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1CCCc2nn(C)cc21 ZINC000794799883 629687180 /nfs/dbraw/zinc/68/71/80/629687180.db2.gz ADXONMFOINKNRD-QGZVFWFLSA-N 0 3 298.434 2.962 20 10 CFCDHN CC[C@H]([NH2+]C[C@@](C)(O)C1CC1)c1ccc(C)cc1[O-] ZINC000794805461 629687566 /nfs/dbraw/zinc/68/75/66/629687566.db2.gz GSVFMJFWIZOKIK-GOEBONIOSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000794807100 629687682 /nfs/dbraw/zinc/68/76/82/629687682.db2.gz KDYBNJXCJLQNJM-HOCLYGCPSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000794807098 629687987 /nfs/dbraw/zinc/68/79/87/629687987.db2.gz KDYBNJXCJLQNJM-GOEBONIOSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@H]([NH2+]CCc1cnccn1)c1ccc(C)cc1[O-] ZINC000794814306 629689366 /nfs/dbraw/zinc/68/93/66/629689366.db2.gz CUFAWRXMPNRNET-HNNXBMFYSA-N 0 3 271.364 2.774 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794812051 629689668 /nfs/dbraw/zinc/68/96/68/629689668.db2.gz BUIRBDQUKADBEL-YQQAZPJKSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)COCCOC)c1ccc(C)cc1[O-] ZINC000794818682 629690153 /nfs/dbraw/zinc/69/01/53/629690153.db2.gz UWANZCXRFUMQJY-DZGCQCFKSA-N 0 3 281.396 2.793 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)CO)c1ccc(C)cc1[O-] ZINC000794819655 629690941 /nfs/dbraw/zinc/69/09/41/629690941.db2.gz WZUHCXRCGDUNEP-CYBMUJFWSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@H](NCc1ccon1)c1ccc(F)cc1O ZINC000796791467 629968581 /nfs/dbraw/zinc/96/85/81/629968581.db2.gz XMBLWWWMBDUFMR-LBPRGKRZSA-N 0 3 250.273 2.760 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000797468994 630070786 /nfs/dbraw/zinc/07/07/86/630070786.db2.gz UCYADWVDZQEFRY-JTQLQIEISA-N 0 3 271.307 2.926 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C2(CN(C)C)CCC2)c1[O-] ZINC000798961341 630264595 /nfs/dbraw/zinc/26/45/95/630264595.db2.gz VHAVKBUCIGDKBY-UHFFFAOYSA-N 0 3 282.815 2.928 20 10 CFCDHN Cc1cccc(CN2CCN(c3cnccc3C)CC2)c1O ZINC000798962792 630264612 /nfs/dbraw/zinc/26/46/12/630264612.db2.gz ZPSFYJSJFUMCBM-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CC[S@](=O)CC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808696164 630400118 /nfs/dbraw/zinc/40/01/18/630400118.db2.gz STZLPRAXTIYMSU-MGNBDDOMSA-N 0 3 289.828 2.773 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCCCCCCC1)[C@H](O)CO2 ZINC000840133447 630977434 /nfs/dbraw/zinc/97/74/34/630977434.db2.gz LKDPGZYERVXYRA-MRXNPFEDSA-N 0 3 291.391 2.974 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCCCCCCC1)[C@@H](O)CO2 ZINC000840133444 630977582 /nfs/dbraw/zinc/97/75/82/630977582.db2.gz LKDPGZYERVXYRA-INIZCTEOSA-N 0 3 291.391 2.974 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(=O)NC(C)C)c1[O-] ZINC000808673201 631026368 /nfs/dbraw/zinc/02/63/68/631026368.db2.gz ZYILXGKFFDFGNG-SNVBAGLBSA-N 0 3 284.787 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCn2ccnc2)c1[O-] ZINC000808673096 631026389 /nfs/dbraw/zinc/02/63/89/631026389.db2.gz XKIAQSQAPOYGDF-NSHDSACASA-N 0 3 279.771 2.901 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H](O)C(F)(F)F)c1[O-] ZINC000808679924 631027462 /nfs/dbraw/zinc/02/74/62/631027462.db2.gz FGAQSBXQFXWYGV-GMSGAONNSA-N 0 3 297.704 2.928 20 10 CFCDHN COC[C@@H](C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-])OC ZINC000808714271 631033405 /nfs/dbraw/zinc/03/34/05/631033405.db2.gz UDJJRJYFFRADGO-CMPLNLGQSA-N 0 3 287.787 2.666 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2ccnn2C)c1[O-] ZINC000808715910 631034163 /nfs/dbraw/zinc/03/41/63/631034163.db2.gz YRAXOKDDWOXWQE-NSHDSACASA-N 0 3 293.798 2.981 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000840764358 631220500 /nfs/dbraw/zinc/22/05/00/631220500.db2.gz SHLVUVDDZYWUEQ-JLLWLGSASA-N 0 3 253.317 2.749 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1ccccc1[O-] ZINC000840886350 631250731 /nfs/dbraw/zinc/25/07/31/631250731.db2.gz CSOISBBEXDHCEK-SCRDCRAPSA-N 0 3 285.334 2.982 20 10 CFCDHN CCn1ccnc1NCc1c(O)cccc1Cl ZINC000840887232 631252381 /nfs/dbraw/zinc/25/23/81/631252381.db2.gz TZQRUEVOOCAQQS-UHFFFAOYSA-N 0 3 251.717 2.874 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(C)c2O)[C@@H](C)C1 ZINC000809698026 631267062 /nfs/dbraw/zinc/26/70/62/631267062.db2.gz UFMHLKHQQWXBPE-LBPRGKRZSA-N 0 3 282.815 2.880 20 10 CFCDHN COc1cc(CNCc2ccc(N(C)C)cc2C)ccn1 ZINC000840932474 631268035 /nfs/dbraw/zinc/26/80/35/631268035.db2.gz QUJBKKYBJWVNMR-UHFFFAOYSA-N 0 3 285.391 2.754 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000840956358 631283250 /nfs/dbraw/zinc/28/32/50/631283250.db2.gz REPXNQWORFFHHW-HOTGVXAUSA-N 0 3 269.344 2.700 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000840956358 631283257 /nfs/dbraw/zinc/28/32/57/631283257.db2.gz REPXNQWORFFHHW-HOTGVXAUSA-N 0 3 269.344 2.700 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C2CC(OCC)C2)c([O-])c1 ZINC000809774246 631287025 /nfs/dbraw/zinc/28/70/25/631287025.db2.gz PZDGCNLFJPIAGS-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C2CC(OCC)C2)c([O-])c1 ZINC000809774246 631287031 /nfs/dbraw/zinc/28/70/31/631287031.db2.gz PZDGCNLFJPIAGS-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CC)[C@@H](O)C(C)C)c([O-])c1 ZINC000840967456 631288208 /nfs/dbraw/zinc/28/82/08/631288208.db2.gz NMEMZYMNKYRUKM-HOCLYGCPSA-N 0 3 281.396 2.676 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cncn2C)c1[O-] ZINC000810243167 631348631 /nfs/dbraw/zinc/34/86/31/631348631.db2.gz MFDMUWCNYGOECV-SNVBAGLBSA-N 0 3 279.771 2.938 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1[O-])CN(C)C ZINC000841756822 631467614 /nfs/dbraw/zinc/46/76/14/631467614.db2.gz KLPRVRHYFXTMJH-GHMZBOCLSA-N 0 3 270.804 2.894 20 10 CFCDHN [NH3+]CC[C@@H]1CCCCN1Cc1c([O-])ccc(Cl)c1F ZINC000843123129 631843693 /nfs/dbraw/zinc/84/36/93/631843693.db2.gz HAPQUTKCXJHBQK-JTQLQIEISA-N 0 3 286.778 2.888 20 10 CFCDHN CC[C@@H]([NH2+]CCCOC[C@H]1CCOC1)c1ccccc1[O-] ZINC000155966876 650038880 /nfs/dbraw/zinc/03/88/80/650038880.db2.gz AKTPSIXFZSQHST-GDBMZVCRSA-N 0 3 293.407 2.876 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCc2ccccc2CC1 ZINC000156049720 650042142 /nfs/dbraw/zinc/04/21/42/650042142.db2.gz FTBFTPXMEDWJDZ-UHFFFAOYSA-N 0 3 253.345 2.993 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)CCSC)c([O-])c1 ZINC000843437494 631960458 /nfs/dbraw/zinc/96/04/58/631960458.db2.gz HPUPMUBJQQRWBK-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)CCSC)c([O-])c1 ZINC000843437494 631960460 /nfs/dbraw/zinc/96/04/60/631960460.db2.gz HPUPMUBJQQRWBK-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN COc1ccc(N(C)CCN(C)CCC(=O)C(C)C)cc1 ZINC000844400857 632194714 /nfs/dbraw/zinc/19/47/14/632194714.db2.gz FZGHWADGJCHERK-UHFFFAOYSA-N 0 3 292.423 2.678 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2ncccc2C)cc1 ZINC000844401002 632195687 /nfs/dbraw/zinc/19/56/87/632195687.db2.gz JICMOPPPDXJMPF-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CC[C@H]1CN(Cc2cc3c(cc2O)CCC3)[C@@H](C)CO1 ZINC000844729292 632290887 /nfs/dbraw/zinc/29/08/87/632290887.db2.gz HLUAKBQIZAIDSE-LRDDRELGSA-N 0 3 275.392 2.880 20 10 CFCDHN Cc1cc(C)c([C@H](C)NCc2cc(C)ncn2)c(O)c1 ZINC000815599263 632295743 /nfs/dbraw/zinc/29/57/43/632295743.db2.gz OUEIBVYLZKVWJN-ZDUSSCGKSA-N 0 3 271.364 2.958 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CC[C@H](O)CC2)c([O-])c1 ZINC000815598348 632295803 /nfs/dbraw/zinc/29/58/03/632295803.db2.gz SDHYAPIVXWFAHO-MGPQQGTHSA-N 0 3 263.381 2.963 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CNc2ccccc2C1 ZINC000844904867 632332099 /nfs/dbraw/zinc/33/20/99/632332099.db2.gz DGZIQECKODMFSN-AWEZNQCLSA-N 0 3 272.323 2.658 20 10 CFCDHN CCc1noc(C)c1CNCc1cc(OC)ccc1O ZINC000816638343 632499476 /nfs/dbraw/zinc/49/94/76/632499476.db2.gz JCCWBGFVHYXIHJ-UHFFFAOYSA-N 0 3 276.336 2.549 20 10 CFCDHN CC[C@@H]1CN(C)CCN1Cc1cc(Cl)cc(OC)c1O ZINC000816660699 632506468 /nfs/dbraw/zinc/50/64/68/632506468.db2.gz MQWRIRFXVDXDRF-CYBMUJFWSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000816675513 632509586 /nfs/dbraw/zinc/50/95/86/632509586.db2.gz CMRLELNRAIFUCZ-MRXNPFEDSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000816675513 632509588 /nfs/dbraw/zinc/50/95/88/632509588.db2.gz CMRLELNRAIFUCZ-MRXNPFEDSA-N 0 3 279.380 2.648 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](CCO)CC1 ZINC000817419749 632628287 /nfs/dbraw/zinc/62/82/87/632628287.db2.gz XGMLWUKERMLUIO-GFCCVEGCSA-N 0 3 267.344 2.516 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](CCO)CC1 ZINC000817419749 632628291 /nfs/dbraw/zinc/62/82/91/632628291.db2.gz XGMLWUKERMLUIO-GFCCVEGCSA-N 0 3 267.344 2.516 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](CCO)CC1 ZINC000817419751 632628683 /nfs/dbraw/zinc/62/86/83/632628683.db2.gz XGMLWUKERMLUIO-LBPRGKRZSA-N 0 3 267.344 2.516 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](CCO)CC1 ZINC000817419751 632628686 /nfs/dbraw/zinc/62/86/86/632628686.db2.gz XGMLWUKERMLUIO-LBPRGKRZSA-N 0 3 267.344 2.516 20 10 CFCDHN COc1cccc([C@@H](C)NCc2cccnc2OC)c1O ZINC000846139528 632643264 /nfs/dbraw/zinc/64/32/64/632643264.db2.gz UTPRUUZEOLJVMX-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cccc([C@H](C)NCc2cccc(C)n2)c1O ZINC000846143455 632645857 /nfs/dbraw/zinc/64/58/57/632645857.db2.gz ISOIAXGCNYLRBR-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cccc([C@H](C)N[C@H](CO)c2ccccc2)c1O ZINC000846143811 632645916 /nfs/dbraw/zinc/64/59/16/632645916.db2.gz HVTFPLLZVNZHPX-SWLSCSKDSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1cccc([C@H](C)N[C@@H]2CCCc3c[nH]nc32)c1O ZINC000846154730 632648736 /nfs/dbraw/zinc/64/87/36/632648736.db2.gz RQMUOCATXOIXAS-GXFFZTMASA-N 0 3 287.363 2.852 20 10 CFCDHN CON1CCC([NH2+][C@H](C)c2c(C)cc(C)cc2[O-])CC1 ZINC000817587264 632671540 /nfs/dbraw/zinc/67/15/40/632671540.db2.gz CXONCBVFNOMIQR-CYBMUJFWSA-N 0 3 278.396 2.685 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCC1(O)CCC1)CC2 ZINC000817585932 632671573 /nfs/dbraw/zinc/67/15/73/632671573.db2.gz JZCUWFAIFAJSPG-ZDUSSCGKSA-N 0 3 261.365 2.664 20 10 CFCDHN COC1([C@H](C)[NH2+][C@H](C)c2ccccc2[O-])CCOCC1 ZINC000817588024 632672025 /nfs/dbraw/zinc/67/20/25/632672025.db2.gz LGRZJWLWESVVIH-OLZOCXBDSA-N 0 3 279.380 2.627 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])CCOCC1 ZINC000817588025 632672392 /nfs/dbraw/zinc/67/23/92/632672392.db2.gz LGRZJWLWESVVIH-QWHCGFSZSA-N 0 3 279.380 2.627 20 10 CFCDHN C[C@H](N[C@@H]1CC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817944548 632747441 /nfs/dbraw/zinc/74/74/41/632747441.db2.gz GSKKCWFXNYMFLN-WCQYABFASA-N 0 3 256.349 2.558 20 10 CFCDHN C[C@@H](NC[C@@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817951386 632751451 /nfs/dbraw/zinc/75/14/51/632751451.db2.gz DXXMLFNAURYOHL-OCCSQVGLSA-N 0 3 270.376 2.948 20 10 CFCDHN N[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000817955347 632754909 /nfs/dbraw/zinc/75/49/09/632754909.db2.gz WBUMCQUWPKTBIK-HUUCEWRRSA-N 0 3 268.360 2.669 20 10 CFCDHN CC[C@@H](NCC[NH2+]C1CC1)c1cccc(Cl)c1[O-] ZINC000817954589 632755052 /nfs/dbraw/zinc/75/50/52/632755052.db2.gz ZLNFYUKYUDIBRD-CYBMUJFWSA-N 0 3 268.788 2.838 20 10 CFCDHN CCCC[C@H](CN)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000817961879 632761833 /nfs/dbraw/zinc/76/18/33/632761833.db2.gz FTBORAAFNRNWER-CMPLNLGQSA-N 0 3 254.349 2.699 20 10 CFCDHN CCC[NH2+]CCN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000817963651 632763303 /nfs/dbraw/zinc/76/33/03/632763303.db2.gz WTRVTMNAYNYLQJ-SNVBAGLBSA-N 0 3 256.777 2.696 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](N)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817965708 632763912 /nfs/dbraw/zinc/76/39/12/632763912.db2.gz UIRDUAOGHXZKTE-STQMWFEESA-N 0 3 268.788 2.824 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CN)c1cc(Cl)c(Cl)cc1[O-] ZINC000817970478 632769697 /nfs/dbraw/zinc/76/96/97/632769697.db2.gz WXVLXGRDFFXDLO-NKWVEPMBSA-N 0 3 263.168 2.697 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1NCCc2ccccc21)c1ccccc1[O-] ZINC000817973664 632773562 /nfs/dbraw/zinc/77/35/62/632773562.db2.gz GBEGMQMRTVAOAH-SUMWQHHRSA-N 0 3 282.387 2.930 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)N)c1ccc(C(F)(F)F)cc1[O-] ZINC000817973532 632773794 /nfs/dbraw/zinc/77/37/94/632773794.db2.gz UVOMQAVGPKNGBI-LDYMZIIASA-N 0 3 276.302 2.799 20 10 CFCDHN CCc1cccc(CN(C)Cc2ccc(OC)nc2)c1O ZINC000848901885 633389616 /nfs/dbraw/zinc/38/96/16/633389616.db2.gz FPRMHSKMMMLMCF-UHFFFAOYSA-N 0 3 286.375 2.990 20 10 CFCDHN CCc1cccc(CN2CCO[C@@]3(CCSC3)C2)c1O ZINC000848919290 633402063 /nfs/dbraw/zinc/40/20/63/633402063.db2.gz JGPPJSLLDPGNHH-INIZCTEOSA-N 0 3 293.432 2.663 20 10 CFCDHN Cc1cc(O)c(CN2CC3(CC3(F)F)C2)cc1C ZINC000848922292 633403974 /nfs/dbraw/zinc/40/39/74/633403974.db2.gz QBLKZPMLABCLAK-UHFFFAOYSA-N 0 3 253.292 2.850 20 10 CFCDHN CC(C)OC(=O)C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000848927696 633410971 /nfs/dbraw/zinc/41/09/71/633410971.db2.gz LGPCWKAJQJWTLA-CQSZACIVSA-N 0 3 297.370 2.987 20 10 CFCDHN COc1ccc(CNC(=[NH2+])NCc2ccc(C)cc2)c([O-])c1 ZINC000849095295 633485266 /nfs/dbraw/zinc/48/52/66/633485266.db2.gz RCFOENKMEIUOTK-UHFFFAOYSA-N 0 3 299.374 2.523 20 10 CFCDHN COc1ccc(N2CC[C@H]([NH2+]Cc3ccccc3[O-])C2)cc1 ZINC000850346849 633948475 /nfs/dbraw/zinc/94/84/75/633948475.db2.gz YQODGVOAHANPRK-HNNXBMFYSA-N 0 3 298.386 2.769 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3cncs3)C2)cc1 ZINC000850347618 633948995 /nfs/dbraw/zinc/94/89/95/633948995.db2.gz UZJSGCAUOVTMDL-GFCCVEGCSA-N 0 3 289.404 2.520 20 10 CFCDHN COC[C@H](NCc1ccccc1O)c1cccc(OC)c1 ZINC000850362624 633955979 /nfs/dbraw/zinc/95/59/79/633955979.db2.gz QPXWQIDEOAUUSR-INIZCTEOSA-N 0 3 287.359 2.878 20 10 CFCDHN COC[C@H]([NH2+]Cc1ccccc1[O-])c1cccc(OC)c1 ZINC000850362624 633955983 /nfs/dbraw/zinc/95/59/83/633955983.db2.gz QPXWQIDEOAUUSR-INIZCTEOSA-N 0 3 287.359 2.878 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2COC3(CCC3)C2)c([O-])c1 ZINC000850367371 633956919 /nfs/dbraw/zinc/95/69/19/633956919.db2.gz GHKZIZJTMJWBCU-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN O[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000850369548 633959571 /nfs/dbraw/zinc/95/95/71/633959571.db2.gz BAPIOJIDOUCCKF-IRXDYDNUSA-N 0 3 281.355 2.890 20 10 CFCDHN COc1cccc(CN[C@H]2C[C@@H](O)c3ccccc32)c1O ZINC000850370400 633959923 /nfs/dbraw/zinc/95/99/23/633959923.db2.gz DNMSLXZHXIEEBL-LSDHHAIUSA-N 0 3 285.343 2.669 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2ccoc2)c([O-])c1 ZINC000850377101 633964698 /nfs/dbraw/zinc/96/46/98/633964698.db2.gz XCMRSKQJIZBUNV-UHFFFAOYSA-N 0 3 261.321 2.716 20 10 CFCDHN C[C@H](O)[C@@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000850419475 633984427 /nfs/dbraw/zinc/98/44/27/633984427.db2.gz FQACUJDAJIPAFM-BLLLJJGKSA-N 0 3 257.333 2.604 20 10 CFCDHN CC[C@@H]([NH2+][C@H](COC)C1CCOCC1)c1ccccc1[O-] ZINC000850494906 634017512 /nfs/dbraw/zinc/01/75/12/634017512.db2.gz ZVXHBBQEMCZBOM-HZPDHXFCSA-N 0 3 293.407 2.875 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](C)=O)C1)c1ccccc1[O-] ZINC000850500664 634020309 /nfs/dbraw/zinc/02/03/09/634020309.db2.gz GECGYAJJUPIXCM-XUOCYBMCSA-N 0 3 281.421 2.733 20 10 CFCDHN Cn1ncc(C2CC2)c1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000850535150 634041380 /nfs/dbraw/zinc/04/13/80/634041380.db2.gz SBCVIURSUQGHGD-AWEZNQCLSA-N 0 3 283.375 2.780 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](CO)CC1CC1)c1ccccc1[O-] ZINC000850544172 634045816 /nfs/dbraw/zinc/04/58/16/634045816.db2.gz DCZLUSDCFQBSOZ-ZFWWWQNUSA-N 0 3 263.381 2.842 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)CC2CC2)c([O-])c1 ZINC000850546429 634047570 /nfs/dbraw/zinc/04/75/70/634047570.db2.gz ZQJLGNPEWNDVQN-TZMCWYRMSA-N 0 3 263.381 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cncc(C)n2)c([O-])c1 ZINC000850549616 634048511 /nfs/dbraw/zinc/04/85/11/634048511.db2.gz IARBWMCZSNPVMF-ZDUSSCGKSA-N 0 3 271.364 2.692 20 10 CFCDHN C[C@@H]([NH2+]CC1(CC(N)=O)CCCCC1)c1ccccc1[O-] ZINC000850573282 634058590 /nfs/dbraw/zinc/05/85/90/634058590.db2.gz KEFYTNVEIYIYKZ-CYBMUJFWSA-N 0 3 290.407 2.869 20 10 CFCDHN CC(=O)Nc1cccc(C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000109769109 634233734 /nfs/dbraw/zinc/23/37/34/634233734.db2.gz AWVHBTOOKOKZHV-UHFFFAOYSA-N 0 3 284.359 2.983 20 10 CFCDHN CC(=O)Nc1cccc(C[N@H+](C)Cc2ccccc2[O-])c1 ZINC000109769109 634233741 /nfs/dbraw/zinc/23/37/41/634233741.db2.gz AWVHBTOOKOKZHV-UHFFFAOYSA-N 0 3 284.359 2.983 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1cccc(F)c1 ZINC000109772715 634234969 /nfs/dbraw/zinc/23/49/69/634234969.db2.gz FAURKFRILJYELU-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1cccc(F)c1 ZINC000109772715 634234974 /nfs/dbraw/zinc/23/49/74/634234974.db2.gz FAURKFRILJYELU-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN COC(=O)c1cccc(C[N@H+](C)Cc2ccccc2[O-])c1 ZINC000111236324 634963294 /nfs/dbraw/zinc/96/32/94/634963294.db2.gz CAYGKYLONNQCOV-UHFFFAOYSA-N 0 3 285.343 2.811 20 10 CFCDHN COC(=O)c1cccc(C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000111236324 634963298 /nfs/dbraw/zinc/96/32/98/634963298.db2.gz CAYGKYLONNQCOV-UHFFFAOYSA-N 0 3 285.343 2.811 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@@H]2CC2(F)F)c([O-])c1 ZINC000856802151 635864478 /nfs/dbraw/zinc/86/44/78/635864478.db2.gz JQWXWJAXQJRHEX-LLVKDONJSA-N 0 3 271.307 2.926 20 10 CFCDHN CC(C)C[C@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858116937 636132296 /nfs/dbraw/zinc/13/22/96/636132296.db2.gz UBHJSWDJNHYPRY-LBPRGKRZSA-N 0 3 286.366 2.527 20 10 CFCDHN CC[C@H](C)[C@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135074 636135769 /nfs/dbraw/zinc/13/57/69/636135769.db2.gz LLTROYYQENCGDY-ZUZCIYMTSA-N 0 3 286.366 2.527 20 10 CFCDHN CC(C)[C@](C)(CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858166022 636146001 /nfs/dbraw/zinc/14/60/01/636146001.db2.gz WSHBZZAMRVXOJT-HNNXBMFYSA-N 0 3 286.366 2.527 20 10 CFCDHN CO[C@H]([C@@H](C)NCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858173648 636147187 /nfs/dbraw/zinc/14/71/87/636147187.db2.gz DXAFJPWMGGZCBZ-QLJPJBMISA-N 0 3 298.377 2.934 20 10 CFCDHN CN(C)c1cc(F)c(CNCCCC2(O)CCC2)cc1F ZINC000858180209 636148531 /nfs/dbraw/zinc/14/85/31/636148531.db2.gz NEBQJZWJVWULKX-UHFFFAOYSA-N 0 3 298.377 2.816 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC=C(C(=O)OC)C1)c1ccccc1[O-] ZINC000858473410 636260271 /nfs/dbraw/zinc/26/02/71/636260271.db2.gz NQVGSYGNOGYIES-JSGCOSHPSA-N 0 3 275.348 2.695 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)CC(F)F)c1ccccc1[O-] ZINC000858597094 636304575 /nfs/dbraw/zinc/30/45/75/636304575.db2.gz LBYSNGHFJHCQBG-GFCCVEGCSA-N 0 3 272.339 2.630 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)C[C@H]2CCCOC2)cc1F ZINC000862239643 637295958 /nfs/dbraw/zinc/29/59/58/637295958.db2.gz BNARAVOVCOMOKJ-GFCCVEGCSA-N 0 3 298.377 2.889 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC[C@@H](C)NC1)c1ccc(F)cc1[O-] ZINC000863546733 637692708 /nfs/dbraw/zinc/69/27/08/637692708.db2.gz NMKFIMSOHAPQJC-OSMZGAPFSA-N 0 3 266.360 2.713 20 10 CFCDHN Cc1cc([O-])c(CN[C@H]2CC[C@H](C)[NH2+]C2)c(Cl)c1 ZINC000863650301 637724859 /nfs/dbraw/zinc/72/48/59/637724859.db2.gz PXVVYPMXVZPMTC-QWRGUYRKSA-N 0 3 268.788 2.584 20 10 CFCDHN C[C@@H]1C[C@H](NCc2cc(F)c(N(C)C)cc2F)[C@H](C)O1 ZINC000864050591 637843755 /nfs/dbraw/zinc/84/37/55/637843755.db2.gz LCACRLURIKJLKM-BFVZDQMLSA-N 0 3 284.350 2.686 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190233707 650421067 /nfs/dbraw/zinc/42/10/67/650421067.db2.gz AQUUJFDLNFRTMG-OAHLLOKOSA-N 0 3 267.344 2.516 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190233707 650421070 /nfs/dbraw/zinc/42/10/70/650421070.db2.gz AQUUJFDLNFRTMG-OAHLLOKOSA-N 0 3 267.344 2.516 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CCC1)[C@@H]1CCCO1 ZINC000865735605 638544103 /nfs/dbraw/zinc/54/41/03/638544103.db2.gz RNUIDCONRNPLQH-JKSUJKDBSA-N 0 3 261.365 2.830 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@@H](CO)C2)c1[O-] ZINC000866415818 638817574 /nfs/dbraw/zinc/81/75/74/638817574.db2.gz FUBKHOKLMRJUPD-FOGDFJRCSA-N 0 3 269.772 2.776 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H](O)C(F)F)c1ccc(C)cc1[O-] ZINC000866442392 638821869 /nfs/dbraw/zinc/82/18/69/638821869.db2.gz KTXYURJBGCQGOA-VXGBXAGGSA-N 0 3 273.323 2.757 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1[C@H]2C[C@H]3CO[C@H]1[C@H]3C2)c1ccccc1[O-] ZINC000866444661 638822454 /nfs/dbraw/zinc/82/24/54/638822454.db2.gz JJAJIVBXKUVNFY-BZIPOHERSA-N 0 3 273.376 2.856 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H](O)C(F)(F)F ZINC000866463604 638825675 /nfs/dbraw/zinc/82/56/75/638825675.db2.gz BZIBKTRIRKJFBQ-OPQQBVKSSA-N 0 3 290.329 2.715 20 10 CFCDHN C[C@H](N[C@@H](C)[C@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000866463603 638825692 /nfs/dbraw/zinc/82/56/92/638825692.db2.gz BZIBKTRIRKJFBQ-KWBADKCTSA-N 0 3 290.329 2.715 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CC2(CO1)CCOCC2)c1ccccc1[O-] ZINC000866530869 638836649 /nfs/dbraw/zinc/83/66/49/638836649.db2.gz BRMNMLVSOYSIHL-ZIAGYGMSSA-N 0 3 291.391 2.629 20 10 CFCDHN COc1cccc(CNCCCSc2nccs2)n1 ZINC000191122549 650479788 /nfs/dbraw/zinc/47/97/88/650479788.db2.gz UOGGPLPCXRUFOM-UHFFFAOYSA-N 0 3 295.433 2.819 20 10 CFCDHN COc1ccc(N2CCN(Cc3cccc(N)c3)CC2)cc1 ZINC000020191857 642317886 /nfs/dbraw/zinc/31/78/86/642317886.db2.gz KHLJEJYBUBLIRX-UHFFFAOYSA-N 0 3 297.402 2.600 20 10 CFCDHN Cc1nn(C)cc1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000125527410 642663734 /nfs/dbraw/zinc/66/37/34/642663734.db2.gz QBFGPPZWSIZBRQ-LBPRGKRZSA-N 0 3 272.396 2.645 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000876591319 642936769 /nfs/dbraw/zinc/93/67/69/642936769.db2.gz GPNIHUWGGPMTAG-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN COC(=O)CCC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000876726565 642985068 /nfs/dbraw/zinc/98/50/68/642985068.db2.gz KHWUUMSSXDXNFZ-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN COCCCOC1CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000876754478 642995263 /nfs/dbraw/zinc/99/52/63/642995263.db2.gz DTZNMJJNLQDOKK-UHFFFAOYSA-N 0 3 293.407 2.718 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCC1CCOCC1 ZINC000876759578 642998334 /nfs/dbraw/zinc/99/83/34/642998334.db2.gz NREFWNGYCFCYCR-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCC1CCOCC1 ZINC000876759578 642998338 /nfs/dbraw/zinc/99/83/38/642998338.db2.gz NREFWNGYCFCYCR-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c([O-])c1 ZINC000876779544 643005531 /nfs/dbraw/zinc/00/55/31/643005531.db2.gz IWGFAKVSTFPZFO-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c([O-])c1 ZINC000876779544 643005543 /nfs/dbraw/zinc/00/55/43/643005543.db2.gz IWGFAKVSTFPZFO-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c([O-])c1 ZINC000876779545 643006127 /nfs/dbraw/zinc/00/61/27/643006127.db2.gz IWGFAKVSTFPZFO-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c([O-])c1 ZINC000876779545 643006142 /nfs/dbraw/zinc/00/61/42/643006142.db2.gz IWGFAKVSTFPZFO-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2ccccc2)c([O-])c1 ZINC000876890696 643054520 /nfs/dbraw/zinc/05/45/20/643054520.db2.gz HDTKBCVRMTWAJN-INIZCTEOSA-N 0 3 257.333 2.524 20 10 CFCDHN CC(C)CN1CCC([NH2+]Cc2ccc(F)c(F)c2[O-])CC1 ZINC000876925185 643066111 /nfs/dbraw/zinc/06/61/11/643066111.db2.gz WOJTWTDWAMLWJU-UHFFFAOYSA-N 0 3 298.377 2.880 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCN(C)CC(F)(F)F ZINC000876932362 643069348 /nfs/dbraw/zinc/06/93/48/643069348.db2.gz KMCWFPPCBNFYND-UHFFFAOYSA-N 0 3 290.329 2.674 20 10 CFCDHN COc1cc(C[C@@H](C)[NH2+]Cc2ccccc2[O-])ccn1 ZINC000876996539 643098567 /nfs/dbraw/zinc/09/85/67/643098567.db2.gz ZCDPPFWVWJWTON-GFCCVEGCSA-N 0 3 272.348 2.517 20 10 CFCDHN COc1cccc2c1OC[C@H]([NH2+]Cc1c(C)cccc1[O-])C2 ZINC000877007092 643102756 /nfs/dbraw/zinc/10/27/56/643102756.db2.gz CUPTXDKJVJPKNW-CQSZACIVSA-N 0 3 299.370 2.803 20 10 CFCDHN CC(=O)Nc1ccc(CC[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000877011697 643103427 /nfs/dbraw/zinc/10/34/27/643103427.db2.gz HEPKZSPSEQIWPY-UHFFFAOYSA-N 0 3 298.386 2.991 20 10 CFCDHN CC(C)N1CCC[C@@H](C[NH2+]Cc2ccc(F)c(F)c2[O-])C1 ZINC000877019598 643106309 /nfs/dbraw/zinc/10/63/09/643106309.db2.gz AJWSBKJIJCHYDZ-LBPRGKRZSA-N 0 3 298.377 2.880 20 10 CFCDHN COc1cc(CC[NH2+]Cc2ccc(C)cc2[O-])ccc1O ZINC000877046203 643118570 /nfs/dbraw/zinc/11/85/70/643118570.db2.gz IUFZEQCZNYWPQJ-UHFFFAOYSA-N 0 3 287.359 2.747 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)c1ccsc1 ZINC000877049215 643120482 /nfs/dbraw/zinc/12/04/82/643120482.db2.gz ROYIJZMUQRUXNN-AWEZNQCLSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2c(F)cccc2F)c([O-])c1 ZINC000877055181 643124376 /nfs/dbraw/zinc/12/43/76/643124376.db2.gz QNGSJCOVPQOAEZ-OAHLLOKOSA-N 0 3 293.313 2.802 20 10 CFCDHN CCC[C@H](CCO)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877065242 643130191 /nfs/dbraw/zinc/13/01/91/643130191.db2.gz KEBIQOJPYBCZLE-CYBMUJFWSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(CO)CCCCC1 ZINC000877082294 643141738 /nfs/dbraw/zinc/14/17/38/643141738.db2.gz OXGWXXTYEFFJTD-UHFFFAOYSA-N 0 3 263.381 2.733 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCCC[C@H]1O ZINC000877082241 643141860 /nfs/dbraw/zinc/14/18/60/643141860.db2.gz YYMWFMHIHHGEQQ-HZPDHXFCSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOc1ncccc1Cl ZINC000877084248 643142761 /nfs/dbraw/zinc/14/27/61/643142761.db2.gz DYOAFEKXTYCQRL-UHFFFAOYSA-N 0 3 292.766 2.918 20 10 CFCDHN Cc1cccc(O)c1CNCc1cn(C)nc1C(F)(F)F ZINC000877116612 643158689 /nfs/dbraw/zinc/15/86/89/643158689.db2.gz RGNQBZRTDPBYSE-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1ccc(CNCc2cn(C)nc2C(F)(F)F)c(O)c1 ZINC000877116587 643159100 /nfs/dbraw/zinc/15/91/00/643159100.db2.gz QQEWRTUPNMTELB-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@H](C(C)C)C1 ZINC000877136049 643170791 /nfs/dbraw/zinc/17/07/91/643170791.db2.gz WRURPAYRDLDZII-CJNGLKHVSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@@H](C(C)C)C1 ZINC000877136051 643170960 /nfs/dbraw/zinc/17/09/60/643170960.db2.gz WRURPAYRDLDZII-XJKSGUPXSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1ccc(C[NH2+]CCCc2nccs2)c([O-])c1 ZINC000877149173 643178461 /nfs/dbraw/zinc/17/84/61/643178461.db2.gz HHKYBRXAXZDTAN-UHFFFAOYSA-N 0 3 262.378 2.880 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000877167210 643184796 /nfs/dbraw/zinc/18/47/96/643184796.db2.gz QFBVKEYGJGUPCC-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000877167210 643184803 /nfs/dbraw/zinc/18/48/03/643184803.db2.gz QFBVKEYGJGUPCC-ZFWWWQNUSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCc1ccccn1 ZINC000877317852 643235275 /nfs/dbraw/zinc/23/52/75/643235275.db2.gz CULDOJKKNLSOLF-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCc1ccccn1 ZINC000877317852 643235281 /nfs/dbraw/zinc/23/52/81/643235281.db2.gz CULDOJKKNLSOLF-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCSC3(CCOCC3)C2)c([O-])c1 ZINC000877401895 643260588 /nfs/dbraw/zinc/26/05/88/643260588.db2.gz RCFOPDNONHNLJY-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN Cc1ccc(C[N@H+]2CCSC3(CCOCC3)C2)c([O-])c1 ZINC000877401895 643260594 /nfs/dbraw/zinc/26/05/94/643260594.db2.gz RCFOPDNONHNLJY-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN CO[C@@H](CC[NH2+]Cc1ccc(C)cc1[O-])C(F)(F)F ZINC000877466527 643286730 /nfs/dbraw/zinc/28/67/30/643286730.db2.gz LVMGTWQJSCSAJV-LBPRGKRZSA-N 0 3 277.286 2.758 20 10 CFCDHN CC(C)(C[NH2+]Cc1ccc(F)c(F)c1[O-])CN1CCCC1 ZINC000877473742 643292057 /nfs/dbraw/zinc/29/20/57/643292057.db2.gz LUDLJRYARYEHHO-UHFFFAOYSA-N 0 3 298.377 2.882 20 10 CFCDHN CC(C)(CNCc1ccc(F)c(F)c1[O-])C[NH+]1CCCC1 ZINC000877473742 643292061 /nfs/dbraw/zinc/29/20/61/643292061.db2.gz LUDLJRYARYEHHO-UHFFFAOYSA-N 0 3 298.377 2.882 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c([O-])c1 ZINC000877508300 643318081 /nfs/dbraw/zinc/31/80/81/643318081.db2.gz WKSWIZYONPURGP-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c([O-])c1 ZINC000877508300 643318087 /nfs/dbraw/zinc/31/80/87/643318087.db2.gz WKSWIZYONPURGP-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(CO)C[C@H]1c1ccccc1 ZINC000877539962 643342990 /nfs/dbraw/zinc/34/29/90/643342990.db2.gz REEYZPANRXQHEF-HKUYNNGSSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c([O-])c1 ZINC000877543965 643346371 /nfs/dbraw/zinc/34/63/71/643346371.db2.gz NYSMEATWKSRVFT-MRXNPFEDSA-N 0 3 277.408 2.977 20 10 CFCDHN Cc1cccc(O)c1CN1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000877555171 643355441 /nfs/dbraw/zinc/35/54/41/643355441.db2.gz RTVBHSFEPLWVHG-DLBZAZTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ncsc1CC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877565355 643365168 /nfs/dbraw/zinc/36/51/68/643365168.db2.gz XIXUZBLLNZRPOU-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877566360 643366594 /nfs/dbraw/zinc/36/65/94/643366594.db2.gz HPXFCJRTXKJGJM-KGLIPLIRSA-N 0 3 277.364 2.522 20 10 CFCDHN COCC1CCC([NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000877590360 643383697 /nfs/dbraw/zinc/38/36/97/643383697.db2.gz YZVVSTAMFQWRQH-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1c(C)cccc1[O-])CC(C)C ZINC000877593222 643386160 /nfs/dbraw/zinc/38/61/60/643386160.db2.gz QMNWBGZTJPMLPI-CYBMUJFWSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CC2)C2CCOCC2)c([O-])c1 ZINC000877610482 643396772 /nfs/dbraw/zinc/39/67/72/643396772.db2.gz PRNKUOJYMSMJML-KRWDZBQOSA-N 0 3 275.392 2.995 20 10 CFCDHN CC[C@@H](COCC1CC1)[NH2+]Cc1c(C)cccc1[O-] ZINC000877622184 643409581 /nfs/dbraw/zinc/40/95/81/643409581.db2.gz HWNWWTLUYFILCL-AWEZNQCLSA-N 0 3 263.381 2.995 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](OCc2ccccn2)C1 ZINC000877645771 643428431 /nfs/dbraw/zinc/42/84/31/643428431.db2.gz WGQOUWQBJYSLLH-INIZCTEOSA-N 0 3 284.359 2.578 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](OCc2ccccn2)C1 ZINC000877645771 643428435 /nfs/dbraw/zinc/42/84/35/643428435.db2.gz WGQOUWQBJYSLLH-INIZCTEOSA-N 0 3 284.359 2.578 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)c([O-])c1 ZINC000877709676 643476009 /nfs/dbraw/zinc/47/60/09/643476009.db2.gz GDVXFOWBYHMHQJ-RDJZCZTQSA-N 0 3 275.392 2.995 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000877715998 643480262 /nfs/dbraw/zinc/48/02/62/643480262.db2.gz OFMZTTAKJPSPAF-MRXNPFEDSA-N 0 3 295.386 2.772 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000877715998 643480269 /nfs/dbraw/zinc/48/02/69/643480269.db2.gz OFMZTTAKJPSPAF-MRXNPFEDSA-N 0 3 295.386 2.772 20 10 CFCDHN CN1CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000877740169 643507979 /nfs/dbraw/zinc/50/79/79/643507979.db2.gz IVVOZZJZSZPXOE-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@H]21 ZINC000877740169 643507988 /nfs/dbraw/zinc/50/79/88/643507988.db2.gz IVVOZZJZSZPXOE-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN Oc1ccccc1CN1CCN(c2cccc(F)c2)CC1 ZINC000877745443 643525012 /nfs/dbraw/zinc/52/50/12/643525012.db2.gz VAUOVJSKRRPDOT-UHFFFAOYSA-N 0 3 286.350 2.854 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCN(c2cccc(F)c2)CC1 ZINC000877745443 643525017 /nfs/dbraw/zinc/52/50/17/643525017.db2.gz VAUOVJSKRRPDOT-UHFFFAOYSA-N 0 3 286.350 2.854 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccccc1[O-] ZINC000877755666 643535370 /nfs/dbraw/zinc/53/53/70/643535370.db2.gz KUEUYKHNWONHDH-OLZOCXBDSA-N 0 3 262.397 2.916 20 10 CFCDHN COC(=O)c1oc(CN[C@H](C)c2ccccc2O)cc1C ZINC000877755483 643535772 /nfs/dbraw/zinc/53/57/72/643535772.db2.gz CGBNXHVMOYRMJT-LLVKDONJSA-N 0 3 289.331 2.931 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccn(C(F)F)c1=O)c1ccccc1[O-] ZINC000877755652 643536034 /nfs/dbraw/zinc/53/60/34/643536034.db2.gz JYLBQVBEODNYON-SNVBAGLBSA-N 0 3 294.301 2.800 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2ccccc2O)n1 ZINC000877757086 643537145 /nfs/dbraw/zinc/53/71/45/643537145.db2.gz FPMQBFSPWSNTBZ-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc2c(cnn2C)c1)c1ccccc1[O-] ZINC000877758264 643538510 /nfs/dbraw/zinc/53/85/10/643538510.db2.gz PUAAFYNHICDAGZ-NSHDSACASA-N 0 3 282.347 2.525 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877818005 643582027 /nfs/dbraw/zinc/58/20/27/643582027.db2.gz WCTNNDPBYYLAHG-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877818005 643582032 /nfs/dbraw/zinc/58/20/32/643582032.db2.gz WCTNNDPBYYLAHG-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000877826391 643592596 /nfs/dbraw/zinc/59/25/96/643592596.db2.gz CSCDWXDNURKQCP-MJHDQNEOSA-N 0 3 295.354 2.741 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)CC1CCCC1)c1ccccc1[O-] ZINC000879648900 644363017 /nfs/dbraw/zinc/36/30/17/644363017.db2.gz FLGTWYSHQPSPBM-OCCSQVGLSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC[C@@H](C)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651768 644364680 /nfs/dbraw/zinc/36/46/80/644364680.db2.gz JZDBDEVEEJZEAP-FRRDWIJNSA-N 0 3 278.396 2.736 20 10 CFCDHN CC(C)CN(C(=O)C[NH2+][C@@H](C)c1ccccc1[O-])C1CC1 ZINC000879650965 644364785 /nfs/dbraw/zinc/36/47/85/644364785.db2.gz AFHODKRAGFEOIU-ZDUSSCGKSA-N 0 3 290.407 2.690 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000128316135 644613958 /nfs/dbraw/zinc/61/39/58/644613958.db2.gz XXJRQTGNXGVFSF-FOSCPWQOSA-N 0 3 280.799 2.760 20 10 CFCDHN CC[C@H]([NH2+]CC(=O)NCc1ccccc1)c1ccccc1[O-] ZINC000128572044 644813936 /nfs/dbraw/zinc/81/39/36/644813936.db2.gz CEGDYPFCIKMCGW-INIZCTEOSA-N 0 3 298.386 2.749 20 10 CFCDHN COC[C@@H](C)C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000249208345 650956188 /nfs/dbraw/zinc/95/61/88/650956188.db2.gz XCGAZIWQVPCZEY-GOEBONIOSA-N 0 3 293.407 2.656 20 10 CFCDHN COC[C@@H](C)C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000249208345 650956191 /nfs/dbraw/zinc/95/61/91/650956191.db2.gz XCGAZIWQVPCZEY-GOEBONIOSA-N 0 3 293.407 2.656 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1cc(F)ccc1[O-] ZINC000094798227 650963742 /nfs/dbraw/zinc/96/37/42/650963742.db2.gz FASZKKCFJXYHQP-QMTHXVAHSA-N 0 3 253.317 2.751 20 10 CFCDHN Oc1cc2c(cc1CN1CCOC3(CCC3)C1)CCC2 ZINC000129686761 645345542 /nfs/dbraw/zinc/34/55/42/645345542.db2.gz ZGUGSXBXFFFWLU-UHFFFAOYSA-N 0 3 273.376 2.636 20 10 CFCDHN C[C@H]1COCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000025480331 645420391 /nfs/dbraw/zinc/42/03/91/645420391.db2.gz LHVIHMVDANSXNO-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@H]1COCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000025480331 645420395 /nfs/dbraw/zinc/42/03/95/645420395.db2.gz LHVIHMVDANSXNO-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@H]1COCCN1Cc1c(O)ccc2ccccc21 ZINC000025480331 645420397 /nfs/dbraw/zinc/42/03/97/645420397.db2.gz LHVIHMVDANSXNO-LBPRGKRZSA-N 0 3 257.333 2.766 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1ccccc1[O-] ZINC000883277474 645718988 /nfs/dbraw/zinc/71/89/88/645718988.db2.gz ZZVJYPBXINKGKY-GOEBONIOSA-N 0 3 289.375 2.877 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000883364434 645771440 /nfs/dbraw/zinc/77/14/40/645771440.db2.gz GJQASXXERAJING-LBPRGKRZSA-N 0 3 277.364 2.592 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CC[C@H](C2CC2)O1 ZINC000886064418 646850575 /nfs/dbraw/zinc/85/05/75/646850575.db2.gz DJZJMVJAFJHUBR-GDBMZVCRSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CC[C@H](C2CC2)O1 ZINC000886064418 646850582 /nfs/dbraw/zinc/85/05/82/646850582.db2.gz DJZJMVJAFJHUBR-GDBMZVCRSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886064419 646850992 /nfs/dbraw/zinc/85/09/92/646850992.db2.gz DJZJMVJAFJHUBR-GOEBONIOSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886064419 646850994 /nfs/dbraw/zinc/85/09/94/646850994.db2.gz DJZJMVJAFJHUBR-GOEBONIOSA-N 0 3 261.365 2.782 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@@H](C)c2c([O-])cccc2F)C1 ZINC000886506131 647023626 /nfs/dbraw/zinc/02/36/26/647023626.db2.gz CZLFYRHDMZGDQD-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CC3(CCC3)CO1)CC2 ZINC000886701828 647116836 /nfs/dbraw/zinc/11/68/36/647116836.db2.gz WJUWVXLPFOKNKL-ZIAGYGMSSA-N 0 3 273.376 2.928 20 10 CFCDHN [O-]c1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@H]1CNOC1 ZINC000925869687 648349607 /nfs/dbraw/zinc/34/96/07/648349607.db2.gz OUXMQYBPSJFZDV-DOTOQJQBSA-N 0 3 298.386 2.559 20 10 CFCDHN Cc1cc(CC[NH2+][C@@H](C)c2ccc(C)cc2[O-])nn1C ZINC000926910017 648653769 /nfs/dbraw/zinc/65/37/69/648653769.db2.gz IMWAMPBOAMRAGQ-ZDUSSCGKSA-N 0 3 273.380 2.636 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])[C@@H](CC)CO ZINC000930350696 649235859 /nfs/dbraw/zinc/23/58/59/649235859.db2.gz JDPMVZXXXDOIBX-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](CC)CO ZINC000930350696 649235863 /nfs/dbraw/zinc/23/58/63/649235863.db2.gz JDPMVZXXXDOIBX-AWEZNQCLSA-N 0 3 251.370 2.765 20 10 CFCDHN CC(C)N(CC[NH3+])Cc1cc(Cl)c(Cl)cc1[O-] ZINC001235947749 778621914 /nfs/dbraw/zinc/62/19/14/778621914.db2.gz PQRUWVQDEDZGLW-UHFFFAOYSA-N 0 3 277.195 2.868 20 10 CFCDHN CC(C)[N@H+](CCN)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001235947749 778621917 /nfs/dbraw/zinc/62/19/17/778621917.db2.gz PQRUWVQDEDZGLW-UHFFFAOYSA-N 0 3 277.195 2.868 20 10 CFCDHN CC(C)[N@@H+](CCN)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001235947749 778621921 /nfs/dbraw/zinc/62/19/21/778621921.db2.gz PQRUWVQDEDZGLW-UHFFFAOYSA-N 0 3 277.195 2.868 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccccc1[O-] ZINC000693890350 775231166 /nfs/dbraw/zinc/23/11/66/775231166.db2.gz PQHQJAYFRKJEDB-OLZOCXBDSA-N 0 3 262.397 2.916 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3OCC[C@H]3C2)c1[O-] ZINC000724814576 775361980 /nfs/dbraw/zinc/36/19/80/775361980.db2.gz ROUHLDMEZNCYLV-GWCFXTLKSA-N 0 3 297.782 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H]3OCC[C@H]3C2)c1[O-] ZINC000724814576 775361993 /nfs/dbraw/zinc/36/19/93/775361993.db2.gz ROUHLDMEZNCYLV-GWCFXTLKSA-N 0 3 297.782 2.665 20 10 CFCDHN C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588303 777268134 /nfs/dbraw/zinc/26/81/34/777268134.db2.gz PBFSBLBSEPDNCJ-OCCSQVGLSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1CC[C@H](O)C[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588303 777268137 /nfs/dbraw/zinc/26/81/37/777268137.db2.gz PBFSBLBSEPDNCJ-OCCSQVGLSA-N 0 3 271.360 2.891 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589352 777268470 /nfs/dbraw/zinc/26/84/70/777268470.db2.gz HABUPTJRQYAZPZ-HNNXBMFYSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589352 777268473 /nfs/dbraw/zinc/26/84/73/777268473.db2.gz HABUPTJRQYAZPZ-HNNXBMFYSA-N 0 3 298.386 2.598 20 10 CFCDHN CCNC(=O)[C@@H]1CCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231589030 777269427 /nfs/dbraw/zinc/26/94/27/777269427.db2.gz BARBAZRTFWREPT-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN CCNC(=O)[C@@H]1CCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231589030 777269435 /nfs/dbraw/zinc/26/94/35/777269435.db2.gz BARBAZRTFWREPT-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H](CO)C[C@H](F)C1 ZINC001231587357 777269715 /nfs/dbraw/zinc/26/97/15/777269715.db2.gz ACTACVPMPOARDA-OCCSQVGLSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H](CO)C[C@H](F)C1 ZINC001231587357 777269721 /nfs/dbraw/zinc/26/97/21/777269721.db2.gz ACTACVPMPOARDA-OCCSQVGLSA-N 0 3 289.350 2.698 20 10 CFCDHN COc1cc(CN2CCc3ccc(C)cc3C2)c(O)cc1O ZINC001231635055 777286801 /nfs/dbraw/zinc/28/68/01/777286801.db2.gz UQNORYYEICABJI-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN Cc1cc(C)c(CN2CCc3ncccc3C2)c(O)c1 ZINC001231846797 777348088 /nfs/dbraw/zinc/34/80/88/777348088.db2.gz PLAVJZYIICKGCL-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN Cc1cc(C)c(CN2CC(N3CCC(F)CC3)C2)c(O)c1 ZINC001231847365 777349205 /nfs/dbraw/zinc/34/92/05/777349205.db2.gz XYBLGVMLQVTPOU-UHFFFAOYSA-N 0 3 292.398 2.627 20 10 CFCDHN CC[N@@H+]1CCCN(Cc2cc(Cl)c(C)cc2[O-])CC1 ZINC001231869688 777358743 /nfs/dbraw/zinc/35/87/43/777358743.db2.gz WDPBLECBBZURRH-UHFFFAOYSA-N 0 3 282.815 2.882 20 10 CFCDHN CC[N@H+]1CCCN(Cc2cc(Cl)c(C)cc2[O-])CC1 ZINC001231869688 777358745 /nfs/dbraw/zinc/35/87/45/777358745.db2.gz WDPBLECBBZURRH-UHFFFAOYSA-N 0 3 282.815 2.882 20 10 CFCDHN [O-]c1c(C[N@@H+]2C[C@H](CO)C[C@H](F)C2)ccc2ccccc12 ZINC001231879617 777363343 /nfs/dbraw/zinc/36/33/43/777363343.db2.gz KWJLIOHSYHSTRS-DOMZBBRYSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1c(C[N@H+]2C[C@H](CO)C[C@H](F)C2)ccc2ccccc12 ZINC001231879617 777363346 /nfs/dbraw/zinc/36/33/46/777363346.db2.gz KWJLIOHSYHSTRS-DOMZBBRYSA-N 0 3 289.350 2.698 20 10 CFCDHN Cc1nc2ccc(NCCc3cc(O)c(O)cc3O)cc2[nH]1 ZINC001168008872 777595877 /nfs/dbraw/zinc/59/58/77/777595877.db2.gz FUISLRCCAHAUGR-UHFFFAOYSA-N 0 3 299.330 2.643 20 10 CFCDHN CC1([NH3+])CN(Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001204986263 777662018 /nfs/dbraw/zinc/66/20/18/777662018.db2.gz USUSBDJPNSNMCM-UHFFFAOYSA-N 0 3 268.360 2.592 20 10 CFCDHN Oc1cc(CN2CC[C@H](Cc3ccccc3)C2)cc(O)c1O ZINC001233013225 777764580 /nfs/dbraw/zinc/76/45/80/777764580.db2.gz NQYKNDSXPJIIBW-CQSZACIVSA-N 0 3 299.370 2.868 20 10 CFCDHN CC(C)(C)c1ccc(O)c(CN2CCN(C3CC3)CC2)c1 ZINC001233283944 777864775 /nfs/dbraw/zinc/86/47/75/777864775.db2.gz BOZWDVBJVGMYKV-UHFFFAOYSA-N 0 3 288.435 2.970 20 10 CFCDHN CN(C/C=C/c1ccccc1)Cc1cc(O)c(O)cc1O ZINC001233486176 777963550 /nfs/dbraw/zinc/96/35/50/777963550.db2.gz BIMDXCXPJIXQNS-VMPITWQZSA-N 0 3 285.343 2.949 20 10 CFCDHN C[C@H]1CN(Cc2cc(O)c(O)cc2O)Cc2ccccc21 ZINC001233483450 777964241 /nfs/dbraw/zinc/96/42/41/777964241.db2.gz ZMTALARYMSDHLK-NSHDSACASA-N 0 3 285.343 2.923 20 10 CFCDHN COc1ccc2c(c1)C[C@H]([N@@H+]1CCc3cccc([O-])c3C1)C2 ZINC001168283036 778392883 /nfs/dbraw/zinc/39/28/83/778392883.db2.gz OISKCGBEQVGSOA-MRXNPFEDSA-N 0 3 295.382 2.926 20 10 CFCDHN COc1ccc2c(c1)C[C@H]([N@H+]1CCc3cccc([O-])c3C1)C2 ZINC001168283036 778392888 /nfs/dbraw/zinc/39/28/88/778392888.db2.gz OISKCGBEQVGSOA-MRXNPFEDSA-N 0 3 295.382 2.926 20 10 CFCDHN [O-]c1c(CN2CCC[C@@H]3[NH2+]C[C@@H]32)cccc1-c1ccccc1 ZINC001235303296 778451461 /nfs/dbraw/zinc/45/14/61/778451461.db2.gz KMJLCXOHCVIDJF-ROUUACIJSA-N 0 3 294.398 2.995 20 10 CFCDHN CC(C)(C)c1ccc(C[NH+]2CCC(O)CC2)c([O-])c1 ZINC001235674254 778532359 /nfs/dbraw/zinc/53/23/59/778532359.db2.gz DZODVAZKZQIINN-UHFFFAOYSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](F)[C@H](O)C2)c([O-])c1 ZINC001235674960 778532892 /nfs/dbraw/zinc/53/28/92/778532892.db2.gz JTTJYTPPLQNCGZ-DZGCQCFKSA-N 0 3 281.371 2.594 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@H](F)[C@H](O)C2)c([O-])c1 ZINC001235674960 778532898 /nfs/dbraw/zinc/53/28/98/778532898.db2.gz JTTJYTPPLQNCGZ-DZGCQCFKSA-N 0 3 281.371 2.594 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2CSC2)c1[O-] ZINC000697978973 778608334 /nfs/dbraw/zinc/60/83/34/778608334.db2.gz PESJSIHXCFZVER-UHFFFAOYSA-N 0 3 273.785 2.507 20 10 CFCDHN CCN(Cc1ccc(Cl)cc1[O-])[C@H]1CCC[NH2+]C1 ZINC001236007033 778651712 /nfs/dbraw/zinc/65/17/12/778651712.db2.gz MFOSTKDXETWQPL-ZDUSSCGKSA-N 0 3 268.788 2.620 20 10 CFCDHN CC(C)C(C)(C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000698035208 778653537 /nfs/dbraw/zinc/65/35/37/778653537.db2.gz XERQFNJWNJYVMN-UHFFFAOYSA-N 0 3 251.326 2.645 20 10 CFCDHN [O-]c1cccc(Cl)c1CN(C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238340 778747554 /nfs/dbraw/zinc/74/75/54/778747554.db2.gz CLVKMVFUHHVFGP-LBPRGKRZSA-N 0 3 280.799 2.762 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236782378 778933624 /nfs/dbraw/zinc/93/36/24/778933624.db2.gz ATZDCZZGTQSGJL-NVXWUHKLSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236782378 778933628 /nfs/dbraw/zinc/93/36/28/778933628.db2.gz ATZDCZZGTQSGJL-NVXWUHKLSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@@H]2COC)c([O-])c1 ZINC001236783655 778934978 /nfs/dbraw/zinc/93/49/78/778934978.db2.gz NVIBBRHAMBDZRY-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@@H]2COC)c([O-])c1 ZINC001236783655 778934981 /nfs/dbraw/zinc/93/49/81/778934981.db2.gz NVIBBRHAMBDZRY-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001236786619 778935552 /nfs/dbraw/zinc/93/55/52/778935552.db2.gz DDAVSYJFNBNFDR-HIFRSBDPSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001236786619 778935556 /nfs/dbraw/zinc/93/55/56/778935556.db2.gz DDAVSYJFNBNFDR-HIFRSBDPSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c([O-])c1 ZINC001236791253 778937776 /nfs/dbraw/zinc/93/77/76/778937776.db2.gz FORNPVAHSNPTHB-ULAZLLGUSA-N 0 3 273.376 2.564 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c([O-])c1 ZINC001236791253 778937783 /nfs/dbraw/zinc/93/77/83/778937783.db2.gz FORNPVAHSNPTHB-ULAZLLGUSA-N 0 3 273.376 2.564 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](CCC(=O)OC)C2)c([O-])c1 ZINC001236795075 778940775 /nfs/dbraw/zinc/94/07/75/778940775.db2.gz QUDRYAMUFRHRDN-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](CCC(=O)OC)C2)c([O-])c1 ZINC001236795075 778940782 /nfs/dbraw/zinc/94/07/82/778940782.db2.gz QUDRYAMUFRHRDN-AWEZNQCLSA-N 0 3 291.391 2.730 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001236806957 778946598 /nfs/dbraw/zinc/94/65/98/778946598.db2.gz CZLXXHPBBVDSJU-QGZVFWFLSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001236806957 778946602 /nfs/dbraw/zinc/94/66/02/778946602.db2.gz CZLXXHPBBVDSJU-QGZVFWFLSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(CN(C)Cc2ccncc2)c(O)c1 ZINC001236807397 778947030 /nfs/dbraw/zinc/94/70/30/778947030.db2.gz GPYFWLBYSIDPPV-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001236808085 778948442 /nfs/dbraw/zinc/94/84/42/778948442.db2.gz LYTIXPIDTNMWFA-QGZVFWFLSA-N 0 3 293.407 2.694 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001236808085 778948446 /nfs/dbraw/zinc/94/84/46/778948446.db2.gz LYTIXPIDTNMWFA-QGZVFWFLSA-N 0 3 293.407 2.694 20 10 CFCDHN COc1cc(C)c(CN2CCOC[C@H]2C(C)C)c(O)c1 ZINC001236811351 778949221 /nfs/dbraw/zinc/94/92/21/778949221.db2.gz RAOFMCJUAHWGAT-HNNXBMFYSA-N 0 3 279.380 2.566 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236816954 778952601 /nfs/dbraw/zinc/95/26/01/778952601.db2.gz ZMQUBMMZKZSZLN-CXAGYDPISA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236816954 778952606 /nfs/dbraw/zinc/95/26/06/778952606.db2.gz ZMQUBMMZKZSZLN-CXAGYDPISA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(CN2CC3(C2)C[C@@H](F)CS3)c(O)c1 ZINC001236822145 778954210 /nfs/dbraw/zinc/95/42/10/778954210.db2.gz YCFILJWBLYEURF-LLVKDONJSA-N 0 3 297.395 2.739 20 10 CFCDHN OC[C@@H]1C[C@@H](F)CN(Cc2cc3ccccc3cc2O)C1 ZINC001236826185 778954968 /nfs/dbraw/zinc/95/49/68/778954968.db2.gz HUTQTKXXGHFJRH-MLGOLLRUSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@H](F)C[C@@H](CO)C1 ZINC001236826185 778954970 /nfs/dbraw/zinc/95/49/70/778954970.db2.gz HUTQTKXXGHFJRH-MLGOLLRUSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@H](F)C[C@@H](CO)C1 ZINC001236826185 778954976 /nfs/dbraw/zinc/95/49/76/778954976.db2.gz HUTQTKXXGHFJRH-MLGOLLRUSA-N 0 3 289.350 2.698 20 10 CFCDHN C[C@@H]1C[C@H](O)CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832650 778958171 /nfs/dbraw/zinc/95/81/71/778958171.db2.gz JWUAMLQYLKZNTC-MLGOLLRUSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1C[C@H](O)CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832650 778958176 /nfs/dbraw/zinc/95/81/76/778958176.db2.gz JWUAMLQYLKZNTC-MLGOLLRUSA-N 0 3 271.360 2.891 20 10 CFCDHN CN1CC[C@H]([N@H+](C)Cc2cc3ccccc3cc2[O-])C1 ZINC001236841565 778962330 /nfs/dbraw/zinc/96/23/30/778962330.db2.gz KZWQNUPOMRCOTN-INIZCTEOSA-N 0 3 270.376 2.681 20 10 CFCDHN CN1CC[C@H]([N@@H+](C)Cc2cc3ccccc3cc2[O-])C1 ZINC001236841565 778962332 /nfs/dbraw/zinc/96/23/32/778962332.db2.gz KZWQNUPOMRCOTN-INIZCTEOSA-N 0 3 270.376 2.681 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044786 778997140 /nfs/dbraw/zinc/99/71/40/778997140.db2.gz DKBYZOVGWMEZJG-OAHLLOKOSA-N 0 3 291.391 2.901 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044786 778997142 /nfs/dbraw/zinc/99/71/42/778997142.db2.gz DKBYZOVGWMEZJG-OAHLLOKOSA-N 0 3 291.391 2.901 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)C[C@H]2C)c([O-])c1 ZINC001237050209 779000544 /nfs/dbraw/zinc/00/05/44/779000544.db2.gz YYVJJPHOIOFFOA-IUODEOHRSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2C)c([O-])c1 ZINC001237050209 779000549 /nfs/dbraw/zinc/00/05/49/779000549.db2.gz YYVJJPHOIOFFOA-IUODEOHRSA-N 0 3 263.381 2.861 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@](C)(O)C2)c([O-])c1 ZINC001237049455 779000726 /nfs/dbraw/zinc/00/07/26/779000726.db2.gz GABNGOQUTKNNLW-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@](C)(O)C2)c([O-])c1 ZINC001237049455 779000732 /nfs/dbraw/zinc/00/07/32/779000732.db2.gz GABNGOQUTKNNLW-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN C[C@@H]1CCN(Cc2cc(C(F)(F)F)ccc2O)C[C@@H]1O ZINC001237135661 779023796 /nfs/dbraw/zinc/02/37/96/779023796.db2.gz KJPQKRPVVPCXCR-RNCFNFMXSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@H]1C[C@H](O)CCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237141346 779025168 /nfs/dbraw/zinc/02/51/68/779025168.db2.gz VZGVYCUYPKTLBP-JOYOIKCWSA-N 0 3 289.297 2.756 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237405483 779098494 /nfs/dbraw/zinc/09/84/94/779098494.db2.gz QTADSORATFSDOU-FZMZJTMJSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1Cl ZINC001237406362 779099729 /nfs/dbraw/zinc/09/97/29/779099729.db2.gz UMPFPCUXNGPJQM-IUODEOHRSA-N 0 3 294.826 2.928 20 10 CFCDHN COC[C@@]12CCC[C@@H]1C[N@H+](Cc1c(C)cccc1[O-])C2 ZINC001237487799 779119493 /nfs/dbraw/zinc/11/94/93/779119493.db2.gz DLDJXJUOWLIGDA-PBHICJAKSA-N 0 3 275.392 2.949 20 10 CFCDHN COC[C@@]12CCC[C@@H]1C[N@@H+](Cc1c(C)cccc1[O-])C2 ZINC001237487799 779119498 /nfs/dbraw/zinc/11/94/98/779119498.db2.gz DLDJXJUOWLIGDA-PBHICJAKSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H](O)C2)c1[O-] ZINC001237680768 779160120 /nfs/dbraw/zinc/16/01/20/779160120.db2.gz HDGHMDOXNZPIEW-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H](O)C2)c1[O-] ZINC001237680768 779160124 /nfs/dbraw/zinc/16/01/24/779160124.db2.gz HDGHMDOXNZPIEW-ZDUSSCGKSA-N 0 3 269.772 2.701 20 10 CFCDHN COC(=O)[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1C ZINC001237690732 779162966 /nfs/dbraw/zinc/16/29/66/779162966.db2.gz SHARUFGHOCJGGA-GWCFXTLKSA-N 0 3 297.782 2.595 20 10 CFCDHN COC(=O)[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@@H]1C ZINC001237690732 779162970 /nfs/dbraw/zinc/16/29/70/779162970.db2.gz SHARUFGHOCJGGA-GWCFXTLKSA-N 0 3 297.782 2.595 20 10 CFCDHN C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(O)cc1[O-] ZINC001168458719 779186921 /nfs/dbraw/zinc/18/69/21/779186921.db2.gz INNXMUKZAQBUAU-NSHDSACASA-N 0 3 275.323 2.958 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCCC[C@](C)(O)C2)c1[O-] ZINC001238057707 779241465 /nfs/dbraw/zinc/24/14/65/779241465.db2.gz LKPAVUYSMSNARK-HNNXBMFYSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCCC[C@](C)(O)C2)c1[O-] ZINC001238057707 779241470 /nfs/dbraw/zinc/24/14/70/779241470.db2.gz LKPAVUYSMSNARK-HNNXBMFYSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC(C)(C)C[C@]2(C)CO)c1[O-] ZINC001238061188 779242428 /nfs/dbraw/zinc/24/24/28/779242428.db2.gz KRVPUAFTIBLBAD-MRXNPFEDSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC(C)(C)C[C@]2(C)CO)c1[O-] ZINC001238061188 779242432 /nfs/dbraw/zinc/24/24/32/779242432.db2.gz KRVPUAFTIBLBAD-MRXNPFEDSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(CCC(=O)O3)CC2)c1[O-] ZINC001238063547 779243062 /nfs/dbraw/zinc/24/30/62/779243062.db2.gz YKXYJRMRNQYQPB-UHFFFAOYSA-N 0 3 293.338 2.511 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@]3(CCCO3)C2)c1[O-] ZINC001238065288 779244359 /nfs/dbraw/zinc/24/43/59/779244359.db2.gz SWNVLGXFFTXIIL-OAHLLOKOSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@]3(CCCO3)C2)c1[O-] ZINC001238065288 779244364 /nfs/dbraw/zinc/24/43/64/779244364.db2.gz SWNVLGXFFTXIIL-OAHLLOKOSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc([O-])c(CN2CC[NH2+]CC2(C)C)cc1Cl ZINC001235825368 779380440 /nfs/dbraw/zinc/38/04/40/779380440.db2.gz FTUVVBROPPJTLB-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN CC1(C)CN(Cc2ccc(C(F)(F)F)cc2[O-])CC[NH2+]1 ZINC001235837903 779384481 /nfs/dbraw/zinc/38/44/81/779384481.db2.gz NDQKDFNMNIXEER-UHFFFAOYSA-N 0 3 288.313 2.595 20 10 CFCDHN CN(Cc1ccc(C(F)(F)F)cc1[O-])C[C@@H]1CCC[NH2+]1 ZINC001236122202 779479346 /nfs/dbraw/zinc/47/93/46/779479346.db2.gz MYVUNXJSCKGUML-LBPRGKRZSA-N 0 3 288.313 2.595 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](CO)[C@H]2C)c1[O-] ZINC001237681802 779705789 /nfs/dbraw/zinc/70/57/89/779705789.db2.gz SPYZKAYZYPOQRA-MNOVXSKESA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CO)[C@H]2C)c1[O-] ZINC001237681802 779705795 /nfs/dbraw/zinc/70/57/95/779705795.db2.gz SPYZKAYZYPOQRA-MNOVXSKESA-N 0 3 269.772 2.557 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)cc1[O-] ZINC000700816762 780726083 /nfs/dbraw/zinc/72/60/83/780726083.db2.gz NNTSNZOCIVPHGL-QWHCGFSZSA-N 0 3 280.387 2.914 20 10 CFCDHN Cn1ccc2c1cccc2-c1cccnc1OC1CNC1 ZINC001241824891 781145658 /nfs/dbraw/zinc/14/56/58/781145658.db2.gz ZMJYESKGFODLJH-UHFFFAOYSA-N 0 3 279.343 2.591 20 10 CFCDHN CO[C@H]1C[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000708695541 781277449 /nfs/dbraw/zinc/27/74/49/781277449.db2.gz CAVBILPZOFMRTD-JBLDHEPKSA-N 0 3 253.317 2.607 20 10 CFCDHN [NH3+][C@@H]1CCCCCN(Cc2c([O-])cccc2Cl)C1 ZINC000709011903 781286282 /nfs/dbraw/zinc/28/62/82/781286282.db2.gz SVDMRCRPRPAFJR-LLVKDONJSA-N 0 3 268.788 2.749 20 10 CFCDHN C[C@@H]([NH2+]CCOC1CCC1)c1cc(F)ccc1[O-] ZINC000709816074 781319584 /nfs/dbraw/zinc/31/95/84/781319584.db2.gz QSKBBKAUSUWJNQ-SNVBAGLBSA-N 0 3 253.317 2.751 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CC)C(C)(C)O)c1ccccc1[O-] ZINC000295063149 199325793 /nfs/dbraw/zinc/32/57/93/199325793.db2.gz RKAJNZKSQVTYRA-JSGCOSHPSA-N 0 3 251.370 2.982 20 10 CFCDHN COc1ccc(N2CCCN(CCOC(C)C)CC2)cc1 ZINC000052465683 346522727 /nfs/dbraw/zinc/52/27/27/346522727.db2.gz GCRHTGVAKWKJNH-UHFFFAOYSA-N 0 3 292.423 2.632 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CC2(O)CCCC2)c1[O-] ZINC000093503082 347677261 /nfs/dbraw/zinc/67/72/61/347677261.db2.gz AYICBVJWGUXOTH-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CC2(O)CCCC2)c1[O-] ZINC000093503082 347677262 /nfs/dbraw/zinc/67/72/62/347677262.db2.gz AYICBVJWGUXOTH-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000295192001 199398511 /nfs/dbraw/zinc/39/85/11/199398511.db2.gz XKVIZNZZLGGYMK-UHFFFAOYSA-N 0 3 275.392 2.909 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](OC)[C@@H](C)CC)c1[O-] ZINC000294330522 199001099 /nfs/dbraw/zinc/00/10/99/199001099.db2.gz XQNCKLHYUXPXGP-WFASDCNBSA-N 0 3 281.396 2.942 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)CCO)c([O-])c1 ZINC000297296196 200138819 /nfs/dbraw/zinc/13/88/19/200138819.db2.gz MBUAEMDTWHKCPI-WCQYABFASA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1cccs1 ZINC000297547184 200224137 /nfs/dbraw/zinc/22/41/37/200224137.db2.gz FLMUSOVAXVBPNI-BLLLJJGKSA-N 0 3 289.400 2.938 20 10 CFCDHN O=C(c1cccc2c1CCNC2)N1CCc2ccc(F)cc21 ZINC000319339317 541261836 /nfs/dbraw/zinc/26/18/36/541261836.db2.gz QQJCOWNMQZMLSW-UHFFFAOYSA-N 0 3 296.345 2.674 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CC[C@H](O)C1)c1ccc(C)cc1[O-] ZINC000280208117 522619907 /nfs/dbraw/zinc/61/99/07/522619907.db2.gz TYWOGKVMLDAIFH-IPYPFGDCSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)Cn1ccnc1)c1ccccc1[O-] ZINC000037157342 372658969 /nfs/dbraw/zinc/65/89/69/372658969.db2.gz FWTUSJKDFUYDQE-GXTWGEPZSA-N 0 3 259.353 2.718 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@H](CC)c1ccccc1[O-] ZINC000038013587 372765529 /nfs/dbraw/zinc/76/55/29/372765529.db2.gz GNYPTLNBOKPVGP-TZMCWYRMSA-N 0 3 278.396 2.738 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCc1ccsc1)OCO2 ZINC000042880469 372964280 /nfs/dbraw/zinc/96/42/80/372964280.db2.gz PLBORJTYCPUDAT-UHFFFAOYSA-N 0 3 277.345 2.515 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](OC)C2CC2)c1[O-] ZINC000378785002 781965552 /nfs/dbraw/zinc/96/55/52/781965552.db2.gz OYIAEUJZUQHNKP-ZDUSSCGKSA-N 0 3 285.771 2.569 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2C[C@](C)(OC)C2(C)C)c1 ZINC000089726200 374942443 /nfs/dbraw/zinc/94/24/43/374942443.db2.gz AAZWRXRVWCBXMG-HOCLYGCPSA-N 0 3 279.380 2.694 20 10 CFCDHN CCCN1CCC([N@H+](C)Cc2cccc(OC)c2[O-])CC1 ZINC000092165710 375093534 /nfs/dbraw/zinc/09/35/34/375093534.db2.gz HOGOIOQUDXUPPJ-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN CCCN1CCC([N@@H+](C)Cc2cccc(OC)c2[O-])CC1 ZINC000092165710 375093543 /nfs/dbraw/zinc/09/35/43/375093543.db2.gz HOGOIOQUDXUPPJ-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN Cc1nn(C)c(C)c1CN[C@H](C)c1cc(C)ccc1O ZINC000092324425 375102240 /nfs/dbraw/zinc/10/22/40/375102240.db2.gz PKHSUWHJTZQKGQ-LLVKDONJSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000092324425 375102246 /nfs/dbraw/zinc/10/22/46/375102246.db2.gz PKHSUWHJTZQKGQ-LLVKDONJSA-N 0 3 273.380 2.902 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CC)C[C@@H]2CCCO2)c1 ZINC000092407751 375109687 /nfs/dbraw/zinc/10/96/87/375109687.db2.gz NGVAFVPDDCUYQH-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CC)C[C@@H]2CCCO2)c1 ZINC000092407751 375109692 /nfs/dbraw/zinc/10/96/92/375109692.db2.gz NGVAFVPDDCUYQH-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOCC[N@H+](CC)Cc1cc(OCC)ccc1[O-] ZINC000092537916 375120449 /nfs/dbraw/zinc/12/04/49/375120449.db2.gz UTCXQAUZXBMLEE-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1cc(OCC)ccc1[O-] ZINC000092537916 375120453 /nfs/dbraw/zinc/12/04/53/375120453.db2.gz UTCXQAUZXBMLEE-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC000093505962 375258059 /nfs/dbraw/zinc/25/80/59/375258059.db2.gz WKEGWJYAZWUUEF-HIFRSBDPSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1[O-] ZINC000093505962 375258065 /nfs/dbraw/zinc/25/80/65/375258065.db2.gz WKEGWJYAZWUUEF-HIFRSBDPSA-N 0 3 291.391 2.792 20 10 CFCDHN C[C@H]([NH2+]CC1(N(C)C)CCC1)c1cc(F)ccc1[O-] ZINC000097927839 375588405 /nfs/dbraw/zinc/58/84/05/375588405.db2.gz AIEFEYYLFNQWMM-NSHDSACASA-N 0 3 266.360 2.666 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)cc1 ZINC000111236228 375835284 /nfs/dbraw/zinc/83/52/84/375835284.db2.gz NUNVJUGNVWDWHD-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)cc1 ZINC000111236228 375835285 /nfs/dbraw/zinc/83/52/85/375835285.db2.gz NUNVJUGNVWDWHD-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+]Cc1cc(C)ccc1[O-] ZINC000113333615 376010673 /nfs/dbraw/zinc/01/06/73/376010673.db2.gz CUQLHDPECBAGLB-CYBMUJFWSA-N 0 3 250.386 2.521 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)CCCn2ccnc2)cc1C ZINC000130587788 377580208 /nfs/dbraw/zinc/58/02/08/377580208.db2.gz UMXVFMQMWRQHMI-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)CCCn2ccnc2)cc1C ZINC000130587788 377580212 /nfs/dbraw/zinc/58/02/12/377580212.db2.gz UMXVFMQMWRQHMI-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@@H]2CCCO2)c([O-])c1 ZINC000132968668 377890995 /nfs/dbraw/zinc/89/09/95/377890995.db2.gz IHTZVWZDRMDWAH-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@@H]2CCCO2)c([O-])c1 ZINC000132968668 377890998 /nfs/dbraw/zinc/89/09/98/377890998.db2.gz IHTZVWZDRMDWAH-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(CN(C)C[C@@H]2CCCCO2)c1O ZINC000132608518 377858597 /nfs/dbraw/zinc/85/85/97/377858597.db2.gz PZXWYIGAEZKMPN-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@@H+]2CCC[C@@H]2C1 ZINC000134195590 377990660 /nfs/dbraw/zinc/99/06/60/377990660.db2.gz GYAONYMBZAPFSO-CQSZACIVSA-N 0 3 280.799 2.716 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@H+]2CCC[C@@H]2C1 ZINC000134195590 377990666 /nfs/dbraw/zinc/99/06/66/377990666.db2.gz GYAONYMBZAPFSO-CQSZACIVSA-N 0 3 280.799 2.716 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)NC(C)(C)C ZINC000135138710 378089726 /nfs/dbraw/zinc/08/97/26/378089726.db2.gz ZHDGPGLAYHYNHO-QWHCGFSZSA-N 0 3 291.439 2.706 20 10 CFCDHN Cc1nc2ccccn2c1CNCc1ccc(N(C)C)cc1 ZINC000378873349 781968920 /nfs/dbraw/zinc/96/89/20/781968920.db2.gz UCFQSZAALSLCEC-UHFFFAOYSA-N 0 3 294.402 2.999 20 10 CFCDHN COCCC1CC[NH+](Cc2cc(C)ccc2[O-])CC1 ZINC000529637323 383740079 /nfs/dbraw/zinc/74/00/79/383740079.db2.gz CPNQHQYDNJJFKA-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)c1ccccc1[O-] ZINC000179889981 380591645 /nfs/dbraw/zinc/59/16/45/380591645.db2.gz KPDSLKKBCJNIRZ-BDJLRTHQSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccccc1[O-] ZINC000179899385 380594209 /nfs/dbraw/zinc/59/42/09/380594209.db2.gz FSWLASCCKLYYGC-GUYCJALGSA-N 0 3 271.360 2.951 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000179924923 380597482 /nfs/dbraw/zinc/59/74/82/380597482.db2.gz LXSIHGLEFUWRKB-LLVKDONJSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000179924923 380597485 /nfs/dbraw/zinc/59/74/85/380597485.db2.gz LXSIHGLEFUWRKB-LLVKDONJSA-N 0 3 265.328 2.532 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](Oc3cccnc3)C2)c1[O-] ZINC000180484039 380666305 /nfs/dbraw/zinc/66/63/05/380666305.db2.gz OVXXMNIUVUTMMW-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](Oc3cccnc3)C2)c1[O-] ZINC000180484039 380666312 /nfs/dbraw/zinc/66/63/12/380666312.db2.gz OVXXMNIUVUTMMW-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN CC(C)OCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000181256382 380766144 /nfs/dbraw/zinc/76/61/44/380766144.db2.gz PDRJXJZPCYTYIV-HNNXBMFYSA-N 0 3 292.423 2.599 20 10 CFCDHN CN1CCCc2cc(CN[C@H]3CCCc4n[nH]cc43)ccc21 ZINC000368609515 381083957 /nfs/dbraw/zinc/08/39/57/381083957.db2.gz YUVAUMBRDGHEPT-INIZCTEOSA-N 0 3 296.418 2.959 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCN1CCCCCC1)CC2 ZINC000295974704 381193138 /nfs/dbraw/zinc/19/31/38/381193138.db2.gz MWZZODCBEBEDIC-OAHLLOKOSA-N 0 3 274.408 2.845 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296095517 381252460 /nfs/dbraw/zinc/25/24/60/381252460.db2.gz UCVKTKUGYYTNEO-CQSZACIVSA-N 0 3 290.407 2.618 20 10 CFCDHN CN(C)[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000296048523 381230103 /nfs/dbraw/zinc/23/01/03/381230103.db2.gz RABHESISDNGVDE-KGLIPLIRSA-N 0 3 286.375 2.865 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccccc1[O-] ZINC000183623455 381296924 /nfs/dbraw/zinc/29/69/24/381296924.db2.gz DPPIYRQCTKJULR-VXGBXAGGSA-N 0 3 251.370 2.840 20 10 CFCDHN CCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000183456592 381273692 /nfs/dbraw/zinc/27/36/92/381273692.db2.gz BYYKNGSWBIEESX-CYBMUJFWSA-N 0 3 298.386 2.993 20 10 CFCDHN C[C@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1ccccc1[O-] ZINC000183511642 381282513 /nfs/dbraw/zinc/28/25/13/381282513.db2.gz JXIGKJSKZSIEAB-ZDUSSCGKSA-N 0 3 290.407 2.691 20 10 CFCDHN COc1ncccc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296235692 381313482 /nfs/dbraw/zinc/31/34/82/381313482.db2.gz AOJXFXDRRKZTQU-CQSZACIVSA-N 0 3 284.359 2.615 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCc2ccncc2)c1[O-] ZINC000183757643 381315462 /nfs/dbraw/zinc/31/54/62/381315462.db2.gz KZDDRLSBBJWAKN-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCc2ccncc2)c1[O-] ZINC000183757643 381315467 /nfs/dbraw/zinc/31/54/67/381315467.db2.gz KZDDRLSBBJWAKN-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296243393 381315477 /nfs/dbraw/zinc/31/54/77/381315477.db2.gz AXGCZDXNCWIQDR-TZMCWYRMSA-N 0 3 290.407 2.522 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296243382 381315597 /nfs/dbraw/zinc/31/55/97/381315597.db2.gz AXGCZDXNCWIQDR-JSGCOSHPSA-N 0 3 290.407 2.522 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296243385 381316391 /nfs/dbraw/zinc/31/63/91/381316391.db2.gz AXGCZDXNCWIQDR-OCCSQVGLSA-N 0 3 290.407 2.522 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@H](O)C(F)F ZINC000296654781 381490852 /nfs/dbraw/zinc/49/08/52/381490852.db2.gz ZFPNUXJSJFYLRU-CDMKHQONSA-N 0 3 273.323 2.756 20 10 CFCDHN CCOCCCC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185071009 381528127 /nfs/dbraw/zinc/52/81/27/381528127.db2.gz REFPTIBOFCGYJI-LBPRGKRZSA-N 0 3 267.369 2.868 20 10 CFCDHN Cc1c2ccccc2n(C)c1CNc1nccn1C ZINC000414300163 381576157 /nfs/dbraw/zinc/57/61/57/381576157.db2.gz KUMVDHVORVMFEE-UHFFFAOYSA-N 0 3 254.337 2.832 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185350320 381607830 /nfs/dbraw/zinc/60/78/30/381607830.db2.gz GEBUTTTUOMYOGH-NXEZZACHSA-N 0 3 277.343 2.985 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000371316002 381589076 /nfs/dbraw/zinc/58/90/76/381589076.db2.gz ZADWHHWQINKTJL-UONOGXRCSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000371316002 381589082 /nfs/dbraw/zinc/58/90/82/381589082.db2.gz ZADWHHWQINKTJL-UONOGXRCSA-N 0 3 261.365 2.559 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-])C1CC1 ZINC000185307980 381593724 /nfs/dbraw/zinc/59/37/24/381593724.db2.gz QWYGEFNEKPKMIJ-LBPRGKRZSA-N 0 3 278.396 2.536 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c1 ZINC000185368595 381613708 /nfs/dbraw/zinc/61/37/08/381613708.db2.gz WSHQMRZQUVIDCM-CHWSQXEVSA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c([O-])c1 ZINC000185369119 381615836 /nfs/dbraw/zinc/61/58/36/381615836.db2.gz KDTQMKYOAVUULN-CHWSQXEVSA-N 0 3 262.397 2.834 20 10 CFCDHN CC[C@@H](C)[C@@H](O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000185438515 381631857 /nfs/dbraw/zinc/63/18/57/381631857.db2.gz QJXIAGAOOYGMHQ-XUJVJEKNSA-N 0 3 251.370 2.758 20 10 CFCDHN CC[C@H](C)[C@@H](O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000185438528 381632282 /nfs/dbraw/zinc/63/22/82/381632282.db2.gz QJXIAGAOOYGMHQ-HUBLWGQQSA-N 0 3 251.370 2.758 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909362 381672641 /nfs/dbraw/zinc/67/26/41/381672641.db2.gz YXXNKVGQUCWZQB-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909362 381672649 /nfs/dbraw/zinc/67/26/49/381672649.db2.gz YXXNKVGQUCWZQB-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909362 381672659 /nfs/dbraw/zinc/67/26/59/381672659.db2.gz YXXNKVGQUCWZQB-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909362 381672666 /nfs/dbraw/zinc/67/26/66/381672666.db2.gz YXXNKVGQUCWZQB-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)c1[O-] ZINC000371682226 381676690 /nfs/dbraw/zinc/67/66/90/381676690.db2.gz WYZZNTVKOFPOMJ-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1[O-] ZINC000371682226 381676691 /nfs/dbraw/zinc/67/66/91/381676691.db2.gz WYZZNTVKOFPOMJ-OAHLLOKOSA-N 0 3 298.386 2.860 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)c1 ZINC000185672156 381699587 /nfs/dbraw/zinc/69/95/87/381699587.db2.gz GYXVUFZSAMXEHD-AGIUHOORSA-N 0 3 290.407 2.677 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC2CCOCC2)c([O-])c1 ZINC000186074466 381817686 /nfs/dbraw/zinc/81/76/86/381817686.db2.gz MVTFOIJEWQEPBZ-CQSZACIVSA-N 0 3 293.407 2.937 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000186505197 381930769 /nfs/dbraw/zinc/93/07/69/381930769.db2.gz MTMJQGBVHGZHMQ-ISBNUJHVSA-N 0 3 253.317 2.509 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000373368141 381989695 /nfs/dbraw/zinc/98/96/95/381989695.db2.gz DEPFWBUKYBGGIE-IAGOWNOFSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000374997587 382063834 /nfs/dbraw/zinc/06/38/34/382063834.db2.gz KKWODAQLLAUVRX-UKRRQHHQSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000374997587 382063839 /nfs/dbraw/zinc/06/38/39/382063839.db2.gz KKWODAQLLAUVRX-UKRRQHHQSA-N 0 3 261.365 2.559 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000373610984 382021135 /nfs/dbraw/zinc/02/11/35/382021135.db2.gz OITUITABGVTWFK-QGZVFWFLSA-N 0 3 291.391 2.552 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000373610984 382021141 /nfs/dbraw/zinc/02/11/41/382021141.db2.gz OITUITABGVTWFK-QGZVFWFLSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](O)c2ccccc2C1 ZINC000375243348 382073427 /nfs/dbraw/zinc/07/34/27/382073427.db2.gz XIMYGELXAAEYRQ-KRWDZBQOSA-N 0 3 287.334 2.971 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](O)c2ccccc2C1 ZINC000375243348 382073431 /nfs/dbraw/zinc/07/34/31/382073431.db2.gz XIMYGELXAAEYRQ-KRWDZBQOSA-N 0 3 287.334 2.971 20 10 CFCDHN CCOC1(C[NH2+]Cc2cc(F)ccc2[O-])CCCC1 ZINC000293664545 382221510 /nfs/dbraw/zinc/22/15/10/382221510.db2.gz OEYOJLQFIQAZID-UHFFFAOYSA-N 0 3 267.344 2.970 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000377236943 382240305 /nfs/dbraw/zinc/24/03/05/382240305.db2.gz GWXLGRCVXJWKNJ-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000377236943 382240315 /nfs/dbraw/zinc/24/03/15/382240315.db2.gz GWXLGRCVXJWKNJ-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2O)c1[O-] ZINC000187675263 382242956 /nfs/dbraw/zinc/24/29/56/382242956.db2.gz GIRHXBRLUPKCCD-CHWSQXEVSA-N 0 3 269.772 2.747 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC(=O)NC(C)C)c([O-])c1 ZINC000293744386 382261603 /nfs/dbraw/zinc/26/16/03/382261603.db2.gz NSFQWWBDUUFGJU-CYBMUJFWSA-N 0 3 278.396 2.574 20 10 CFCDHN CCC[C@H](CNCc1ccc(OC)c(C)c1)OC ZINC000293763572 382269184 /nfs/dbraw/zinc/26/91/84/382269184.db2.gz VCMLYQVWWIZURN-CQSZACIVSA-N 0 3 251.370 2.908 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC[C@@]23CCOC3)c1 ZINC000377685328 382320344 /nfs/dbraw/zinc/32/03/44/382320344.db2.gz ZTMCOQXZCUIRMV-LRDDRELGSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC[C@@]23CCOC3)c1 ZINC000377685328 382320347 /nfs/dbraw/zinc/32/03/47/382320347.db2.gz ZTMCOQXZCUIRMV-LRDDRELGSA-N 0 3 277.364 2.717 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000365467513 382398686 /nfs/dbraw/zinc/39/86/86/382398686.db2.gz HEKCSWATIBVKGH-AWEZNQCLSA-N 0 3 282.815 2.962 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c([O-])c1C ZINC000377803358 382349837 /nfs/dbraw/zinc/34/98/37/382349837.db2.gz VKVUDCRXROGYPA-CHWSQXEVSA-N 0 3 285.391 2.940 20 10 CFCDHN CN1CC[C@@H](C[NH2+]Cc2ccccc2[O-])[C@@H]1c1cccnc1 ZINC000364672521 382352157 /nfs/dbraw/zinc/35/21/57/382352157.db2.gz JNWRPKVWQPPWLC-WMZOPIPTSA-N 0 3 297.402 2.570 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000377852406 382357570 /nfs/dbraw/zinc/35/75/70/382357570.db2.gz PTZOOCCWUHRTRB-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000377852406 382357575 /nfs/dbraw/zinc/35/75/75/382357575.db2.gz PTZOOCCWUHRTRB-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC(C)[C@]1(CO)CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000293997735 382370769 /nfs/dbraw/zinc/37/07/69/382370769.db2.gz MAJNQPSNCXCHCX-MRXNPFEDSA-N 0 3 281.371 2.762 20 10 CFCDHN CC(C)[C@]1(CO)CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000293997735 382370773 /nfs/dbraw/zinc/37/07/73/382370773.db2.gz MAJNQPSNCXCHCX-MRXNPFEDSA-N 0 3 281.371 2.762 20 10 CFCDHN Oc1ccccc1CN1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000294014635 382378459 /nfs/dbraw/zinc/37/84/59/382378459.db2.gz NCLUVZBNPXWKEU-CVEARBPZSA-N 0 3 259.349 2.536 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCCC[C@H](CO)C2)c([O-])c1 ZINC000378350307 382443950 /nfs/dbraw/zinc/44/39/50/382443950.db2.gz RCUDBCSFTFZMPK-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCCC[C@H](CO)C2)c([O-])c1 ZINC000378350307 382443954 /nfs/dbraw/zinc/44/39/54/382443954.db2.gz RCUDBCSFTFZMPK-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H](O)CC2)c([O-])c1 ZINC000294065987 382401317 /nfs/dbraw/zinc/40/13/17/382401317.db2.gz QHMJBMKBPFJGSU-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H](O)CC2)c([O-])c1 ZINC000294065987 382401320 /nfs/dbraw/zinc/40/13/20/382401320.db2.gz QHMJBMKBPFJGSU-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)c1 ZINC000294108777 382418428 /nfs/dbraw/zinc/41/84/28/382418428.db2.gz SODYMHUDSDCNNS-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c1 ZINC000294108777 382418434 /nfs/dbraw/zinc/41/84/34/382418434.db2.gz SODYMHUDSDCNNS-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000378435857 382459341 /nfs/dbraw/zinc/45/93/41/382459341.db2.gz BEOOUNNUARLRBT-CYBMUJFWSA-N 0 3 299.374 2.570 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000378435857 382459345 /nfs/dbraw/zinc/45/93/45/382459345.db2.gz BEOOUNNUARLRBT-CYBMUJFWSA-N 0 3 299.374 2.570 20 10 CFCDHN CO[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000378627907 382494345 /nfs/dbraw/zinc/49/43/45/382494345.db2.gz BANAODYFAVAQOV-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN CO[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000378627907 382494350 /nfs/dbraw/zinc/49/43/50/382494350.db2.gz BANAODYFAVAQOV-ZDUSSCGKSA-N 0 3 253.317 2.532 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000378499021 382474161 /nfs/dbraw/zinc/47/41/61/382474161.db2.gz SSJXITOTUNJKOL-YUELXQCFSA-N 0 3 279.355 2.777 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000378499021 382474163 /nfs/dbraw/zinc/47/41/63/382474163.db2.gz SSJXITOTUNJKOL-YUELXQCFSA-N 0 3 279.355 2.777 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2cccc(OC)c2[O-])C1 ZINC000188774759 382474713 /nfs/dbraw/zinc/47/47/13/382474713.db2.gz JNRMYFFZOZXWGA-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H]([NH2+]Cc1ccnc(-n2ccnc2)c1)c1ccccc1[O-] ZINC000378631598 382496215 /nfs/dbraw/zinc/49/62/15/382496215.db2.gz JTBNKYLOKULENT-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@H]21 ZINC000378538103 382479596 /nfs/dbraw/zinc/47/95/96/382479596.db2.gz ZZKJCYBEOINOKU-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@H]21 ZINC000378538103 382479600 /nfs/dbraw/zinc/47/96/00/382479600.db2.gz ZZKJCYBEOINOKU-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C2 ZINC000378617599 382491512 /nfs/dbraw/zinc/49/15/12/382491512.db2.gz BEPUDEKXRZJMGG-CHWSQXEVSA-N 0 3 271.364 2.563 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cc(C)ccc1[O-])OC ZINC000294298428 382499905 /nfs/dbraw/zinc/49/99/05/382499905.db2.gz UUNMBFVFTFMAFL-IUODEOHRSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1cc(CN2CC[C@H](O)C(C)(C)C2)ccc1N(C)C ZINC000294649898 382519638 /nfs/dbraw/zinc/51/96/38/382519638.db2.gz QNXRVELROMRTTH-INIZCTEOSA-N 0 3 276.424 2.654 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)[C@@H](C)OC)c([O-])c1 ZINC000189101902 382542025 /nfs/dbraw/zinc/54/20/25/382542025.db2.gz PFKIDYNEZNTHJD-NWDGAFQWSA-N 0 3 267.369 2.694 20 10 CFCDHN Cc1cccc(C[NH2+]CCc2ncccc2C)c1[O-] ZINC000295102997 382576589 /nfs/dbraw/zinc/57/65/89/382576589.db2.gz VEKDATNLQQQURR-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](OC)C(C)(C)C2)c1 ZINC000295056971 382570334 /nfs/dbraw/zinc/57/03/34/382570334.db2.gz PZPDSATXWGZALO-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c1 ZINC000295056971 382570337 /nfs/dbraw/zinc/57/03/37/382570337.db2.gz PZPDSATXWGZALO-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])Cc1ccccc1 ZINC000294826813 382532898 /nfs/dbraw/zinc/53/28/98/382532898.db2.gz PPXVWTSRVSYNIZ-MRXNPFEDSA-N 0 3 289.350 2.879 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC(n2cccn2)C1 ZINC000366626222 382534068 /nfs/dbraw/zinc/53/40/68/382534068.db2.gz AYZJUAURDOXZRD-CQSZACIVSA-N 0 3 257.337 2.597 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000189799629 382641327 /nfs/dbraw/zinc/64/13/27/382641327.db2.gz BUNPPQHQJBLYKE-GJZGRUSLSA-N 0 3 279.380 2.574 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@](CC)(CO)C2)c1[O-] ZINC000190219925 382657235 /nfs/dbraw/zinc/65/72/35/382657235.db2.gz YUBVDOBBRQHPKQ-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@](CC)(CO)C2)c1[O-] ZINC000190219925 382657237 /nfs/dbraw/zinc/65/72/37/382657237.db2.gz YUBVDOBBRQHPKQ-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1O)c1cc(F)ccc1[O-] ZINC000248493043 383250583 /nfs/dbraw/zinc/25/05/83/383250583.db2.gz JQWMTTACNIOXSO-HKJPBSJPSA-N 0 3 287.334 2.840 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@H]2CC[NH2+]C23CCC3)c([O-])c1 ZINC000530217050 383768552 /nfs/dbraw/zinc/76/85/52/383768552.db2.gz SBESJRYVFALFCG-DOMZBBRYSA-N 0 3 260.381 2.636 20 10 CFCDHN C[C@@H]1C[C@H](N[C@H]2CC[NH2+]C23CCC3)c2c1c(F)ccc2[O-] ZINC000530215985 383768575 /nfs/dbraw/zinc/76/85/75/383768575.db2.gz LKAQJOGNPKZXSG-OSMZGAPFSA-N 0 3 290.382 2.954 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1cc(C)ccc1[O-] ZINC000267291160 384349250 /nfs/dbraw/zinc/34/92/50/384349250.db2.gz RITKEGJREIKLSO-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)N1CCCCCC1 ZINC000118775270 412994507 /nfs/dbraw/zinc/99/45/07/412994507.db2.gz WUXXXLRRCFQYGG-AWEZNQCLSA-N 0 3 290.407 2.615 20 10 CFCDHN CO[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)C1 ZINC000282123060 385218841 /nfs/dbraw/zinc/21/88/41/385218841.db2.gz AYCKHJATAJYONJ-OCCSQVGLSA-N 0 3 280.387 2.891 20 10 CFCDHN CC[C@H]([NH2+]CC1([S@](C)=O)CC1)c1ccc(C)cc1[O-] ZINC000282411497 385303778 /nfs/dbraw/zinc/30/37/78/385303778.db2.gz SDTYSTDNZIABCR-DJJJIMSYSA-N 0 3 281.421 2.652 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c1[O-] ZINC000271209542 385376205 /nfs/dbraw/zinc/37/62/05/385376205.db2.gz XOMWIZZGERBZEH-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c1[O-] ZINC000271209542 385376209 /nfs/dbraw/zinc/37/62/09/385376209.db2.gz XOMWIZZGERBZEH-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000271209540 385376217 /nfs/dbraw/zinc/37/62/17/385376217.db2.gz XOMWIZZGERBZEH-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000271209540 385376219 /nfs/dbraw/zinc/37/62/19/385376219.db2.gz XOMWIZZGERBZEH-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H]2CCO[C@@H](C)C2)cc1C ZINC000271554451 385385199 /nfs/dbraw/zinc/38/51/99/385385199.db2.gz UZCRGCONNAAHST-UONOGXRCSA-N 0 3 263.381 2.914 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000271775264 385391013 /nfs/dbraw/zinc/39/10/13/385391013.db2.gz CLJYLCMZGGHAAE-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN C[C@@H](CCO)C1(C[NH2+]Cc2ccccc2[O-])CCC1 ZINC000272121041 385453346 /nfs/dbraw/zinc/45/33/46/385453346.db2.gz ZSTGIMNCHNLYNU-ZDUSSCGKSA-N 0 3 263.381 2.671 20 10 CFCDHN Cc1cc(CN[C@H](C)c2cc(C)ccc2O)n(C)n1 ZINC000284147839 385540773 /nfs/dbraw/zinc/54/07/73/385540773.db2.gz DKTIBXKBZGCSAI-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1[O-] ZINC000284337546 385547823 /nfs/dbraw/zinc/54/78/23/385547823.db2.gz MPFQYADJLYAZPA-IVMMDQJWSA-N 0 3 295.423 2.591 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284948095 385551668 /nfs/dbraw/zinc/55/16/68/385551668.db2.gz HMGKDKPSRYJBRW-GDBMZVCRSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284948095 385551670 /nfs/dbraw/zinc/55/16/70/385551670.db2.gz HMGKDKPSRYJBRW-GDBMZVCRSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C2(CCO)CCCC2)c1 ZINC000285347947 385554260 /nfs/dbraw/zinc/55/42/60/385554260.db2.gz APQDKSRXUPBSPJ-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN CC[C@@H]([NH2+]CCCN(C)CCOC)c1ccc(F)cc1[O-] ZINC000285635811 385556143 /nfs/dbraw/zinc/55/61/43/385556143.db2.gz LNBWXFBAWVRTRG-OAHLLOKOSA-N 0 3 298.402 2.540 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(F)cc1[O-] ZINC000286001697 385559455 /nfs/dbraw/zinc/55/94/55/385559455.db2.gz IRMOWPVCGFVAAT-FZMZJTMJSA-N 0 3 268.376 2.912 20 10 CFCDHN Cc1cccc(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000273147313 385672170 /nfs/dbraw/zinc/67/21/70/385672170.db2.gz GPBILEUSJBPPHY-JKSUJKDBSA-N 0 3 261.365 2.748 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@@]1(C)[NH2+]Cc1ccccc1[O-] ZINC000273374799 385679501 /nfs/dbraw/zinc/67/95/01/385679501.db2.gz BHXASYUGJDSJGU-CZUORRHYSA-N 0 3 277.364 2.604 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@]1(C)[NH2+]Cc1ccccc1[O-] ZINC000273374795 385679722 /nfs/dbraw/zinc/67/97/22/385679722.db2.gz BHXASYUGJDSJGU-CJNGLKHVSA-N 0 3 277.364 2.604 20 10 CFCDHN COCCN(C)CCC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273396223 385680598 /nfs/dbraw/zinc/68/05/98/385680598.db2.gz LWLSENGLOHFCCM-OAHLLOKOSA-N 0 3 294.439 2.628 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CN2CCCC2=O)c([O-])c1C ZINC000273387181 385681038 /nfs/dbraw/zinc/68/10/38/385681038.db2.gz JXJSEVYBPMCAJS-OCCSQVGLSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCCC2=O)c([O-])c1C ZINC000273387179 385681541 /nfs/dbraw/zinc/68/15/41/385681541.db2.gz JXJSEVYBPMCAJS-JSGCOSHPSA-N 0 3 290.407 2.671 20 10 CFCDHN CC[NH+](CC)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273419934 385683245 /nfs/dbraw/zinc/68/32/45/385683245.db2.gz RUNCKVFWWPEXFS-GFCCVEGCSA-N 0 3 295.383 2.683 20 10 CFCDHN CCN(CC)CCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273419934 385683248 /nfs/dbraw/zinc/68/32/48/385683248.db2.gz RUNCKVFWWPEXFS-GFCCVEGCSA-N 0 3 295.383 2.683 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000273442745 385683334 /nfs/dbraw/zinc/68/33/34/385683334.db2.gz WSIHPRARTVVGJH-ZIAGYGMSSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000273442745 385683337 /nfs/dbraw/zinc/68/33/37/385683337.db2.gz WSIHPRARTVVGJH-ZIAGYGMSSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccncc2C)c1 ZINC000273490549 385685073 /nfs/dbraw/zinc/68/50/73/385685073.db2.gz OELRXPRSQBJEEQ-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496061 385686018 /nfs/dbraw/zinc/68/60/18/385686018.db2.gz PBLFQZZTJISEJK-ZANVPECISA-N 0 3 275.327 2.983 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2([C@@H](O)C(C)C)CC2)c1 ZINC000273510286 385686222 /nfs/dbraw/zinc/68/62/22/385686222.db2.gz ROJAZSDBADFFPM-LRDDRELGSA-N 0 3 293.407 2.849 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])CC1 ZINC000273535777 385687335 /nfs/dbraw/zinc/68/73/35/385687335.db2.gz XGRIQJAVPWJKRW-XHDPSFHLSA-N 0 3 281.371 2.979 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CCN(C)C)c([O-])c1C ZINC000273562991 385688029 /nfs/dbraw/zinc/68/80/29/385688029.db2.gz IRANUBBEIBKAAB-TZMCWYRMSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN(C)CC(F)(F)F)c1 ZINC000273559577 385688177 /nfs/dbraw/zinc/68/81/77/385688177.db2.gz HUQZFNBHLFNUSP-LLVKDONJSA-N 0 3 290.329 2.845 20 10 CFCDHN CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000273603149 385691019 /nfs/dbraw/zinc/69/10/19/385691019.db2.gz SKTKNBBHABDGOA-IINYFYTJSA-N 0 3 255.333 2.853 20 10 CFCDHN COCCCN(C)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273616669 385691034 /nfs/dbraw/zinc/69/10/34/385691034.db2.gz XOQKLEZLUFXWIN-OAHLLOKOSA-N 0 3 294.439 2.628 20 10 CFCDHN COc1cc(Cl)cc(CN2CCCSCC2)c1O ZINC000273785232 385695759 /nfs/dbraw/zinc/69/57/59/385695759.db2.gz UJFDYJGWTLHOAS-UHFFFAOYSA-N 0 3 287.812 2.993 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)c(C)cc1[O-])[C@@H](O)C(F)F ZINC000295050101 522638861 /nfs/dbraw/zinc/63/88/61/522638861.db2.gz NKUVONNCBWHYSS-WCQYABFASA-N 0 3 273.323 2.503 20 10 CFCDHN CC(C)(C)C[C@@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297532009 393446443 /nfs/dbraw/zinc/44/64/43/393446443.db2.gz DPVVWFVJSBMELU-OLZOCXBDSA-N 0 3 263.381 2.766 20 10 CFCDHN c1cc(N2CCCCC2)ccc1CN1CCCOCC1 ZINC000372433539 393449396 /nfs/dbraw/zinc/44/93/96/393449396.db2.gz KEUXQLBHPMUVEN-UHFFFAOYSA-N 0 3 274.408 2.899 20 10 CFCDHN Cc1noc(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)n1 ZINC000179941181 393472554 /nfs/dbraw/zinc/47/25/54/393472554.db2.gz MAMMVZWJDCGSBY-UHFFFAOYSA-N 0 3 291.326 2.602 20 10 CFCDHN C[C@@H]1C[C@]2(CCO1)C[N@H+](Cc1ccccc1[O-])C[C@H](C)O2 ZINC000373978972 393477653 /nfs/dbraw/zinc/47/76/53/393477653.db2.gz UMMWPFKDDZHSIW-JKIFEVAISA-N 0 3 291.391 2.551 20 10 CFCDHN C[C@@H]1C[C@]2(CCO1)C[N@@H+](Cc1ccccc1[O-])C[C@H](C)O2 ZINC000373978972 393477658 /nfs/dbraw/zinc/47/76/58/393477658.db2.gz UMMWPFKDDZHSIW-JKIFEVAISA-N 0 3 291.391 2.551 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000374255036 393489758 /nfs/dbraw/zinc/48/97/58/393489758.db2.gz OTVLEKMHKVUTBI-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000374255036 393489762 /nfs/dbraw/zinc/48/97/62/393489762.db2.gz OTVLEKMHKVUTBI-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN C[C@H](C(=O)N(C)Cc1ccccc1O)[C@H](N)c1ccccc1 ZINC000237550095 393793923 /nfs/dbraw/zinc/79/39/23/393793923.db2.gz GMVBPLPGBFTCFA-GUYCJALGSA-N 0 3 298.386 2.687 20 10 CFCDHN CCN(Cc1cnn(C)c1)Cc1ccc(N(C)C)cc1 ZINC000119044988 393913766 /nfs/dbraw/zinc/91/37/66/393913766.db2.gz DQVZSAYICRJMBM-UHFFFAOYSA-N 0 3 272.396 2.508 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1[C@H]2COC[C@H]21)c1ccc(C)cc1[O-] ZINC000367688961 394260562 /nfs/dbraw/zinc/26/05/62/394260562.db2.gz OEXBEWYHNMKUGE-APIJFGDWSA-N 0 3 261.365 2.634 20 10 CFCDHN CCOc1cccc(C[NH2+]CC[C@H]2CCCOC2)c1[O-] ZINC000527740760 394402568 /nfs/dbraw/zinc/40/25/68/394402568.db2.gz VCRKAYUCIBPSDV-CYBMUJFWSA-N 0 3 279.380 2.697 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H]2CCN2C2CCCC2)c1[O-] ZINC000527805842 394410571 /nfs/dbraw/zinc/41/05/71/394410571.db2.gz INEJZVZFFOQEAJ-OAHLLOKOSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2cccnc2)c1 ZINC000020128045 171014865 /nfs/dbraw/zinc/01/48/65/171014865.db2.gz UUETWRXORKOBOL-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc(O)cc2)cc1 ZINC000020145993 171032198 /nfs/dbraw/zinc/03/21/98/171032198.db2.gz SBNHVAVAPHQATA-UHFFFAOYSA-N 0 3 256.349 2.748 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C2CCN(C(C)C)CC2)c1 ZINC000020189212 171054039 /nfs/dbraw/zinc/05/40/39/171054039.db2.gz GUYQEDYAIWXPDU-ZDUSSCGKSA-N 0 3 292.423 2.924 20 10 CFCDHN CCN1CCC([NH2+]Cc2cc(Cl)ccc2[O-])CC1 ZINC000038097935 174112017 /nfs/dbraw/zinc/11/20/17/174112017.db2.gz VLCMDNPADUQNLN-UHFFFAOYSA-N 0 3 268.788 2.620 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(C)ccc2[O-])cc1 ZINC000071403871 176155199 /nfs/dbraw/zinc/15/51/99/176155199.db2.gz CMMXXYSIJZSWJK-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2NCc1ccc2c(c1)CCO2 ZINC000037363417 260095029 /nfs/dbraw/zinc/09/50/29/260095029.db2.gz UTIGXPVCSBMOKO-HNNXBMFYSA-N 0 3 283.375 2.522 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H](n2cncn2)C1 ZINC000364622236 262255524 /nfs/dbraw/zinc/25/55/24/262255524.db2.gz JTZUYYLMNKPRGM-UKRRQHHQSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@H](n2cncn2)C1 ZINC000364622236 262255525 /nfs/dbraw/zinc/25/55/25/262255525.db2.gz JTZUYYLMNKPRGM-UKRRQHHQSA-N 0 3 286.379 2.772 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@@](F)(CO)C1 ZINC000367691078 267109999 /nfs/dbraw/zinc/10/99/99/267109999.db2.gz ZYLGXLVHOLPIGX-HIFRSBDPSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@@](F)(CO)C1 ZINC000367691078 267110000 /nfs/dbraw/zinc/11/00/00/267110000.db2.gz ZYLGXLVHOLPIGX-HIFRSBDPSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@](O)(C2CC2)C1 ZINC000368035885 267139392 /nfs/dbraw/zinc/13/93/92/267139392.db2.gz HEOGJLIIEAJLIT-GDBMZVCRSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@](O)(C2CC2)C1 ZINC000368035885 267139393 /nfs/dbraw/zinc/13/93/93/267139393.db2.gz HEOGJLIIEAJLIT-GDBMZVCRSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2OCC[C@H]2C1 ZINC000368043792 267140996 /nfs/dbraw/zinc/14/09/96/267140996.db2.gz XUECAHHRBYUUFG-DUVNUKRYSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@H]2OCC[C@H]2C1 ZINC000368043792 267140998 /nfs/dbraw/zinc/14/09/98/267140998.db2.gz XUECAHHRBYUUFG-DUVNUKRYSA-N 0 3 261.365 2.954 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134235 267147611 /nfs/dbraw/zinc/14/76/11/267147611.db2.gz LLPMLSGQUXHGMR-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134235 267147613 /nfs/dbraw/zinc/14/76/13/267147613.db2.gz LLPMLSGQUXHGMR-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368658224 267195060 /nfs/dbraw/zinc/19/50/60/267195060.db2.gz HORYFEKZCNJUHM-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368658224 267195061 /nfs/dbraw/zinc/19/50/61/267195061.db2.gz HORYFEKZCNJUHM-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN O[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)CC12CC2 ZINC000368800195 267206285 /nfs/dbraw/zinc/20/62/85/267206285.db2.gz LZTCJIXADGQKLQ-QGZVFWFLSA-N 0 3 286.419 2.634 20 10 CFCDHN CN1Cc2ccccc2[C@@H](NCc2ccc3c(c2)CCO3)C1 ZINC000371324680 267390131 /nfs/dbraw/zinc/39/01/31/267390131.db2.gz ZMKVIGBJDHHGSV-SFHVURJKSA-N 0 3 294.398 2.898 20 10 CFCDHN CC(C)N1CCC([NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000296814858 275626773 /nfs/dbraw/zinc/62/67/73/275626773.db2.gz LXKPYOMUXWITRI-OAHLLOKOSA-N 0 3 274.408 2.842 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000296613609 276288666 /nfs/dbraw/zinc/28/86/66/276288666.db2.gz YRFVEPGMVNBCAM-HZSPNIEDSA-N 0 3 289.375 2.701 20 10 CFCDHN COc1cc([O-])c(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1OC ZINC000183462536 277385963 /nfs/dbraw/zinc/38/59/63/277385963.db2.gz VHUJPOKGWDSHRO-RYUDHWBXSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1cccc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1[O-] ZINC000292747790 278010978 /nfs/dbraw/zinc/01/09/78/278010978.db2.gz IEKTWOAZKOSHQV-HNNXBMFYSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1[O-] ZINC000292747790 278010979 /nfs/dbraw/zinc/01/09/79/278010979.db2.gz IEKTWOAZKOSHQV-HNNXBMFYSA-N 0 3 291.391 2.649 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)C1CCOCC1 ZINC000296652303 278276570 /nfs/dbraw/zinc/27/65/70/278276570.db2.gz DLYVQYBRSRQHBL-SMDDNHRTSA-N 0 3 261.365 2.784 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000274869186 288041008 /nfs/dbraw/zinc/04/10/08/288041008.db2.gz FGHRQWWGHXCSAK-LBPRGKRZSA-N 0 3 290.329 2.927 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@H]1CCCO1)c1ccccc1[O-] ZINC000278946036 288063650 /nfs/dbraw/zinc/06/36/50/288063650.db2.gz YUPFRDRZGYVUME-OFQRWUPVSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@@](=O)CC[C@H]1C ZINC000377698946 288167317 /nfs/dbraw/zinc/16/73/17/288167317.db2.gz NBVMQYDREUNYON-TVZGQMOCSA-N 0 3 281.421 2.686 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952080 280949334 /nfs/dbraw/zinc/94/93/34/280949334.db2.gz BTKCCGFFWOYCPR-ZFWWWQNUSA-N 0 3 290.407 2.752 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cccc(Cl)c3[O-])[C@@H]2C1 ZINC000272540675 290232885 /nfs/dbraw/zinc/23/28/85/290232885.db2.gz BWRXYVPIYIPRTH-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cccc(Cl)c3[O-])[C@@H]2C1 ZINC000272540675 290232886 /nfs/dbraw/zinc/23/28/86/290232886.db2.gz BWRXYVPIYIPRTH-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCC[C@H]1CCO)CC2 ZINC000296438443 304827146 /nfs/dbraw/zinc/82/71/46/304827146.db2.gz MMVJMTKCMHTAME-FPMFFAJLSA-N 0 3 261.365 2.520 20 10 CFCDHN COc1cccc([C@H](C[NH2+]Cc2ccccc2[O-])OC)c1 ZINC000527737042 330278853 /nfs/dbraw/zinc/27/88/53/330278853.db2.gz MAHFOQCJGCDNIU-KRWDZBQOSA-N 0 3 287.359 2.878 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H]2CCN2C2CCCC2)c1 ZINC000527808925 330284685 /nfs/dbraw/zinc/28/46/85/330284685.db2.gz RBGSYGBSGHSWNS-INIZCTEOSA-N 0 3 274.408 2.807 20 10 CFCDHN CCn1nncc1CN[C@H](C)c1cc(Cl)cc(C)c1O ZINC000527914078 330295011 /nfs/dbraw/zinc/29/50/11/330295011.db2.gz IRIKMIULQGCTSX-SNVBAGLBSA-N 0 3 294.786 2.816 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@H]1CCCOC1)CC2 ZINC000527927044 330296740 /nfs/dbraw/zinc/29/67/40/330296740.db2.gz QRNDUDIBORPFEP-OCCSQVGLSA-N 0 3 261.365 2.786 20 10 CFCDHN COc1ccc(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])cn1 ZINC000527990309 330299108 /nfs/dbraw/zinc/29/91/08/330299108.db2.gz MIOMSYQTYWTFOR-NSHDSACASA-N 0 3 290.338 2.828 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)CC2 ZINC000527998418 330299815 /nfs/dbraw/zinc/29/98/15/330299815.db2.gz CTUIXGQTCZGIKZ-JKSUJKDBSA-N 0 3 286.419 2.986 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000230661778 521294813 /nfs/dbraw/zinc/29/48/13/521294813.db2.gz KYVKYNOEUAVQPA-NHYWBVRUSA-N 0 3 267.369 2.603 20 10 CFCDHN COCCSCCC[N@H+](C)Cc1ccccc1[O-] ZINC000278489222 521772381 /nfs/dbraw/zinc/77/23/81/521772381.db2.gz JFZYMDOKPTXZOK-UHFFFAOYSA-N 0 3 269.410 2.594 20 10 CFCDHN COCCSCCC[N@@H+](C)Cc1ccccc1[O-] ZINC000278489222 521772393 /nfs/dbraw/zinc/77/23/93/521772393.db2.gz JFZYMDOKPTXZOK-UHFFFAOYSA-N 0 3 269.410 2.594 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000289509764 518847437 /nfs/dbraw/zinc/84/74/37/518847437.db2.gz UPLJVVUGKWUFDG-CQSZACIVSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000289509764 518847445 /nfs/dbraw/zinc/84/74/45/518847445.db2.gz UPLJVVUGKWUFDG-CQSZACIVSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(=O)N1CCC[C@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000280981292 519552368 /nfs/dbraw/zinc/55/23/68/519552368.db2.gz MBTBQXRQWJVTTJ-UKRRQHHQSA-N 0 3 290.407 2.610 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC[C@H](C)OC)c([O-])c1 ZINC000263810407 520366322 /nfs/dbraw/zinc/36/63/22/520366322.db2.gz MQXXTOFYPDZPRI-LBPRGKRZSA-N 0 3 267.369 2.696 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1cc(F)ccc1[O-] ZINC000289565899 520506002 /nfs/dbraw/zinc/50/60/02/520506002.db2.gz ZFPBMZLUSVVTTL-UHFFFAOYSA-N 0 3 255.333 2.516 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1cc(F)ccc1[O-] ZINC000289565899 520506015 /nfs/dbraw/zinc/50/60/15/520506015.db2.gz ZFPBMZLUSVVTTL-UHFFFAOYSA-N 0 3 255.333 2.516 20 10 CFCDHN CCCCOCC[NH2+]Cc1cccc(OCC)c1[O-] ZINC000040506239 520782517 /nfs/dbraw/zinc/78/25/17/520782517.db2.gz ZXPABJFFQPJIFT-UHFFFAOYSA-N 0 3 267.369 2.697 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000280048406 520805923 /nfs/dbraw/zinc/80/59/23/520805923.db2.gz JKKMQZSBDREXLT-OCCSQVGLSA-N 0 3 251.370 2.902 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H](OC)[C@H](C)CC)c1 ZINC000294841759 521152154 /nfs/dbraw/zinc/15/21/54/521152154.db2.gz RCOVYPWEOUTTBD-MLGOLLRUSA-N 0 3 281.396 2.942 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000283831244 521191981 /nfs/dbraw/zinc/19/19/81/521191981.db2.gz APHDVMRPPLNQEZ-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230661871 521294997 /nfs/dbraw/zinc/29/49/97/521294997.db2.gz UKGBOBJDEFEKAO-HZMBPMFUSA-N 0 3 255.333 2.733 20 10 CFCDHN CCC[C@]1(CO)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000290180327 521319646 /nfs/dbraw/zinc/31/96/46/521319646.db2.gz NQDULDRWBYZZIO-KRWDZBQOSA-N 0 3 294.414 2.876 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000280565628 521338236 /nfs/dbraw/zinc/33/82/36/521338236.db2.gz VHUYUEGTOIHTKW-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000280565628 521338241 /nfs/dbraw/zinc/33/82/41/521338241.db2.gz VHUYUEGTOIHTKW-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2csc(C)n2)c1[O-] ZINC000227436736 521365773 /nfs/dbraw/zinc/36/57/73/521365773.db2.gz DIMIXZICGPCWSR-UHFFFAOYSA-N 0 3 292.404 2.888 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+]Cc1cccc(C)c1[O-] ZINC000224831156 521622651 /nfs/dbraw/zinc/62/26/51/521622651.db2.gz UCTBSRJADZBTAM-CQSZACIVSA-N 0 3 251.370 2.587 20 10 CFCDHN CCOC1(C[NH2+]Cc2cc3c(cc2[O-])OCO3)CCCC1 ZINC000293056372 521637372 /nfs/dbraw/zinc/63/73/72/521637372.db2.gz UIGLOOILAALVCW-UHFFFAOYSA-N 0 3 293.363 2.560 20 10 CFCDHN CCC[N@H+](CCn1ccnc1)Cc1ccccc1[O-] ZINC000161529617 521675040 /nfs/dbraw/zinc/67/50/40/521675040.db2.gz NBNHAMYUCVWREL-UHFFFAOYSA-N 0 3 259.353 2.501 20 10 CFCDHN CCC[N@@H+](CCn1ccnc1)Cc1ccccc1[O-] ZINC000161529617 521675042 /nfs/dbraw/zinc/67/50/42/521675042.db2.gz NBNHAMYUCVWREL-UHFFFAOYSA-N 0 3 259.353 2.501 20 10 CFCDHN CN(C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000226618988 522087533 /nfs/dbraw/zinc/08/75/33/522087533.db2.gz ODXIXJDODVQGDN-MRXNPFEDSA-N 0 3 288.366 2.924 20 10 CFCDHN CN(C)c1ccc(CN2CCC23CCOCC3)cc1F ZINC000365841875 522175357 /nfs/dbraw/zinc/17/53/57/522175357.db2.gz VSEPFAYHAXHAQT-UHFFFAOYSA-N 0 3 278.371 2.647 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@](C)(O)CC2)cc1F ZINC000279693992 522176093 /nfs/dbraw/zinc/17/60/93/522176093.db2.gz QDMKGOZFYXFREO-MRXNPFEDSA-N 0 3 280.387 2.629 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc(CO)c2)cc1 ZINC000222117209 522209229 /nfs/dbraw/zinc/20/92/29/522209229.db2.gz PTNGXQQJPQLZQQ-UHFFFAOYSA-N 0 3 270.376 2.535 20 10 CFCDHN CC[C@H](CSC)[N@H+](C)Cc1cccc(OC)c1[O-] ZINC000290333217 522270592 /nfs/dbraw/zinc/27/05/92/522270592.db2.gz DWQUPUXPZISYKK-GFCCVEGCSA-N 0 3 269.410 2.974 20 10 CFCDHN CC[C@H](CSC)[N@@H+](C)Cc1cccc(OC)c1[O-] ZINC000290333217 522270601 /nfs/dbraw/zinc/27/06/01/522270601.db2.gz DWQUPUXPZISYKK-GFCCVEGCSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cc(CNCc2ccc(OC)c(C)c2)ccn1 ZINC000057395271 522465040 /nfs/dbraw/zinc/46/50/40/522465040.db2.gz RKFHJWHOGZBQSR-UHFFFAOYSA-N 0 3 272.348 2.697 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](C)OC)c1[O-] ZINC000191695755 522540967 /nfs/dbraw/zinc/54/09/67/522540967.db2.gz ZQJHOYAHWWVZKS-IUCAKERBSA-N 0 3 273.760 2.567 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCOC[C@@H]2C)c1[O-] ZINC000277523742 522544583 /nfs/dbraw/zinc/54/45/83/522544583.db2.gz PJPDGRYOJONONE-CABZTGNLSA-N 0 3 285.771 2.569 20 10 CFCDHN COC1(CC[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000293596243 522595040 /nfs/dbraw/zinc/59/50/40/522595040.db2.gz IWVPVXDAEIMNDU-UHFFFAOYSA-N 0 3 253.317 2.580 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649235 522633541 /nfs/dbraw/zinc/63/35/41/522633541.db2.gz JRAAACJKTCWZNW-CJNGLKHVSA-N 0 3 274.408 2.917 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(C)c(C)cc1[O-])[C@H](O)C(F)F ZINC000295050097 522637539 /nfs/dbraw/zinc/63/75/39/522637539.db2.gz NKUVONNCBWHYSS-AAEUAGOBSA-N 0 3 273.323 2.503 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279996375 522732567 /nfs/dbraw/zinc/73/25/67/522732567.db2.gz FRPXPELQNDZWTK-YCPHGPKFSA-N 0 3 293.407 2.935 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)cc1OC ZINC000160389517 522778297 /nfs/dbraw/zinc/77/82/97/522778297.db2.gz AVCWZIHXRPFRJJ-TXEJJXNPSA-N 0 3 277.364 2.641 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1OC ZINC000160389517 522778303 /nfs/dbraw/zinc/77/83/03/522778303.db2.gz AVCWZIHXRPFRJJ-TXEJJXNPSA-N 0 3 277.364 2.641 20 10 CFCDHN CC[C@@H]([NH2+]CC1([S@](C)=O)CCC1)c1ccccc1[O-] ZINC000280959987 522821799 /nfs/dbraw/zinc/82/17/99/522821799.db2.gz HOCLGIWFYKJNAV-YJYMSZOUSA-N 0 3 281.421 2.734 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)CCCOC)c1ccc(C)cc1[O-] ZINC000279918888 522833927 /nfs/dbraw/zinc/83/39/27/522833927.db2.gz ABSSECVOXOOOQK-MRXNPFEDSA-N 0 3 294.439 2.710 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@](C)(O)CC)c1ccc(C)cc1[O-] ZINC000280124052 522857057 /nfs/dbraw/zinc/85/70/57/522857057.db2.gz OMUKKBGDEBBYRM-HIFRSBDPSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1[O-])C(C)(C)O ZINC000295059995 522911243 /nfs/dbraw/zinc/91/12/43/522911243.db2.gz RBDNFTWGMDCJDP-IINYFYTJSA-N 0 3 267.369 2.601 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2cccc(C)c2[O-])CCCC1 ZINC000279738023 522935802 /nfs/dbraw/zinc/93/58/02/522935802.db2.gz WVSWIIIRSYRNRR-UHFFFAOYSA-N 0 3 277.364 2.666 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000364762082 522951498 /nfs/dbraw/zinc/95/14/98/522951498.db2.gz XTSOHFFSHROQKG-CQSZACIVSA-N 0 3 286.379 2.841 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)Cc1ccc(F)cc1 ZINC000292874394 523386001 /nfs/dbraw/zinc/38/60/01/523386001.db2.gz STDSNZCLDZMNRC-MRXNPFEDSA-N 0 3 289.350 2.567 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)Cc1ccc(F)cc1 ZINC000292874394 523386005 /nfs/dbraw/zinc/38/60/05/523386005.db2.gz STDSNZCLDZMNRC-MRXNPFEDSA-N 0 3 289.350 2.567 20 10 CFCDHN CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCS1 ZINC000160320436 523449335 /nfs/dbraw/zinc/44/93/35/523449335.db2.gz NIDCNEIHNTUFTM-GFCCVEGCSA-N 0 3 297.420 2.737 20 10 CFCDHN CCn1nccc1C1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000278989093 523711477 /nfs/dbraw/zinc/71/14/77/523711477.db2.gz AJTLJFRDJWTJMM-UHFFFAOYSA-N 0 3 285.391 2.988 20 10 CFCDHN CO[C@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 ZINC000292983372 523972420 /nfs/dbraw/zinc/97/24/20/523972420.db2.gz FMCONWTZIQCWLW-HNNXBMFYSA-N 0 3 262.397 2.672 20 10 CFCDHN C[C@H](CCO)C1(C[NH2+]Cc2ccccc2[O-])CCC1 ZINC000272121040 524198744 /nfs/dbraw/zinc/19/87/44/524198744.db2.gz ZSTGIMNCHNLYNU-CYBMUJFWSA-N 0 3 263.381 2.671 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000279681289 524394565 /nfs/dbraw/zinc/39/45/65/524394565.db2.gz AJHRTNNWROGGDO-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000279681289 524394570 /nfs/dbraw/zinc/39/45/70/524394570.db2.gz AJHRTNNWROGGDO-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(CN2C[C@@H](C)O[C@@H](C3CC3)C2)c1O ZINC000280307617 524406391 /nfs/dbraw/zinc/40/63/91/524406391.db2.gz BSSWBSKTNMZTSV-IUODEOHRSA-N 0 3 261.365 2.700 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C(C)C)C2(CO)CCC2)c1 ZINC000292847121 524754648 /nfs/dbraw/zinc/75/46/48/524754648.db2.gz SWCUUVQKJQCRNV-MRXNPFEDSA-N 0 3 293.407 2.678 20 10 CFCDHN Cc1cc(C[NH2+]Cc2ccccc2[O-])cc(N2CCCC2)n1 ZINC000289936095 524760369 /nfs/dbraw/zinc/76/03/69/524760369.db2.gz WNVRGYNXBBCXMP-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CN(C)C(C)C)c1 ZINC000290269867 524767636 /nfs/dbraw/zinc/76/76/36/524767636.db2.gz WAZZOOANMHJGAH-CHWSQXEVSA-N 0 3 280.412 2.780 20 10 CFCDHN COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2[O-])c1 ZINC000168753083 524771532 /nfs/dbraw/zinc/77/15/32/524771532.db2.gz FQTSRMJWMZKSAH-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@](C)(OC)C2CC2)c1 ZINC000291370600 524771587 /nfs/dbraw/zinc/77/15/87/524771587.db2.gz YSJLZXSXDMGNNU-ZBEGNZNMSA-N 0 3 279.380 2.867 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@@H]2C2CC2)c1 ZINC000230669852 524773580 /nfs/dbraw/zinc/77/35/80/524773580.db2.gz UVYZMPABNHVEHJ-DRZCJDIDSA-N 0 3 277.364 2.619 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](CO)c2ccccc2)c1 ZINC000062999301 524775009 /nfs/dbraw/zinc/77/50/09/524775009.db2.gz IMOUEOXLPKIPAJ-BLLLJJGKSA-N 0 3 287.359 2.785 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H]2CO)c1[O-] ZINC000191175172 524866201 /nfs/dbraw/zinc/86/62/01/524866201.db2.gz KFNSJBMWEVFUHO-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H]2CO)c1[O-] ZINC000191175172 524866209 /nfs/dbraw/zinc/86/62/09/524866209.db2.gz KFNSJBMWEVFUHO-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCOC[C@H]2C)c1[O-] ZINC000277662624 524874738 /nfs/dbraw/zinc/87/47/38/524874738.db2.gz ZXPXDCWZNHGYTO-MFKMUULPSA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C2CCC(CO)CC2)cc1C ZINC000290321869 525311406 /nfs/dbraw/zinc/31/14/06/525311406.db2.gz CZOPIXMPYLJTTH-UHFFFAOYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C2CCC(CO)CC2)cc1C ZINC000290321869 525311414 /nfs/dbraw/zinc/31/14/14/525311414.db2.gz CZOPIXMPYLJTTH-UHFFFAOYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H](CO)CC(C)C)cc1C ZINC000290665180 525317082 /nfs/dbraw/zinc/31/70/82/525317082.db2.gz ZYDWLENHIDQAPR-HNNXBMFYSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H](CO)CC(C)C)cc1C ZINC000290665180 525317090 /nfs/dbraw/zinc/31/70/90/525317090.db2.gz ZYDWLENHIDQAPR-HNNXBMFYSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2COc3ccccc3[C@@H]2O)cc1C ZINC000288594493 525321922 /nfs/dbraw/zinc/32/19/22/525321922.db2.gz OXLJDPZRXDLMGX-QAPCUYQASA-N 0 3 299.370 2.593 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@@H]3CCCC[C@H]32)c1 ZINC000228155581 525341839 /nfs/dbraw/zinc/34/18/39/525341839.db2.gz DMNLGKQUXJUQGJ-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280610699 525342892 /nfs/dbraw/zinc/34/28/92/525342892.db2.gz YYDHTOJDXMZBLZ-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280610699 525342895 /nfs/dbraw/zinc/34/28/95/525342895.db2.gz YYDHTOJDXMZBLZ-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2(O)CCCCCC2)c1 ZINC000079619386 525346998 /nfs/dbraw/zinc/34/69/98/525346998.db2.gz ZERZEYXGEKTMBA-UHFFFAOYSA-N 0 3 263.381 2.876 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c1 ZINC000273043591 525353096 /nfs/dbraw/zinc/35/30/96/525353096.db2.gz BBTLLRFITZDTOK-HOTGVXAUSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)CC(C)C)c1 ZINC000040775407 525363117 /nfs/dbraw/zinc/36/31/17/525363117.db2.gz CNZIMUCKHCNKOU-CHWSQXEVSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCc2cccnc2)c1 ZINC000037718027 525363481 /nfs/dbraw/zinc/36/34/81/525363481.db2.gz UOCWKMFTLDRBND-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)N(C)C ZINC000276701640 525428877 /nfs/dbraw/zinc/42/88/77/525428877.db2.gz NSGGKXGPDGIJCH-ZDUSSCGKSA-N 0 3 298.386 2.626 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCc2nccn2C1)c1cc(F)ccc1[O-] ZINC000278891689 525506977 /nfs/dbraw/zinc/50/69/77/525506977.db2.gz DSTWOEPAUNGVIF-VXGBXAGGSA-N 0 3 289.354 2.641 20 10 CFCDHN C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000222484636 525532443 /nfs/dbraw/zinc/53/24/43/525532443.db2.gz UNFKFOZKKUBGNX-RYUDHWBXSA-N 0 3 258.369 2.888 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)C1CCCC1)c1cc(F)ccc1[O-] ZINC000290122897 525667935 /nfs/dbraw/zinc/66/79/35/525667935.db2.gz JLCDNIIWCLOAMO-QMTHXVAHSA-N 0 3 267.344 2.733 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC[C@H]2CCCO2)c([O-])c1 ZINC000020146916 525725651 /nfs/dbraw/zinc/72/56/51/525725651.db2.gz SGXHEXYEMCGHHS-HUUCEWRRSA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCN(C)C)c([O-])c1 ZINC000049553635 525739763 /nfs/dbraw/zinc/73/97/63/525739763.db2.gz DIVKWVHBQWDJEY-QWHCGFSZSA-N 0 3 250.386 2.691 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)Cc2ccccc2)c([O-])c1 ZINC000063218409 525741195 /nfs/dbraw/zinc/74/11/95/525741195.db2.gz VUQWOCGAGKVCKK-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([C@@H](O)CNCc2ccc(N(C)C)c(F)c2)o1 ZINC000266054018 525780244 /nfs/dbraw/zinc/78/02/44/525780244.db2.gz VLZMEBVVQWNGTN-HNNXBMFYSA-N 0 3 292.354 2.616 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2ccccc2[O-])cc1 ZINC000237783686 525780772 /nfs/dbraw/zinc/78/07/72/525780772.db2.gz OGRVVUOYSUDLEQ-INIZCTEOSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2[O-])cnn1C ZINC000094617579 525901086 /nfs/dbraw/zinc/90/10/86/525901086.db2.gz WBFJDLJJMCSHCB-VHSXEESVSA-N 0 3 277.343 2.985 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(C)OCCCO2)c([O-])c1C ZINC000277260289 525916764 /nfs/dbraw/zinc/91/67/64/525916764.db2.gz OTQDNWVXGWRPGI-ZDUSSCGKSA-N 0 3 279.380 2.813 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)c([O-])c1 ZINC000293613924 525923147 /nfs/dbraw/zinc/92/31/47/525923147.db2.gz JHNAXOJDXNTMSI-OLZOCXBDSA-N 0 3 250.386 2.549 20 10 CFCDHN Cc1cnccc1CNCc1ccc(N(C)C)cc1 ZINC000228658991 526234275 /nfs/dbraw/zinc/23/42/75/526234275.db2.gz IXRZXPPJIGDPEG-UHFFFAOYSA-N 0 3 255.365 2.746 20 10 CFCDHN Cc1nnc(CC[NH2+][C@@H](C)c2ccc(C)cc2[O-])s1 ZINC000289578528 526330149 /nfs/dbraw/zinc/33/01/49/526330149.db2.gz BIMIDOZZYOTKTJ-JTQLQIEISA-N 0 3 277.393 2.754 20 10 CFCDHN Cc1nnc(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])s1 ZINC000289583001 526330245 /nfs/dbraw/zinc/33/02/45/526330245.db2.gz BODQKMYHIAXLAK-MRVPVSSYSA-N 0 3 281.356 2.585 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCc1cccc(F)c1)OCO2 ZINC000042879780 526336386 /nfs/dbraw/zinc/33/63/86/526336386.db2.gz NZOPDZYXSRYIGA-UHFFFAOYSA-N 0 3 289.306 2.592 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@@H](c3ccco3)C1)OCO2 ZINC000360942516 526336774 /nfs/dbraw/zinc/33/67/74/526336774.db2.gz WCEMBPZVINFWPK-LLVKDONJSA-N 0 3 287.315 2.703 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@@H](c3ccco3)C1)OCO2 ZINC000360942516 526336777 /nfs/dbraw/zinc/33/67/77/526336777.db2.gz WCEMBPZVINFWPK-LLVKDONJSA-N 0 3 287.315 2.703 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@H]1CCCCO1 ZINC000227522023 526348307 /nfs/dbraw/zinc/34/83/07/526348307.db2.gz RLKCPSUIXDJECO-CYBMUJFWSA-N 0 3 253.317 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCCC(F)(F)F ZINC000226611733 526348806 /nfs/dbraw/zinc/34/88/06/526348806.db2.gz IEPNPZYNVXGUNZ-UHFFFAOYSA-N 0 3 251.223 2.963 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCO[C@H](C(F)(F)F)C1 ZINC000287768523 526374126 /nfs/dbraw/zinc/37/41/26/526374126.db2.gz RJOGJBBMGPWDAF-JQWIXIFHSA-N 0 3 275.270 2.592 20 10 CFCDHN Cc1nccn1CCC[N@@H+](C)Cc1cc(F)ccc1[O-] ZINC000290305480 527408408 /nfs/dbraw/zinc/40/84/08/527408408.db2.gz BQXGQPWRNMKAMW-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN Cc1nccn1CCC[N@H+](C)Cc1cc(F)ccc1[O-] ZINC000290305480 527408412 /nfs/dbraw/zinc/40/84/12/527408412.db2.gz BQXGQPWRNMKAMW-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H](O)c2ccco2)c1[O-] ZINC000305780384 651077654 /nfs/dbraw/zinc/07/76/54/651077654.db2.gz OAGCJPLVUDENQE-LBPRGKRZSA-N 0 3 281.739 2.770 20 10 CFCDHN C[C@@H]1C[C@@H]1CN(C)c1ccc(OCCN(C)C)cc1 ZINC000754147663 574077557 /nfs/dbraw/zinc/07/75/57/574077557.db2.gz DMUZTYVHOLEACN-ZIAGYGMSSA-N 0 3 262.397 2.719 20 10 CFCDHN COc1cc(CN2CCCOCC2)c(O)c(C(C)(C)C)c1 ZINC000754719663 574115929 /nfs/dbraw/zinc/11/59/29/574115929.db2.gz GCLOKULIRWLXCJ-UHFFFAOYSA-N 0 3 293.407 2.921 20 10 CFCDHN CCOCCN(CC)Cc1cc(C)cc(OC)c1O ZINC000754726038 574116977 /nfs/dbraw/zinc/11/69/77/574116977.db2.gz KDCUPJLNIOLDAI-UHFFFAOYSA-N 0 3 267.369 2.568 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccncc21)[C@H]1CCN(C2CC2)C1 ZINC000732188781 574146172 /nfs/dbraw/zinc/14/61/72/574146172.db2.gz MUWOUKJRRGSWGV-HNNXBMFYSA-N 0 3 297.402 2.609 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccncc21)[C@H]1CCN(C2CC2)C1 ZINC000732188781 574146174 /nfs/dbraw/zinc/14/61/74/574146174.db2.gz MUWOUKJRRGSWGV-HNNXBMFYSA-N 0 3 297.402 2.609 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCCN(C)C)c2c1c(F)ccc2[O-] ZINC000756342547 574227283 /nfs/dbraw/zinc/22/72/83/574227283.db2.gz KOXPZVASGJFXGB-PWSUYJOCSA-N 0 3 266.360 2.621 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CCCC2)c([O-])c1C ZINC000756355993 574228755 /nfs/dbraw/zinc/22/87/55/574228755.db2.gz VDSJETCDHJBYLV-CQSZACIVSA-N 0 3 262.397 2.755 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C2CCN(C)CC2)c2c1c(F)ccc2[O-] ZINC000756364596 574230031 /nfs/dbraw/zinc/23/00/31/574230031.db2.gz VEYUKARVBMBWQR-GXFFZTMASA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccco1)c1cc(F)ccc1[O-] ZINC000756382100 574231852 /nfs/dbraw/zinc/23/18/52/574231852.db2.gz QXQJZIWXDMQGSP-TVQRCGJNSA-N 0 3 265.284 2.509 20 10 CFCDHN C[C@H](Cn1ccnc1)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756401655 574234065 /nfs/dbraw/zinc/23/40/65/574234065.db2.gz JEVUUCSBYPRGTF-LOWVWBTDSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756445263 574238190 /nfs/dbraw/zinc/23/81/90/574238190.db2.gz ZMAWXHZYRSEQOM-MFKMUULPSA-N 0 3 289.354 2.645 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756457167 574238894 /nfs/dbraw/zinc/23/88/94/574238894.db2.gz HFWDBSYYANGGFS-JQWIXIFHSA-N 0 3 294.370 2.586 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CC3)C2)c([O-])c1C ZINC000756545673 574245579 /nfs/dbraw/zinc/24/55/79/574245579.db2.gz NSQSSMWBNXLKAS-ZIAGYGMSSA-N 0 3 274.408 2.896 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CC3)C2)c([O-])c1C ZINC000756545670 574245943 /nfs/dbraw/zinc/24/59/43/574245943.db2.gz NSQSSMWBNXLKAS-UONOGXRCSA-N 0 3 274.408 2.896 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c1 ZINC000756555765 574246862 /nfs/dbraw/zinc/24/68/62/574246862.db2.gz VOHDYEARGDDSGK-HIFRSBDPSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c([O-])c1 ZINC000756555578 574247325 /nfs/dbraw/zinc/24/73/25/574247325.db2.gz SLFHAOJXZOSRBZ-UKRRQHHQSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2(O)CCCC2)c2c1c(F)ccc2[O-] ZINC000756571740 574248886 /nfs/dbraw/zinc/24/88/86/574248886.db2.gz DQPOUGLLSORYCJ-ZYHUDNBSSA-N 0 3 279.355 2.974 20 10 CFCDHN CCCCN(C)CC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000756576798 574249986 /nfs/dbraw/zinc/24/99/86/574249986.db2.gz OYDPMODPDXQUDV-CYBMUJFWSA-N 0 3 280.412 2.783 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)c2ccc(C)o2)c1 ZINC000756606016 574251611 /nfs/dbraw/zinc/25/16/11/574251611.db2.gz KOZLUDZQBUXRJU-NHYWBVRUSA-N 0 3 291.347 2.686 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756603003 574251623 /nfs/dbraw/zinc/25/16/23/574251623.db2.gz HLSFLYPWMSIIBS-OLZOCXBDSA-N 0 3 283.437 2.774 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](CO)Cc2ccco2)c([O-])c1 ZINC000756661190 574256497 /nfs/dbraw/zinc/25/64/97/574256497.db2.gz PMINSCLLLRBTDY-UONOGXRCSA-N 0 3 289.375 2.795 20 10 CFCDHN Cc1n[nH]cc1C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756736677 574260051 /nfs/dbraw/zinc/26/00/51/574260051.db2.gz CCNMBCUXJFKVJR-PELKAZGASA-N 0 3 275.327 2.901 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@H](C)c2cc(F)ccc2[O-])n1 ZINC000756747568 574260375 /nfs/dbraw/zinc/26/03/75/574260375.db2.gz QSPCCGHZGMCCIR-GFCCVEGCSA-N 0 3 289.354 2.997 20 10 CFCDHN C[C@H](CC[S@](C)=O)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756743236 574260665 /nfs/dbraw/zinc/26/06/65/574260665.db2.gz QVGPLXXHCHIZME-RDBNXMJASA-N 0 3 299.411 2.826 20 10 CFCDHN Cc1c(C[NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)cnn1C ZINC000756774511 574261868 /nfs/dbraw/zinc/26/18/68/574261868.db2.gz DKAJWTPEYBTHGO-RNCFNFMXSA-N 0 3 289.354 2.911 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]3COCC[C@H]31)CCC2 ZINC000756884766 574270782 /nfs/dbraw/zinc/27/07/82/574270782.db2.gz JFRGNDWXOGYQMJ-NVXWUHKLSA-N 0 3 287.403 2.882 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]3COCC[C@H]31)CCC2 ZINC000756884766 574270784 /nfs/dbraw/zinc/27/07/84/574270784.db2.gz JFRGNDWXOGYQMJ-NVXWUHKLSA-N 0 3 287.403 2.882 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C)Cc2ccncc2)c1[O-] ZINC000749297148 574288485 /nfs/dbraw/zinc/28/84/85/574288485.db2.gz TZMHPGXGMYASIF-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN CCOc1ccc(O)c(CNC(C)(C)c2cnn(C)c2)c1 ZINC000742374020 574325533 /nfs/dbraw/zinc/32/55/33/574325533.db2.gz OXYOEPJHPAERJO-UHFFFAOYSA-N 0 3 289.379 2.549 20 10 CFCDHN CN(C)C(=O)C[C@@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000725846875 574328280 /nfs/dbraw/zinc/32/82/80/574328280.db2.gz WABYOFBOSVCYDP-MRXNPFEDSA-N 0 3 298.386 2.701 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CC)C[C@H](C)CO)c([O-])c1 ZINC000743499651 574366878 /nfs/dbraw/zinc/36/68/78/574366878.db2.gz MNKOYAPSDDOTAR-JSGCOSHPSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H](CC)C[C@H](C)CO)c1 ZINC000743499710 574366952 /nfs/dbraw/zinc/36/69/52/574366952.db2.gz PPKHCUHAMWYICU-JSGCOSHPSA-N 0 3 281.396 2.678 20 10 CFCDHN CO[C@H]1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000751944921 574385671 /nfs/dbraw/zinc/38/56/71/574385671.db2.gz JEVXWWCIUPCFFR-ZDUSSCGKSA-N 0 3 279.380 2.616 20 10 CFCDHN Cc1ccsc1[C@H](CO)NCc1ccc(N(C)C)cc1 ZINC000751991093 574386359 /nfs/dbraw/zinc/38/63/59/574386359.db2.gz MUGTYEQVIYTMGT-HNNXBMFYSA-N 0 3 290.432 2.946 20 10 CFCDHN CO[C@@H]1C[C@@H]([NH2+]Cc2cc(C)c(C)cc2[O-])C1(C)C ZINC000753372820 574401726 /nfs/dbraw/zinc/40/17/26/574401726.db2.gz IYZMIQUBUXPXMR-HUUCEWRRSA-N 0 3 263.381 2.912 20 10 CFCDHN CC[N@H+](Cc1ccc(OC)c(OC)c1[O-])C(C)C ZINC000891570680 617671445 /nfs/dbraw/zinc/67/14/45/617671445.db2.gz CKTOLNJSSCHSOP-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN CC[N@@H+](Cc1ccc(OC)c(OC)c1[O-])C(C)C ZINC000891570680 617671448 /nfs/dbraw/zinc/67/14/48/617671448.db2.gz CKTOLNJSSCHSOP-UHFFFAOYSA-N 0 3 253.342 2.640 20 10 CFCDHN CC[N@@H+](Cc1ccc(OC)c(OC)c1[O-])CC1CC1 ZINC000892035332 617920545 /nfs/dbraw/zinc/92/05/45/617920545.db2.gz GTXGIBHHXHFXOE-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN CC[N@H+](Cc1ccc(OC)c(OC)c1[O-])CC1CC1 ZINC000892035332 617920547 /nfs/dbraw/zinc/92/05/47/617920547.db2.gz GTXGIBHHXHFXOE-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN Cc1noc(C)c1[C@@H](C)NCc1cc2c(cc1O)OCO2 ZINC000078679824 617989798 /nfs/dbraw/zinc/98/97/98/617989798.db2.gz REHNWWFDCFCYIV-MRVPVSSYSA-N 0 3 290.319 2.577 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2c([O-])cccc2Cl)CCN1C ZINC000090721209 618156914 /nfs/dbraw/zinc/15/69/14/618156914.db2.gz WEVUQMUJFZKNMC-WDEREUQCSA-N 0 3 268.788 2.618 20 10 CFCDHN COC(=O)[C@@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C ZINC000280268802 618230156 /nfs/dbraw/zinc/23/01/56/618230156.db2.gz MJYZIKNBYDTNBK-IUODEOHRSA-N 0 3 299.370 2.786 20 10 CFCDHN COC(=O)[C@@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C ZINC000280268802 618230157 /nfs/dbraw/zinc/23/01/57/618230157.db2.gz MJYZIKNBYDTNBK-IUODEOHRSA-N 0 3 299.370 2.786 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@H]21 ZINC000894096431 618323018 /nfs/dbraw/zinc/32/30/18/618323018.db2.gz UZWOIHGIDBCKJP-IAQYHMDHSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cc(F)cc(F)c3[O-])CC[C@H]21 ZINC000894096431 618323020 /nfs/dbraw/zinc/32/30/20/618323020.db2.gz UZWOIHGIDBCKJP-IAQYHMDHSA-N 0 3 296.361 2.587 20 10 CFCDHN CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OC)cc2[O-])C1 ZINC000894186329 618432890 /nfs/dbraw/zinc/43/28/90/618432890.db2.gz VGCFJVPMBAZGKZ-UKRRQHHQSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cc(C)cc(CNCc2ccoc2C)c1O ZINC000894199003 618438564 /nfs/dbraw/zinc/43/85/64/618438564.db2.gz JFQFDENDHWRHPM-UHFFFAOYSA-N 0 3 261.321 2.900 20 10 CFCDHN CCOc1ccc(C[NH2+]C(C)(C)CCOC)c([O-])c1 ZINC000747100726 618440639 /nfs/dbraw/zinc/44/06/39/618440639.db2.gz PTUKDBPPQIWQDT-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN Cc1ccncc1CNCc1ccc2c(c1)CCO2 ZINC000162681135 618457312 /nfs/dbraw/zinc/45/73/12/618457312.db2.gz JTWKXLBWYQGBGL-UHFFFAOYSA-N 0 3 254.333 2.615 20 10 CFCDHN CC1=NO[C@H](CNC/C=C/c2ccc(N(C)C)cc2)C1 ZINC000895300769 618520212 /nfs/dbraw/zinc/52/02/12/618520212.db2.gz TXGPSYYOVJTXEJ-APHBUQMISA-N 0 3 273.380 2.520 20 10 CFCDHN CC1=NO[C@@H](CNC/C=C/c2ccc(N(C)C)cc2)C1 ZINC000895300771 618520304 /nfs/dbraw/zinc/52/03/04/618520304.db2.gz TXGPSYYOVJTXEJ-DWTRPJMMSA-N 0 3 273.380 2.520 20 10 CFCDHN COc1cc(C)cc(CN2CC(Cc3ccco3)C2)c1O ZINC000895393741 618565671 /nfs/dbraw/zinc/56/56/71/618565671.db2.gz MRKQCUUACAECSR-UHFFFAOYSA-N 0 3 287.359 2.977 20 10 CFCDHN Cc1ccnc(N)c1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000895459391 618596461 /nfs/dbraw/zinc/59/64/61/618596461.db2.gz AJCXTDMFQGGLMC-NSHDSACASA-N 0 3 257.337 2.529 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000311806225 618723931 /nfs/dbraw/zinc/72/39/31/618723931.db2.gz CCDYLGZCUWRRQT-TZMCWYRMSA-N 0 3 262.397 2.699 20 10 CFCDHN CN(Cc1ccccc1O)C(=O)[C@@H](N)CC1CCCCC1 ZINC000314578726 618849727 /nfs/dbraw/zinc/84/97/27/618849727.db2.gz VQRNZTQVWAPFLC-HNNXBMFYSA-N 0 3 290.407 2.648 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@]2(C)CCCO2)c1[O-] ZINC000184710189 619067298 /nfs/dbraw/zinc/06/72/98/619067298.db2.gz ADMDFZCFIZIMIQ-CQSZACIVSA-N 0 3 285.771 2.713 20 10 CFCDHN C[C@@H](NCc1cc(N)ccn1)c1ccc(N(C)C)cc1 ZINC000925770390 619082684 /nfs/dbraw/zinc/08/26/84/619082684.db2.gz HGODJTWYNLHLDN-GFCCVEGCSA-N 0 3 270.380 2.581 20 10 CFCDHN CC1(C)CCC[C@@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000094266018 619102524 /nfs/dbraw/zinc/10/25/24/619102524.db2.gz QYPALKCMRKMKLI-AWEZNQCLSA-N 0 3 263.337 2.789 20 10 CFCDHN C[C@H]([NH2+]CCc1cscn1)c1cc(F)ccc1[O-] ZINC000094618223 619133055 /nfs/dbraw/zinc/13/30/55/619133055.db2.gz IIIGGFPIRQBUKQ-VIFPVBQESA-N 0 3 266.341 2.881 20 10 CFCDHN CC(C)COCCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000226583414 619152781 /nfs/dbraw/zinc/15/27/81/619152781.db2.gz ZNBBCOPRTZIJTC-UHFFFAOYSA-N 0 3 255.333 2.684 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCOC12CCCCC2 ZINC000924901014 619270553 /nfs/dbraw/zinc/27/05/53/619270553.db2.gz GJVSNYCFSOWUEU-OAHLLOKOSA-N 0 3 261.365 2.974 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000319895468 619365721 /nfs/dbraw/zinc/36/57/21/619365721.db2.gz YJHLJQFXEGMVQL-HNNXBMFYSA-N 0 3 296.370 2.529 20 10 CFCDHN CCc1cccc(NC(=O)CNCc2cccc(C)c2O)c1 ZINC000895039694 619531078 /nfs/dbraw/zinc/53/10/78/619531078.db2.gz QXFHNGRAOUVHHM-UHFFFAOYSA-N 0 3 298.386 2.991 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCN(Cc2ccc(C)cc2O)C1 ZINC000895573772 619557384 /nfs/dbraw/zinc/55/73/84/619557384.db2.gz MGBYRVKZAMKCNK-ZDUSSCGKSA-N 0 3 289.297 2.854 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCN(Cc2cc(C)ccc2O)C1 ZINC000895577707 619559420 /nfs/dbraw/zinc/55/94/20/619559420.db2.gz RMGJDMKMHMSMKZ-CYBMUJFWSA-N 0 3 289.297 2.854 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2ccns2)c(O)c1OC ZINC000895662712 619578499 /nfs/dbraw/zinc/57/84/99/619578499.db2.gz LYKZXFLSSMJLGV-VIFPVBQESA-N 0 3 294.376 2.717 20 10 CFCDHN CN(C)c1cc(F)c(CN2C[C@@H]3CSC[C@@H]3C2)cc1F ZINC000895776273 619604104 /nfs/dbraw/zinc/60/41/04/619604104.db2.gz AZRNXTMZXDBOPC-TXEJJXNPSA-N 0 3 298.402 2.826 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000895791750 619608148 /nfs/dbraw/zinc/60/81/48/619608148.db2.gz UXVXBKIJBGWLOE-ZDUSSCGKSA-N 0 3 265.328 2.580 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(Nc2ccccn2)CC1 ZINC000896197817 619691870 /nfs/dbraw/zinc/69/18/70/619691870.db2.gz IRLMPFIZTMZZAB-UHFFFAOYSA-N 0 3 283.375 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896490398 619744724 /nfs/dbraw/zinc/74/47/24/619744724.db2.gz SJYOFGACORKKPE-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896490398 619744726 /nfs/dbraw/zinc/74/47/26/619744726.db2.gz SJYOFGACORKKPE-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(c3ccn(C)n3)CC2)c([O-])c1 ZINC000896494358 619748701 /nfs/dbraw/zinc/74/87/01/619748701.db2.gz IGPOBPRSTPTEPY-UHFFFAOYSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CCC2(CCOCC2)O1 ZINC000896921902 619890097 /nfs/dbraw/zinc/89/00/97/619890097.db2.gz UFAQXOKODRZMRZ-AWEZNQCLSA-N 0 3 291.391 2.518 20 10 CFCDHN CSCC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000896937457 619900549 /nfs/dbraw/zinc/90/05/49/619900549.db2.gz UMJROYKYNDIDKK-UHFFFAOYSA-N 0 3 251.395 2.967 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1cc(F)ccc1[O-])c1cnn(C)c1 ZINC000897080836 619926109 /nfs/dbraw/zinc/92/61/09/619926109.db2.gz DGZSGSVCBXTXGC-OAHLLOKOSA-N 0 3 277.343 2.752 20 10 CFCDHN COC(=O)c1ccccc1CC[NH2+]Cc1ccc(C)cc1[O-] ZINC000897310844 619977364 /nfs/dbraw/zinc/97/73/64/619977364.db2.gz INAWBFFHLGBIDR-UHFFFAOYSA-N 0 3 299.370 2.820 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1COc3ccccc3O1)CC2 ZINC000321014829 620081132 /nfs/dbraw/zinc/08/11/32/620081132.db2.gz SPXQKKGZSLCJHC-KBPBESRZSA-N 0 3 297.354 2.809 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN(C)Cc1cccc(=O)[nH]1 ZINC000897391183 620091984 /nfs/dbraw/zinc/09/19/84/620091984.db2.gz HRPVATRONPTJGY-UHFFFAOYSA-N 0 3 285.391 2.794 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@@H](C3CC3)O2)c([O-])c1 ZINC000897501051 620192274 /nfs/dbraw/zinc/19/22/74/620192274.db2.gz LTTJZRNLRQRUDA-HOCLYGCPSA-N 0 3 261.365 2.748 20 10 CFCDHN COC(=O)C[C@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)(C)C ZINC000897889235 620299067 /nfs/dbraw/zinc/29/90/67/620299067.db2.gz OQSLWBSPIVVYLO-ZDUSSCGKSA-N 0 3 283.343 2.599 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2cncs2)c(O)c1OC ZINC000897929074 620305215 /nfs/dbraw/zinc/30/52/15/620305215.db2.gz MDDUZIOKSPFFFY-VIFPVBQESA-N 0 3 294.376 2.717 20 10 CFCDHN Cc1cccc(CN[C@H]2c3ccccc3OC[C@H]2CO)c1O ZINC000897950857 620309748 /nfs/dbraw/zinc/30/97/48/620309748.db2.gz VDTPXRVIYPIWFN-RHSMWYFYSA-N 0 3 299.370 2.532 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)Cc2cccnc2)c([O-])c1 ZINC000897964933 620313912 /nfs/dbraw/zinc/31/39/12/620313912.db2.gz KYRYWQUMSUWDTC-CYBMUJFWSA-N 0 3 256.349 2.816 20 10 CFCDHN CC[C@H]([NH2+]CC1(N)CC1)c1cc(Cl)ccc1[O-] ZINC000902404311 621069546 /nfs/dbraw/zinc/06/95/46/621069546.db2.gz DKDWMXBADRHSGV-NSHDSACASA-N 0 3 254.761 2.578 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccccc1[O-] ZINC000903263806 621304287 /nfs/dbraw/zinc/30/42/87/621304287.db2.gz LMPXHQUCJRKVOU-IPYPFGDCSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCN2C)c1[O-] ZINC000903318663 621332050 /nfs/dbraw/zinc/33/20/50/621332050.db2.gz ROIOHKQOOGTAGG-PWSUYJOCSA-N 0 3 268.788 2.709 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1Cc3ccccc3[C@@H]1O)CC2 ZINC000903440597 621377505 /nfs/dbraw/zinc/37/75/05/621377505.db2.gz RAZHOOKRDYUJLL-MPGHIAIKSA-N 0 3 281.355 2.627 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@]2(C1)CCCC[NH2+]2 ZINC000904429924 621594773 /nfs/dbraw/zinc/59/47/73/621594773.db2.gz BMSCCDOJTWTHTC-HNNXBMFYSA-N 0 3 280.799 2.764 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccccc2[N+](=O)[O-])c1 ZINC000071408844 625515646 /nfs/dbraw/zinc/51/56/46/625515646.db2.gz IWIDPCJQLULALY-UHFFFAOYSA-N 0 3 272.304 2.899 20 10 CFCDHN C[C@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1cc([O-])cs1 ZINC000912651770 622755133 /nfs/dbraw/zinc/75/51/33/622755133.db2.gz ZDTFCDSGNMCWJO-NWDGAFQWSA-N 0 3 296.436 2.789 20 10 CFCDHN CCCC[C@@H](COC)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877049906 623023597 /nfs/dbraw/zinc/02/35/97/623023597.db2.gz IOPZYZNDSDIUOB-AWEZNQCLSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1cccc(CNCc2ccccc2[N+](=O)[O-])c1O ZINC000158106924 623093818 /nfs/dbraw/zinc/09/38/18/623093818.db2.gz DEUNOROSWQACOC-UHFFFAOYSA-N 0 3 272.304 2.899 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(CO)cc1)c1cc(F)ccc1[O-] ZINC000227464631 623110584 /nfs/dbraw/zinc/11/05/84/623110584.db2.gz RDUXYRKMLWAPQC-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN C[N@@H+]1C[C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000822520577 623119643 /nfs/dbraw/zinc/11/96/43/623119643.db2.gz HMHNKKSTPRSVND-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1C[C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000822520577 623119647 /nfs/dbraw/zinc/11/96/47/623119647.db2.gz HMHNKKSTPRSVND-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)C(=O)NC(C)C)cc1 ZINC000228929639 623169808 /nfs/dbraw/zinc/16/98/08/623169808.db2.gz NBXJWNBCYJHFPD-CQSZACIVSA-N 0 3 291.439 2.536 20 10 CFCDHN CCCN1CCN(Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000184670797 625634140 /nfs/dbraw/zinc/63/41/40/625634140.db2.gz ZZANMIRKZDCKGU-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)CC(C)C)c([O-])c1 ZINC000230660067 623291376 /nfs/dbraw/zinc/29/13/76/623291376.db2.gz YQVRPUDKNGQIJC-STQMWFEESA-N 0 3 251.370 2.758 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)C2CCOCC2)c1[O-] ZINC000230935221 623310385 /nfs/dbraw/zinc/31/03/85/623310385.db2.gz OLUVBPDZIWMHNS-JTQLQIEISA-N 0 3 299.798 2.959 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)CC2 ZINC000311948731 623485885 /nfs/dbraw/zinc/48/58/85/623485885.db2.gz XKVGIYQJCPHAAR-IACUBPJLSA-N 0 3 261.365 2.520 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](OC)[C@@H](C)CC)c([O-])c1 ZINC000824596805 623529692 /nfs/dbraw/zinc/52/96/92/623529692.db2.gz LPNKRDUBJTTWDT-LRDDRELGSA-N 0 3 281.396 2.942 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@H](CO)CC(C)(C)C ZINC000825040309 623613491 /nfs/dbraw/zinc/61/34/91/623613491.db2.gz GAOAYMZJEVHYJW-ZDUSSCGKSA-N 0 3 251.370 2.621 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@H](CO)CC(C)(C)C ZINC000825040309 623613497 /nfs/dbraw/zinc/61/34/97/623613497.db2.gz GAOAYMZJEVHYJW-ZDUSSCGKSA-N 0 3 251.370 2.621 20 10 CFCDHN CCN1CCC([NH2+]Cc2cc(Cl)c(C)cc2[O-])CC1 ZINC000825050508 623617172 /nfs/dbraw/zinc/61/71/72/623617172.db2.gz RILXKVHOPOICHS-UHFFFAOYSA-N 0 3 282.815 2.928 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2COCC2(C)C)c1[O-] ZINC000825090527 623627299 /nfs/dbraw/zinc/62/72/99/623627299.db2.gz BEZVHQMQAYBSGU-GFCCVEGCSA-N 0 3 269.772 2.869 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)c2cnn(CC)c2)c([O-])c1 ZINC000825129700 623636697 /nfs/dbraw/zinc/63/66/97/623636697.db2.gz AZYDDSHIMJLBHY-GFCCVEGCSA-N 0 3 289.379 2.858 20 10 CFCDHN CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000825300280 623666735 /nfs/dbraw/zinc/66/67/35/623666735.db2.gz ZAHYVUUAFBRMBF-UKRRQHHQSA-N 0 3 267.344 2.969 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2cccc(OC)c2[O-])CC1 ZINC000825321859 623671386 /nfs/dbraw/zinc/67/13/86/623671386.db2.gz PLGLQJPPWIVKTR-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2cccc(OC)c2[O-])CC1 ZINC000825321859 623671387 /nfs/dbraw/zinc/67/13/87/623671387.db2.gz PLGLQJPPWIVKTR-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CC1(C)CCC(O)(C[NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000232810727 623825738 /nfs/dbraw/zinc/82/57/38/623825738.db2.gz XOYGOEHLELGDPX-UHFFFAOYSA-N 0 3 281.371 2.952 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@]3(C)COC[C@]3(C)C2)c([O-])c1 ZINC000827017701 623925537 /nfs/dbraw/zinc/92/55/37/623925537.db2.gz INFGPHSDNKWLMY-CALCHBBNSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)c([O-])c1 ZINC000827017701 623925540 /nfs/dbraw/zinc/92/55/40/623925540.db2.gz INFGPHSDNKWLMY-CALCHBBNSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2C[C@@H](C)C(O)[C@H](C)C2)c1[O-] ZINC000827151657 623955015 /nfs/dbraw/zinc/95/50/15/623955015.db2.gz HRLHDFHFKZNEOZ-GHMZBOCLSA-N 0 3 283.799 2.803 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1COc2cc(F)ccc2C1 ZINC000827261208 623977139 /nfs/dbraw/zinc/97/71/39/623977139.db2.gz XWZCSWAVYTWJFG-AWEZNQCLSA-N 0 3 291.297 2.764 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccc3c(c1)OCO3)CC2 ZINC000834497232 625695250 /nfs/dbraw/zinc/69/52/50/625695250.db2.gz ZWAQAIBKLFZNDM-CQSZACIVSA-N 0 3 297.354 2.941 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@@H]1[NH2+]Cc1ccccc1[O-] ZINC000827751363 624085351 /nfs/dbraw/zinc/08/53/51/624085351.db2.gz TZDXWKNUXFCXTA-GOEBONIOSA-N 0 3 277.364 2.604 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc(CO)c(F)c1)CC2 ZINC000834531405 625702933 /nfs/dbraw/zinc/70/29/33/625702933.db2.gz YSDSAXAVVNXCAD-HNNXBMFYSA-N 0 3 287.334 2.801 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@H](C1CC1)C1CCC1)OCO2 ZINC000324663723 624230213 /nfs/dbraw/zinc/23/02/13/624230213.db2.gz IXRZVEBUEVIOBU-INIZCTEOSA-N 0 3 275.348 2.789 20 10 CFCDHN Cc1cc(O)c(CN(C)Cc2cccc(C(N)=O)c2)cc1C ZINC000918179037 624426544 /nfs/dbraw/zinc/42/65/44/624426544.db2.gz AMMICZSSWTVMAU-UHFFFAOYSA-N 0 3 298.386 2.740 20 10 CFCDHN c1cncc(CNCc2ccc3c(c2)CCCO3)c1 ZINC000921472876 624903791 /nfs/dbraw/zinc/90/37/91/624903791.db2.gz VMODRMQHTCXUAR-UHFFFAOYSA-N 0 3 254.333 2.696 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N(C)Cc1ccccc1)c1ccccc1[O-] ZINC000179889314 624982924 /nfs/dbraw/zinc/98/29/24/624982924.db2.gz JWACFWNTLXWJNP-CQSZACIVSA-N 0 3 298.386 2.701 20 10 CFCDHN CSC[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000180219521 625004643 /nfs/dbraw/zinc/00/46/43/625004643.db2.gz GFWOIOZIJZVBEK-LBPRGKRZSA-N 0 3 255.358 2.859 20 10 CFCDHN CSC[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000180219521 625004650 /nfs/dbraw/zinc/00/46/50/625004650.db2.gz GFWOIOZIJZVBEK-LBPRGKRZSA-N 0 3 255.358 2.859 20 10 CFCDHN N#Cc1ccc(CNCc2cc(F)ccc2O)c(F)c1 ZINC000180654810 625032246 /nfs/dbraw/zinc/03/22/46/625032246.db2.gz WHUXXZUHLDOHCE-UHFFFAOYSA-N 0 3 274.270 2.832 20 10 CFCDHN O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000180682060 625033033 /nfs/dbraw/zinc/03/30/33/625033033.db2.gz LCHWAPXADRTCKD-UHFFFAOYSA-N 0 3 290.294 2.772 20 10 CFCDHN CCCN(CC)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185632047 625751623 /nfs/dbraw/zinc/75/16/23/625751623.db2.gz RXKADGJFDIAZFP-LBPRGKRZSA-N 0 3 268.376 2.914 20 10 CFCDHN Oc1cccc2c1[C@@H](NCc1cccc(F)n1)CC2 ZINC000834689231 625786274 /nfs/dbraw/zinc/78/62/74/625786274.db2.gz KMPHDTMZZIYRPZ-LBPRGKRZSA-N 0 3 258.296 2.703 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1cnc(C3CC3)nc1)CC2 ZINC000834693725 625787572 /nfs/dbraw/zinc/78/75/72/625787572.db2.gz QICAWQHYJBRUIJ-HNNXBMFYSA-N 0 3 295.386 2.879 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1cnc(C3CC3)nc1)CC2 ZINC000834693727 625788647 /nfs/dbraw/zinc/78/86/47/625788647.db2.gz QICAWQHYJBRUIJ-OAHLLOKOSA-N 0 3 295.386 2.879 20 10 CFCDHN C[C@H]([NH2+]CC1(CF)CCOCC1)c1ccccc1[O-] ZINC000834884820 625908721 /nfs/dbraw/zinc/90/87/21/625908721.db2.gz CVBZCAWMGCWSQW-LBPRGKRZSA-N 0 3 267.344 2.809 20 10 CFCDHN CNC(=O)C[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834900182 625915588 /nfs/dbraw/zinc/91/55/88/625915588.db2.gz NCHRCEULVYOVAU-UWVGGRQHSA-N 0 3 284.787 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@]2(C)CCC(=O)N2)c1[O-] ZINC000834907845 625919301 /nfs/dbraw/zinc/91/93/01/625919301.db2.gz DJWFIGUXQRSXJV-ZUZCIYMTSA-N 0 3 296.798 2.673 20 10 CFCDHN Cc1ncccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000834909643 625919949 /nfs/dbraw/zinc/91/99/49/625919949.db2.gz CDYLQXLKMIRZCQ-YPMHNXCESA-N 0 3 299.374 2.773 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cn(C)cn1)c1ccc(C)cc1[O-] ZINC000840766303 625921524 /nfs/dbraw/zinc/92/15/24/625921524.db2.gz LVZLVSCDARFTDC-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2NCc1ccc2c(c1)CCCO2 ZINC000921527928 625978661 /nfs/dbraw/zinc/97/86/61/625978661.db2.gz QJLIUQWDLBFRGI-INIZCTEOSA-N 0 3 297.402 2.912 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000085972908 626215228 /nfs/dbraw/zinc/21/52/28/626215228.db2.gz QXQUJISCGIZCNG-NFAWXSAZSA-N 0 3 263.381 2.902 20 10 CFCDHN CCCOc1ccc(CN[C@@H](C)C(OC)OC)cc1C ZINC000922314094 626267261 /nfs/dbraw/zinc/26/72/61/626267261.db2.gz IMCLWAKFGBSDCX-ZDUSSCGKSA-N 0 3 281.396 2.881 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)C(C)(C)OC)c([O-])c1 ZINC000922583409 626317773 /nfs/dbraw/zinc/31/77/73/626317773.db2.gz XCYNLEITVROQLH-NSHDSACASA-N 0 3 267.369 2.694 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCC2(CCC2)O1 ZINC000922812468 626369013 /nfs/dbraw/zinc/36/90/13/626369013.db2.gz MVSHURZAMWFEFG-CYBMUJFWSA-N 0 3 291.391 2.982 20 10 CFCDHN CCOc1ccc(CNCc2c(C)noc2CC)c(O)c1 ZINC000922987683 626439633 /nfs/dbraw/zinc/43/96/33/626439633.db2.gz HQCARTLXYCSNBA-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@H](OC)C23CCC3)c([O-])c1 ZINC000839179856 626529709 /nfs/dbraw/zinc/52/97/09/626529709.db2.gz ALQUIULUAINGGI-HOTGVXAUSA-N 0 3 291.391 2.838 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CCC[C@@H]3COC[C@@H]32)cc1 ZINC000839190235 626530571 /nfs/dbraw/zinc/53/05/71/626530571.db2.gz FFDRLDAEKLQLTB-JVEBIPGUSA-N 0 3 286.419 2.877 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2ccccc2NC1=O)c1ccccc1[O-] ZINC000839539226 626546371 /nfs/dbraw/zinc/54/63/71/626546371.db2.gz RQBNEJSTFWEHLR-MLGOLLRUSA-N 0 3 296.370 2.996 20 10 CFCDHN C[C@H](O)C[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000757654293 626557272 /nfs/dbraw/zinc/55/72/72/626557272.db2.gz DJMGFVRODUTVGD-FYLLDIAZSA-N 0 3 267.344 2.829 20 10 CFCDHN CC[NH+](CC)[C@@H](CNC(=O)c1cc([O-])cs1)CC(C)C ZINC000759274521 626641731 /nfs/dbraw/zinc/64/17/31/626641731.db2.gz TWKFAGCONORFGL-GFCCVEGCSA-N 0 3 298.452 2.940 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000760897094 626782965 /nfs/dbraw/zinc/78/29/65/626782965.db2.gz PDCYUBVVQRJOKW-GXFFZTMASA-N 0 3 289.354 2.645 20 10 CFCDHN Cc1cc(O)c(CNCc2ccc(F)cn2)cc1C ZINC000763517846 626993784 /nfs/dbraw/zinc/99/37/84/626993784.db2.gz IEIOADCHAFRCCB-UHFFFAOYSA-N 0 3 260.312 2.833 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CCO)C2CCOCC2)c([O-])c1 ZINC000763559052 626997931 /nfs/dbraw/zinc/99/79/31/626997931.db2.gz QJCIKRMXKFNCCD-XJKSGUPXSA-N 0 3 293.407 2.529 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1CC[C@H](O)C1 ZINC000768408644 627342246 /nfs/dbraw/zinc/34/22/46/627342246.db2.gz CPKAYLDLOSIPNK-INIZCTEOSA-N 0 3 269.344 2.626 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@H](O)C1 ZINC000768408644 627342248 /nfs/dbraw/zinc/34/22/48/627342248.db2.gz CPKAYLDLOSIPNK-INIZCTEOSA-N 0 3 269.344 2.626 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](COC)C2)c([O-])c1 ZINC000769402562 627434856 /nfs/dbraw/zinc/43/48/56/627434856.db2.gz KBUGJRREYHQLTC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](COC)C2)c([O-])c1 ZINC000769402562 627434861 /nfs/dbraw/zinc/43/48/61/627434861.db2.gz KBUGJRREYHQLTC-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](OC)C2)cc1F ZINC000769452679 627440575 /nfs/dbraw/zinc/44/05/75/627440575.db2.gz YINDZHKGDQUESC-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(CC)(CO)CC2)c([O-])c1 ZINC000769469398 627444477 /nfs/dbraw/zinc/44/44/77/627444477.db2.gz XIWCRHMGKKPBCE-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000769513826 627450124 /nfs/dbraw/zinc/45/01/24/627450124.db2.gz FOEGLJWHBVPBIR-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000769513826 627450125 /nfs/dbraw/zinc/45/01/25/627450125.db2.gz FOEGLJWHBVPBIR-HIFRSBDPSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCOCC2CC2)c([O-])c1 ZINC000769525891 627452378 /nfs/dbraw/zinc/45/23/78/627452378.db2.gz YTMNOWHRFDEZPT-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCOCC2CC2)c([O-])c1 ZINC000769525891 627452379 /nfs/dbraw/zinc/45/23/79/627452379.db2.gz YTMNOWHRFDEZPT-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CC(C)(C)OC(=O)CCCC[NH2+]Cc1ccccc1[O-] ZINC000773428265 627817993 /nfs/dbraw/zinc/81/79/93/627817993.db2.gz OVQAPTZYOABLQC-UHFFFAOYSA-N 0 3 279.380 2.994 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](O)c1ccc(C)cc1 ZINC000775028786 627985900 /nfs/dbraw/zinc/98/59/00/627985900.db2.gz SVAWCSFGBAVUJR-MRXNPFEDSA-N 0 3 287.359 2.532 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@@H]1CCCO1)c1ccccc1[O-] ZINC000775414670 628023226 /nfs/dbraw/zinc/02/32/26/628023226.db2.gz KDTAOUWPTORYHU-DZGCQCFKSA-N 0 3 279.380 2.629 20 10 CFCDHN CC[C@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1ccccc1[O-] ZINC000775511703 628033258 /nfs/dbraw/zinc/03/32/58/628033258.db2.gz IGYKISBJCVPDFM-GOEBONIOSA-N 0 3 294.464 2.870 20 10 CFCDHN CCN1C[C@@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000775713977 628058254 /nfs/dbraw/zinc/05/82/54/628058254.db2.gz XZUWOIZMWKVMOE-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN1C[C@@H](C)[N@@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000775713977 628058260 /nfs/dbraw/zinc/05/82/60/628058260.db2.gz XZUWOIZMWKVMOE-NWDGAFQWSA-N 0 3 282.815 2.960 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCC(=O)O1 ZINC000852017878 634627698 /nfs/dbraw/zinc/62/76/98/634627698.db2.gz HWPPLEKRHVGVHD-AWEZNQCLSA-N 0 3 277.364 2.700 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCC(=O)O1 ZINC000852017878 634627699 /nfs/dbraw/zinc/62/76/99/634627699.db2.gz HWPPLEKRHVGVHD-AWEZNQCLSA-N 0 3 277.364 2.700 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000776018914 628094289 /nfs/dbraw/zinc/09/42/89/628094289.db2.gz HYLZYKMFTSCLNA-OLZOCXBDSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000776018914 628094291 /nfs/dbraw/zinc/09/42/91/628094291.db2.gz HYLZYKMFTSCLNA-OLZOCXBDSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CC1OCCO1)C1CCCC1 ZINC000777583522 628239016 /nfs/dbraw/zinc/23/90/16/628239016.db2.gz FGDUSSKHSYPINI-UHFFFAOYSA-N 0 3 277.364 2.510 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CC1OCCO1)C1CCCC1 ZINC000777583522 628239018 /nfs/dbraw/zinc/23/90/18/628239018.db2.gz FGDUSSKHSYPINI-UHFFFAOYSA-N 0 3 277.364 2.510 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@H](C(C)C)C2)cc1C ZINC000777969907 628269300 /nfs/dbraw/zinc/26/93/00/628269300.db2.gz TUDGZQKBNMQVNJ-INIZCTEOSA-N 0 3 263.381 2.866 20 10 CFCDHN Oc1ccccc1CN1CCN(Cc2ccsc2)CC1 ZINC000778995541 628343803 /nfs/dbraw/zinc/34/38/03/628343803.db2.gz ZDFNGEXONPFPHI-UHFFFAOYSA-N 0 3 288.416 2.772 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000779028433 628346471 /nfs/dbraw/zinc/34/64/71/628346471.db2.gz WTLVINZHESGIFY-MRXNPFEDSA-N 0 3 261.365 2.785 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000779028433 628346475 /nfs/dbraw/zinc/34/64/75/628346475.db2.gz WTLVINZHESGIFY-MRXNPFEDSA-N 0 3 261.365 2.785 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000783515759 628715113 /nfs/dbraw/zinc/71/51/13/628715113.db2.gz AWHUELLAMLBMII-JHJVBQTASA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000788604048 629085948 /nfs/dbraw/zinc/08/59/48/629085948.db2.gz TUBVDQZNQGNPHR-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2cn[nH]c2)ccc1N(C)C ZINC000788645248 629089217 /nfs/dbraw/zinc/08/92/17/629089217.db2.gz NXORYZDNVASCHP-LBPRGKRZSA-N 0 3 258.369 2.635 20 10 CFCDHN Cc1c(CN(C)Cc2cc(C)cc(C)c2O)cnn1C ZINC000790427557 629238491 /nfs/dbraw/zinc/23/84/91/629238491.db2.gz IQWSEEINTJACOA-UHFFFAOYSA-N 0 3 273.380 2.683 20 10 CFCDHN C[C@@H](NC/C=C/c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000835041040 629335370 /nfs/dbraw/zinc/33/53/70/629335370.db2.gz IUBHEMKODZSRKT-MUBLQREKSA-N 0 3 270.380 2.840 20 10 CFCDHN CC(C)c1nc(CNCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835054312 629356342 /nfs/dbraw/zinc/35/63/42/629356342.db2.gz JLPUTBQKVWRZHL-WAYWQWQTSA-N 0 3 299.422 2.797 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CC([C@@H]3CCOC3)C2)cc1 ZINC000835054394 629357061 /nfs/dbraw/zinc/35/70/61/629357061.db2.gz ORTOEZLKAHBWQA-MJSXRHKHSA-N 0 3 286.419 2.734 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2cccc(C)n2)c([O-])c1 ZINC000793202357 629503963 /nfs/dbraw/zinc/50/39/63/629503963.db2.gz HPUXZEXVVATHSJ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(CCOC)CCC2)c([O-])c1 ZINC000793328878 629528333 /nfs/dbraw/zinc/52/83/33/629528333.db2.gz HGLVGQUUTBJUGJ-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN COC[C@@H](CC(C)C)[NH2+]Cc1ccc(OC)cc1[O-] ZINC000793388756 629535735 /nfs/dbraw/zinc/53/57/35/629535735.db2.gz IPKHSKPWABQUQV-CYBMUJFWSA-N 0 3 267.369 2.552 20 10 CFCDHN CC[C@@H]1C[C@H](C[NH2+]Cc2ccc(OC)cc2[O-])CCO1 ZINC000793388101 629535868 /nfs/dbraw/zinc/53/58/68/629535868.db2.gz LVKOMCDEWDIAHD-TZMCWYRMSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc([C@@H](C)NCc2ccc(N(C)C)cc2C)n(C)n1 ZINC000793540506 629566457 /nfs/dbraw/zinc/56/64/57/629566457.db2.gz KQGUTGDMTBKBPX-CQSZACIVSA-N 0 3 286.423 2.954 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000793567606 629572623 /nfs/dbraw/zinc/57/26/23/629572623.db2.gz ZMEYXQFUSPKYFT-ZYHUDNBSSA-N 0 3 279.355 2.974 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000793607964 629578022 /nfs/dbraw/zinc/57/80/22/629578022.db2.gz GNUNPJFBQXEYFO-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000793607964 629578027 /nfs/dbraw/zinc/57/80/27/629578027.db2.gz GNUNPJFBQXEYFO-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000793609066 629578065 /nfs/dbraw/zinc/57/80/65/629578065.db2.gz MZFWQTVLKBPKMY-CZUORRHYSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000793609066 629578069 /nfs/dbraw/zinc/57/80/69/629578069.db2.gz MZFWQTVLKBPKMY-CZUORRHYSA-N 0 3 277.364 2.544 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794801302 629686906 /nfs/dbraw/zinc/68/69/06/629686906.db2.gz JIOINHGFPWJKQI-TZMCWYRMSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+]CC[S@@](=O)CC)c1ccc(C)cc1[O-] ZINC000794809175 629688895 /nfs/dbraw/zinc/68/88/95/629688895.db2.gz RBPVBSBYOWZYHA-UGSOOPFHSA-N 0 3 269.410 2.510 20 10 CFCDHN CC[C@H]([NH2+]CC1(OC)CCOCC1)c1ccc(C)cc1[O-] ZINC000794815928 629689696 /nfs/dbraw/zinc/68/96/96/629689696.db2.gz MIIGJIGRIKOXMH-HNNXBMFYSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000794816108 629690122 /nfs/dbraw/zinc/69/01/22/629690122.db2.gz KJXOJLCRACLFGG-HZPDHXFCSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C[C@@H](C)O)c1ccc(C)cc1[O-] ZINC000794818763 629690548 /nfs/dbraw/zinc/69/05/48/629690548.db2.gz TVMLQUWDCUBQHZ-SCRDCRAPSA-N 0 3 251.370 2.901 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2([S@@](C)=O)CC2)c2c1c(F)ccc2[O-] ZINC000799727515 630340029 /nfs/dbraw/zinc/34/00/29/630340029.db2.gz NCDSQOOWPHOBAW-GYKIULCDSA-N 0 3 297.395 2.580 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808716762 630417836 /nfs/dbraw/zinc/41/78/36/630417836.db2.gz VGXKXJWNLJLXNY-QWRGUYRKSA-N 0 3 298.814 2.871 20 10 CFCDHN C[C@H]1CCC[C@](C[NH2+]Cc2ccccc2[O-])(N(C)C)C1 ZINC000040668246 649985585 /nfs/dbraw/zinc/98/55/85/649985585.db2.gz VGWRIMLRSNKILX-YOEHRIQHSA-N 0 3 276.424 2.992 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)Cn2cncn2)c1[O-] ZINC000808683427 631028083 /nfs/dbraw/zinc/02/80/83/631028083.db2.gz FUDUXCSTHCDUEL-GHMZBOCLSA-N 0 3 294.786 2.685 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](C)N(C)C)c1[O-] ZINC000808690951 631029106 /nfs/dbraw/zinc/02/91/06/631029106.db2.gz HGNDGWPDLFJRMV-QWRGUYRKSA-N 0 3 270.804 2.955 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCN(C)C2)c1[O-] ZINC000808692233 631029336 /nfs/dbraw/zinc/02/93/36/631029336.db2.gz QLWNTIIONVJRQB-CMPLNLGQSA-N 0 3 268.788 2.709 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCn2cccn2)c1[O-] ZINC000808704421 631030656 /nfs/dbraw/zinc/03/06/56/631030656.db2.gz QGMFLZVHCFIBTH-NSHDSACASA-N 0 3 279.771 2.901 20 10 CFCDHN COC[C@@H](C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-])OC ZINC000808714277 631032919 /nfs/dbraw/zinc/03/29/19/631032919.db2.gz UDJJRJYFFRADGO-ZYHUDNBSSA-N 0 3 287.787 2.666 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCN(C)C)c1[O-] ZINC000808718092 631034360 /nfs/dbraw/zinc/03/43/60/631034360.db2.gz LJXYVOZQMBNBAY-JTQLQIEISA-N 0 3 256.777 2.566 20 10 CFCDHN CC(C)NC(=O)[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000840891359 631252908 /nfs/dbraw/zinc/25/29/08/631252908.db2.gz RCMPCRBWXMMBTG-NHCYSSNCSA-N 0 3 294.370 2.582 20 10 CFCDHN COC(=O)c1cccc(C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000809730507 631272524 /nfs/dbraw/zinc/27/25/24/631272524.db2.gz QHUMERGSRHQDMX-UHFFFAOYSA-N 0 3 289.306 2.608 20 10 CFCDHN CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000840955965 631282630 /nfs/dbraw/zinc/28/26/30/631282630.db2.gz DKOUNXKLJJQXHO-WBVHZDCISA-N 0 3 287.334 2.933 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@H]2CCN(C)C[C@H]2C)c([O-])c1 ZINC000809765815 631283415 /nfs/dbraw/zinc/28/34/15/631283415.db2.gz QVIQZCQYDADGBI-CJNGLKHVSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@H]2CCN(C)C[C@H]2C)c([O-])c1 ZINC000809765815 631283419 /nfs/dbraw/zinc/28/34/19/631283419.db2.gz QVIQZCQYDADGBI-CJNGLKHVSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@]2(C)CCCO)c([O-])c1 ZINC000809758005 631283847 /nfs/dbraw/zinc/28/38/47/631283847.db2.gz ZIHGLCLFLZBZCE-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@]2(C)CCCO)c([O-])c1 ZINC000809758005 631283850 /nfs/dbraw/zinc/28/38/50/631283850.db2.gz ZIHGLCLFLZBZCE-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CC(C)C[C@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841039062 631316796 /nfs/dbraw/zinc/31/67/96/631316796.db2.gz YZMAYDPBFXLRJY-SECBINFHSA-N 0 3 274.767 2.648 20 10 CFCDHN CC(C)C[C@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841039062 631316802 /nfs/dbraw/zinc/31/68/02/631316802.db2.gz YZMAYDPBFXLRJY-SECBINFHSA-N 0 3 274.767 2.648 20 10 CFCDHN C[C@@H]1CNCC[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000841062805 631327386 /nfs/dbraw/zinc/32/73/86/631327386.db2.gz CORTYXCDABCKIX-PELKAZGASA-N 0 3 289.206 2.787 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(CC(F)F)C1)c1cc(F)ccc1[O-] ZINC000841766056 631470008 /nfs/dbraw/zinc/47/00/08/631470008.db2.gz YKVVARSLLYNTRJ-ONGXEEELSA-N 0 3 288.313 2.521 20 10 CFCDHN CCn1cncc1CNCc1ccc(N(C)C)cc1C ZINC000841862859 631483254 /nfs/dbraw/zinc/48/32/54/631483254.db2.gz GXBUCJNGIOHTDV-UHFFFAOYSA-N 0 3 272.396 2.567 20 10 CFCDHN CCn1cncc1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000841871950 631486131 /nfs/dbraw/zinc/48/61/31/631486131.db2.gz GYXYMEIJWSZMPG-CYBMUJFWSA-N 0 3 272.396 2.820 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](CC(C)C)OC ZINC000841888904 631488375 /nfs/dbraw/zinc/48/83/75/631488375.db2.gz UTGHGXQTTRWTMQ-LBPRGKRZSA-N 0 3 267.369 2.552 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](CO)CC1CCCCC1 ZINC000841893414 631490571 /nfs/dbraw/zinc/49/05/71/631490571.db2.gz KEGDNQONJJAXEW-HNNXBMFYSA-N 0 3 281.371 2.952 20 10 CFCDHN CC[C@H](C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1)OC ZINC000842154143 631554783 /nfs/dbraw/zinc/55/47/83/631554783.db2.gz TYMGJGAGMRYARY-CVEARBPZSA-N 0 3 293.407 2.798 20 10 CFCDHN CC[C@H](C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1)OC ZINC000842154143 631554788 /nfs/dbraw/zinc/55/47/88/631554788.db2.gz TYMGJGAGMRYARY-CVEARBPZSA-N 0 3 293.407 2.798 20 10 CFCDHN COc1cccc(O)c1CN1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000811510650 631574242 /nfs/dbraw/zinc/57/42/42/631574242.db2.gz MIUYIJKXSUVWSW-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000811510650 631574246 /nfs/dbraw/zinc/57/42/46/631574246.db2.gz MIUYIJKXSUVWSW-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000811510650 631574253 /nfs/dbraw/zinc/57/42/53/631574253.db2.gz MIUYIJKXSUVWSW-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CO)C[C@H](C)CC)c([O-])c1 ZINC000842753142 631728567 /nfs/dbraw/zinc/72/85/67/631728567.db2.gz CFBYUSLKARBPQA-OCCSQVGLSA-N 0 3 281.396 2.678 20 10 CFCDHN CC[C@H]([NH2+]CCCc1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000842905260 631779867 /nfs/dbraw/zinc/77/98/67/631779867.db2.gz XBCXFINCUPQZFH-AWEZNQCLSA-N 0 3 288.395 2.503 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000842915942 631781724 /nfs/dbraw/zinc/78/17/24/631781724.db2.gz HZLNJWUKNIRZJT-IACUBPJLSA-N 0 3 263.381 2.766 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)C[C@@H](C)OC)c([O-])c1 ZINC000812807964 631786171 /nfs/dbraw/zinc/78/61/71/631786171.db2.gz MYXSILBRERHQOA-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)C[C@@H](C)OC)c([O-])c1 ZINC000812807964 631786176 /nfs/dbraw/zinc/78/61/76/631786176.db2.gz MYXSILBRERHQOA-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H](C)[NH2+][C@H](C)C2)c(Cl)c1 ZINC000843049555 631815022 /nfs/dbraw/zinc/81/50/22/631815022.db2.gz PWFVZAYDYQXSRE-GHMZBOCLSA-N 0 3 268.788 2.536 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)c(Cl)c1 ZINC000843054273 631817361 /nfs/dbraw/zinc/81/73/61/631817361.db2.gz IHXZQBYTZPWSOE-NEPJUHHUSA-N 0 3 280.799 2.680 20 10 CFCDHN [NH3+][C@@H]1CCC[C@@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@H]21 ZINC000843059414 631821719 /nfs/dbraw/zinc/82/17/19/631821719.db2.gz LIYUYUOQJDUTRH-GAJTVXKRSA-N 0 3 298.789 2.744 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@]1(O)CCc2ccccc21 ZINC000843422089 631951455 /nfs/dbraw/zinc/95/14/55/631951455.db2.gz UQPYVPXFFKXXNZ-SFHVURJKSA-N 0 3 283.371 2.658 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@]1(O)CCc2ccccc21 ZINC000843422089 631951456 /nfs/dbraw/zinc/95/14/56/631951456.db2.gz UQPYVPXFFKXXNZ-SFHVURJKSA-N 0 3 283.371 2.658 20 10 CFCDHN CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000843428281 631955561 /nfs/dbraw/zinc/95/55/61/631955561.db2.gz FQILNDRBKZHBJB-BETUJISGSA-N 0 3 267.344 2.967 20 10 CFCDHN C[C@@H](N)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000843484657 631966222 /nfs/dbraw/zinc/96/62/22/631966222.db2.gz KUIUWPIRFGTHNC-ZIAGYGMSSA-N 0 3 298.386 2.829 20 10 CFCDHN C[C@@H](N)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000843484649 631966317 /nfs/dbraw/zinc/96/63/17/631966317.db2.gz KUIUWPIRFGTHNC-KGLIPLIRSA-N 0 3 298.386 2.829 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1[O-])CN(C)C ZINC000813877315 631971394 /nfs/dbraw/zinc/97/13/94/631971394.db2.gz RPVITWCJTXQAFZ-GHMZBOCLSA-N 0 3 270.804 2.894 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2cnccc2C)cc1 ZINC000844402490 632196130 /nfs/dbraw/zinc/19/61/30/632196130.db2.gz ZRALDKRKJHZRKF-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@]2(O)CCCC2(C)C)c([O-])c1 ZINC000815147619 632217878 /nfs/dbraw/zinc/21/78/78/632217878.db2.gz SUBDQIFFVYBYJT-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN CC[N@H+](CCCN(C)C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816611901 632494647 /nfs/dbraw/zinc/49/46/47/632494647.db2.gz ZVMPWUDGAQWNHF-UHFFFAOYSA-N 0 3 288.794 2.958 20 10 CFCDHN CC[N@@H+](CCCN(C)C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816611901 632494650 /nfs/dbraw/zinc/49/46/50/632494650.db2.gz ZVMPWUDGAQWNHF-UHFFFAOYSA-N 0 3 288.794 2.958 20 10 CFCDHN CCN(CCC[NH+](C)C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816611901 632494655 /nfs/dbraw/zinc/49/46/55/632494655.db2.gz ZVMPWUDGAQWNHF-UHFFFAOYSA-N 0 3 288.794 2.958 20 10 CFCDHN COc1cccc(CN2CCN(C)Cc3ccccc32)c1O ZINC000816617798 632495974 /nfs/dbraw/zinc/49/59/74/632495974.db2.gz JBHSMPTZEYANGS-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000846015216 632614452 /nfs/dbraw/zinc/61/44/52/632614452.db2.gz CEYHCLMUDXYWMN-SWLSCSKDSA-N 0 3 281.396 2.678 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000846027477 632617246 /nfs/dbraw/zinc/61/72/46/632617246.db2.gz PWEIVMXQJVMUIF-UHFFFAOYSA-N 0 3 283.755 2.539 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@](C)(O)c1ccccc1 ZINC000846038969 632620765 /nfs/dbraw/zinc/62/07/65/632620765.db2.gz OREDUGGEKRKPFT-DYVFJYSZSA-N 0 3 271.360 2.778 20 10 CFCDHN Cc1cc([O-])c(CN(C)C[C@H]2CCC[N@@H+]2C)c(Cl)c1 ZINC000817417452 632627558 /nfs/dbraw/zinc/62/75/58/632627558.db2.gz MVRILKDBLYZTBA-GFCCVEGCSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc([O-])c(CN(C)C[C@H]2CCC[N@H+]2C)c(Cl)c1 ZINC000817417452 632627559 /nfs/dbraw/zinc/62/75/59/632627559.db2.gz MVRILKDBLYZTBA-GFCCVEGCSA-N 0 3 282.815 2.880 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](CCO)CC2)c([O-])c1 ZINC000817419205 632628617 /nfs/dbraw/zinc/62/86/17/632628617.db2.gz QYQHPENYNJQDHN-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](CCO)CC2)c([O-])c1 ZINC000817419205 632628621 /nfs/dbraw/zinc/62/86/21/632628621.db2.gz QYQHPENYNJQDHN-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC2(CO)CCC2)c1[O-] ZINC000846103946 632632145 /nfs/dbraw/zinc/63/21/45/632632145.db2.gz AFLYRSQWCGMPIG-UHFFFAOYSA-N 0 3 283.799 2.996 20 10 CFCDHN COc1cccc([C@@H](C)NC[C@@H](OC)C(F)(F)F)c1O ZINC000846163742 632650934 /nfs/dbraw/zinc/65/09/34/632650934.db2.gz QQEFBTJBBVITER-LDYMZIIASA-N 0 3 293.285 2.629 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000846185833 632656152 /nfs/dbraw/zinc/65/61/52/632656152.db2.gz YMRVPTRTDFUVRS-WDMOLILDSA-N 0 3 269.360 2.979 20 10 CFCDHN CCN1C[C@H](C[NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])CC1=O ZINC000846209687 632661138 /nfs/dbraw/zinc/66/11/38/632661138.db2.gz SDDRPDIRKNEILJ-KBPBESRZSA-N 0 3 290.407 2.528 20 10 CFCDHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1cc(Cl)ccc1O ZINC000846475745 632716212 /nfs/dbraw/zinc/71/62/12/632716212.db2.gz HXAQDZZNQMRXDH-QWRGUYRKSA-N 0 3 296.798 2.535 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CCCCC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000817938122 632743096 /nfs/dbraw/zinc/74/30/96/632743096.db2.gz DXJYXZBDJXJETR-LLVKDONJSA-N 0 3 293.367 2.613 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](N)C(C)C)c1ccc(F)cc1[O-] ZINC000817957399 632755858 /nfs/dbraw/zinc/75/58/58/632755858.db2.gz BQRWFJXNCFHIBO-QWHCGFSZSA-N 0 3 254.349 2.555 20 10 CFCDHN CC(C)C[C@@H](CN)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000817958080 632756797 /nfs/dbraw/zinc/75/67/97/632756797.db2.gz HGGVZODQCDTWKF-PWSUYJOCSA-N 0 3 254.349 2.555 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CN)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817961471 632760316 /nfs/dbraw/zinc/76/03/16/632760316.db2.gz ZIFMGLWFKBVHOR-STQMWFEESA-N 0 3 268.788 2.824 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CN)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970286 632768679 /nfs/dbraw/zinc/76/86/79/632768679.db2.gz QNRSHKKDCCOUPS-GZMMTYOYSA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cc(F)cc(F)c1[O-] ZINC000818614998 632879980 /nfs/dbraw/zinc/87/99/80/632879980.db2.gz KHBNTEXPXZUCDQ-ZEGGKSINSA-N 0 3 270.323 2.591 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)Cc2ccccn2)c([O-])c1 ZINC000848566872 633291452 /nfs/dbraw/zinc/29/14/52/633291452.db2.gz LFUIOGIFLDPBHV-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)Cc1ccccn1 ZINC000848567361 633291549 /nfs/dbraw/zinc/29/15/49/633291549.db2.gz SZKMOYVAWSHMCK-LBPRGKRZSA-N 0 3 272.348 2.517 20 10 CFCDHN CCc1cccc(C[NH2+][C@H](CC)C[C@@H](C)CO)c1[O-] ZINC000848898033 633387091 /nfs/dbraw/zinc/38/70/91/633387091.db2.gz OQJUWAVCVPVTDO-IUODEOHRSA-N 0 3 265.397 2.841 20 10 CFCDHN CCc1cccc(CN(C)Cc2ccccn2)c1O ZINC000848903069 633391274 /nfs/dbraw/zinc/39/12/74/633391274.db2.gz XRCJBODVNLPXQL-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cnc(Cl)n2C)c1 ZINC000848911858 633396098 /nfs/dbraw/zinc/39/60/98/633396098.db2.gz JLOKJIQYBZSLQE-VIFPVBQESA-N 0 3 295.770 2.639 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCN2C(C)(C)C)c([O-])c1 ZINC000850344250 633947865 /nfs/dbraw/zinc/94/78/65/633947865.db2.gz ZCOJHEZZKFHCMO-AWEZNQCLSA-N 0 3 292.423 2.753 20 10 CFCDHN CCOc1ccc(C[NH2+]CCc2cnccc2C)c([O-])c1 ZINC000850355557 633953156 /nfs/dbraw/zinc/95/31/56/633953156.db2.gz IUYCJXZWEQVTLQ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](OC)[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000850484945 634013570 /nfs/dbraw/zinc/01/35/70/634013570.db2.gz VFPGQJDPDJCJAY-UKPHBRMFSA-N 0 3 293.407 2.793 20 10 CFCDHN CC[C@@H](N[C@H](C)c1nccn1C)c1ccccc1O ZINC000850572473 634057547 /nfs/dbraw/zinc/05/75/47/634057547.db2.gz KNHXGUKYZVAZBZ-DGCLKSJQSA-N 0 3 259.353 2.928 20 10 CFCDHN C[N@H+](CCC(=O)Nc1ccccc1)Cc1ccccc1[O-] ZINC000109770035 634233559 /nfs/dbraw/zinc/23/35/59/634233559.db2.gz ZBQDKXGYPBPPJC-UHFFFAOYSA-N 0 3 284.359 2.853 20 10 CFCDHN C[N@@H+](CCC(=O)Nc1ccccc1)Cc1ccccc1[O-] ZINC000109770035 634233565 /nfs/dbraw/zinc/23/35/65/634233565.db2.gz ZBQDKXGYPBPPJC-UHFFFAOYSA-N 0 3 284.359 2.853 20 10 CFCDHN COC(=O)c1ccc(C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000109769618 634233921 /nfs/dbraw/zinc/23/39/21/634233921.db2.gz CAKKYWXZNAUWJB-UHFFFAOYSA-N 0 3 285.343 2.811 20 10 CFCDHN COC(=O)c1ccc(C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000109769618 634233926 /nfs/dbraw/zinc/23/39/26/634233926.db2.gz CAKKYWXZNAUWJB-UHFFFAOYSA-N 0 3 285.343 2.811 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+]Cc1c([O-])cccc1Cl ZINC000113333632 635553611 /nfs/dbraw/zinc/55/36/11/635553611.db2.gz SZCUHYVPWCDIGL-NSHDSACASA-N 0 3 270.804 2.866 20 10 CFCDHN COC1(CNCc2cc(F)c(N(C)C)cc2F)CCC1 ZINC000858157085 636143625 /nfs/dbraw/zinc/14/36/25/636143625.db2.gz BVRYAJIEHKWVKA-UHFFFAOYSA-N 0 3 284.350 2.690 20 10 CFCDHN CO[C@H](C)[C@@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000858165694 636146276 /nfs/dbraw/zinc/14/62/76/636146276.db2.gz LAOHSWYLKZDMHE-NXEZZACHSA-N 0 3 272.339 2.544 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2ccc[nH]c2=O)c2c1c(F)ccc2[O-] ZINC000858563146 636294237 /nfs/dbraw/zinc/29/42/37/636294237.db2.gz QELJSLWDGAEVON-JOYOIKCWSA-N 0 3 288.322 2.970 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)C1 ZINC000858584733 636300602 /nfs/dbraw/zinc/30/06/02/636300602.db2.gz WHBXJKXOYUPLHZ-QFOLPQNPSA-N 0 3 265.328 2.847 20 10 CFCDHN CC[C@@H]([NH2+]CCOC1CCOCC1)c1ccccc1[O-] ZINC000859232548 636518169 /nfs/dbraw/zinc/51/81/69/636518169.db2.gz LZABSHJMLWCCJY-OAHLLOKOSA-N 0 3 279.380 2.629 20 10 CFCDHN C[C@H](NCC(=O)NCC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000859258143 636524833 /nfs/dbraw/zinc/52/48/33/636524833.db2.gz KPRKNAGFURDISM-ZDUSSCGKSA-N 0 3 291.439 2.566 20 10 CFCDHN CC[C@H]1[C@H](CO)CCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862384798 637348230 /nfs/dbraw/zinc/34/82/30/637348230.db2.gz KHJGLJFCWIWPRX-NHYWBVRUSA-N 0 3 298.377 2.624 20 10 CFCDHN COc1cnccc1[C@@H](C)NCc1cccc(C)c1O ZINC000189011629 650356761 /nfs/dbraw/zinc/35/67/61/650356761.db2.gz DUDKZUKHKWENFA-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN CC[C@@H]1[NH2+]CC[C@H]1N[C@H](C)c1cc(Cl)ccc1[O-] ZINC000863542879 637690195 /nfs/dbraw/zinc/69/01/95/637690195.db2.gz HVPXNOVNJGCJPE-JIMOISOXSA-N 0 3 268.788 2.837 20 10 CFCDHN Cc1cc([O-])c(CN[C@@H]2CC[C@H](C)[NH2+]C2)c(Cl)c1 ZINC000863650302 637724617 /nfs/dbraw/zinc/72/46/17/637724617.db2.gz PXVVYPMXVZPMTC-WDEREUQCSA-N 0 3 268.788 2.584 20 10 CFCDHN Cc1cc([O-])c(CN[C@@H]2CC[C@@H](C)[NH2+]C2)c(Cl)c1 ZINC000863650299 637725304 /nfs/dbraw/zinc/72/53/04/637725304.db2.gz PXVVYPMXVZPMTC-GHMZBOCLSA-N 0 3 268.788 2.584 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2cc(F)c(N(C)C)cc2F)[C@H](C)O1 ZINC000864050593 637843266 /nfs/dbraw/zinc/84/32/66/637843266.db2.gz LCACRLURIKJLKM-ISTVAULSSA-N 0 3 284.350 2.686 20 10 CFCDHN COC[C@@H](C)C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000189540678 650387649 /nfs/dbraw/zinc/38/76/49/650387649.db2.gz XCGAZIWQVPCZEY-HOCLYGCPSA-N 0 3 293.407 2.656 20 10 CFCDHN COC[C@@H](C)C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000189540678 650387653 /nfs/dbraw/zinc/38/76/53/650387653.db2.gz XCGAZIWQVPCZEY-HOCLYGCPSA-N 0 3 293.407 2.656 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1F ZINC000190064470 650409201 /nfs/dbraw/zinc/40/92/01/650409201.db2.gz AUFMJQIVANLKLK-DYVFJYSZSA-N 0 3 294.414 2.875 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000189993352 650405962 /nfs/dbraw/zinc/40/59/62/650405962.db2.gz JZJKZWOBQKXTLM-NWDGAFQWSA-N 0 3 294.395 2.956 20 10 CFCDHN CC1(c2ccc(C[NH2+]Cc3ccccc3[O-])cc2)OCCO1 ZINC000865669377 638501634 /nfs/dbraw/zinc/50/16/34/638501634.db2.gz DCBFKTPIAFQXPT-UHFFFAOYSA-N 0 3 299.370 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3C[C@H]4CO[C@H]2[C@H]4C3)c([O-])c1 ZINC000866444005 638822316 /nfs/dbraw/zinc/82/23/16/638822316.db2.gz BRBCKQRAPBBDFP-JBLLWJKWSA-N 0 3 273.376 2.775 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@@H](O)C(F)(F)F)c1ccccc1[O-] ZINC000866464906 638825570 /nfs/dbraw/zinc/82/55/70/638825570.db2.gz ZSNCOYDWBSDTKP-UBHAPETDSA-N 0 3 277.286 2.745 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)CC(C)C)c1ccccc1[O-] ZINC000121083782 638831463 /nfs/dbraw/zinc/83/14/63/638831463.db2.gz YUKJGROIXSVPNU-OCCSQVGLSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@@H]([NH2+]CCCO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000121092731 638832821 /nfs/dbraw/zinc/83/28/21/638832821.db2.gz YVQGMINKRZNJMK-UKRRQHHQSA-N 0 3 279.380 2.629 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])c1ccnn1C ZINC000866612612 638854385 /nfs/dbraw/zinc/85/43/85/638854385.db2.gz ACKVCSJFEHFEHJ-UWVGGRQHSA-N 0 3 263.316 2.677 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](C)c2ccnn2C)c1 ZINC000866614174 638854875 /nfs/dbraw/zinc/85/48/75/638854875.db2.gz LJUSCWSJBJPGBI-WDEREUQCSA-N 0 3 275.352 2.546 20 10 CFCDHN COc1cccc([C@@H](C)N[C@@H](C)c2ccnn2C)c1O ZINC000866615921 638855328 /nfs/dbraw/zinc/85/53/28/638855328.db2.gz XUHRBAJGDOOXAX-MNOVXSKESA-N 0 3 275.352 2.546 20 10 CFCDHN COc1ccc(CNCC(C)(C)F)cc1Cn1cccn1 ZINC000873147347 642030363 /nfs/dbraw/zinc/03/03/63/642030363.db2.gz UQQDSOOPSYZCPP-UHFFFAOYSA-N 0 3 291.370 2.778 20 10 CFCDHN Nc1cc(F)cc(C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000873290088 642123198 /nfs/dbraw/zinc/12/31/98/642123198.db2.gz NSJRLIFQGGXCIM-CQSZACIVSA-N 0 3 272.323 2.891 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1Cc3ccccc3CN1)CC2 ZINC000873296512 642127842 /nfs/dbraw/zinc/12/78/42/642127842.db2.gz HGZOTBQZBQTHMN-SJORKVTESA-N 0 3 294.398 2.684 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccccn2)c1 ZINC000019957599 642241766 /nfs/dbraw/zinc/24/17/66/642241766.db2.gz WZQVRAWYYQCGMB-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@H+](Cc3ccc(C)cc3[O-])C2)n1 ZINC000876612722 642944751 /nfs/dbraw/zinc/94/47/51/642944751.db2.gz VFJGCEOSAYDSME-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(C)cc3[O-])C2)n1 ZINC000876612722 642944755 /nfs/dbraw/zinc/94/47/55/642944755.db2.gz VFJGCEOSAYDSME-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN CO[C@@H](C)C[N@H+](Cc1c(C)cccc1[O-])C(C)C ZINC000876757920 642997103 /nfs/dbraw/zinc/99/71/03/642997103.db2.gz GKBNAQNEEUCKIS-ZDUSSCGKSA-N 0 3 251.370 2.946 20 10 CFCDHN CO[C@@H](C)C[N@@H+](Cc1c(C)cccc1[O-])C(C)C ZINC000876757920 642997105 /nfs/dbraw/zinc/99/71/05/642997105.db2.gz GKBNAQNEEUCKIS-ZDUSSCGKSA-N 0 3 251.370 2.946 20 10 CFCDHN CCCCOCCC[NH2+]Cc1c(C)cccc1[O-] ZINC000876894350 643056008 /nfs/dbraw/zinc/05/60/08/643056008.db2.gz OBMFZWYRRSINQP-UHFFFAOYSA-N 0 3 251.370 2.997 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1COc2ccccc2O1 ZINC000876907864 643060256 /nfs/dbraw/zinc/06/02/56/643060256.db2.gz IHFIWHBPDNLGGB-CYBMUJFWSA-N 0 3 285.343 2.630 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)N2CCCCC2)c([O-])c1 ZINC000876957487 643079834 /nfs/dbraw/zinc/07/98/34/643079834.db2.gz XOHPYWHTRRYILJ-AWEZNQCLSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2ccccc2F)c([O-])c1 ZINC000876958696 643080842 /nfs/dbraw/zinc/08/08/42/643080842.db2.gz BBMVGGOFNOHDDV-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccccc1O ZINC000876996566 643098730 /nfs/dbraw/zinc/09/87/30/643098730.db2.gz ZYELQOUGXZCFNQ-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000877019070 643106485 /nfs/dbraw/zinc/10/64/85/643106485.db2.gz FUJGFDIYLZFUER-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc2c(c1)CCO2 ZINC000877035285 643113858 /nfs/dbraw/zinc/11/38/58/643113858.db2.gz DJGXMURZVHYYPB-UHFFFAOYSA-N 0 3 283.371 2.968 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)CC(C)(C)C)c([O-])c1 ZINC000877041514 643117800 /nfs/dbraw/zinc/11/78/00/643117800.db2.gz YGXAIQCWDIOUEX-ZDUSSCGKSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)CCC(C)C ZINC000877051292 643121283 /nfs/dbraw/zinc/12/12/83/643121283.db2.gz VCDCGYSXKJRFTP-INIZCTEOSA-N 0 3 265.397 2.977 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000877052146 643122135 /nfs/dbraw/zinc/12/21/35/643122135.db2.gz SHEQZORYGZVBTK-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CO)c1ccccc1 ZINC000877073902 643136310 /nfs/dbraw/zinc/13/63/10/643136310.db2.gz VOCRYFDYHQVFHM-OAHLLOKOSA-N 0 3 271.360 2.566 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000877095751 643150718 /nfs/dbraw/zinc/15/07/18/643150718.db2.gz SYBPQLGZWWXRKW-CJNGLKHVSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1ccc(CN[C@@H](C)c2n[nH]c(C(C)C)n2)c(O)c1 ZINC000877126857 643165019 /nfs/dbraw/zinc/16/50/19/643165019.db2.gz UQBDXELXRKEKRT-NSHDSACASA-N 0 3 274.368 2.793 20 10 CFCDHN COc1ccc2c(c1)OC[C@H]([NH2+]Cc1c(C)cccc1[O-])C2 ZINC000877129105 643167039 /nfs/dbraw/zinc/16/70/39/643167039.db2.gz YFKJYHHLDAGRJX-CQSZACIVSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)C[C@H](O)c2ccco2)c([O-])c1 ZINC000877130197 643167938 /nfs/dbraw/zinc/16/79/38/643167938.db2.gz PTEAHWUEBQGJNO-DOMZBBRYSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000877139420 643173561 /nfs/dbraw/zinc/17/35/61/643173561.db2.gz NVAAQWNKAZWLQO-ZBFHGGJFSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000877139420 643173564 /nfs/dbraw/zinc/17/35/64/643173564.db2.gz NVAAQWNKAZWLQO-ZBFHGGJFSA-N 0 3 277.408 2.930 20 10 CFCDHN COc1ccc(CN(C)Cc2c(C)cccc2O)cn1 ZINC000877325548 643239815 /nfs/dbraw/zinc/23/98/15/643239815.db2.gz KACPKXPRFKWHLN-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000877395972 643258526 /nfs/dbraw/zinc/25/85/26/643258526.db2.gz PWLRLUUXYKOWPI-IRXDYDNUSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(CN[C@H](CO)c2ccsc2)c(O)c1 ZINC000877398800 643259444 /nfs/dbraw/zinc/25/94/44/643259444.db2.gz JFYVAKRGCAISEK-CYBMUJFWSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877464372 643284327 /nfs/dbraw/zinc/28/43/27/643284327.db2.gz IJTOXLHNDOEBFH-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN [O-]c1c(CNC2CC([NH+]3CCCCC3)C2)ccc(F)c1F ZINC000877492296 643306085 /nfs/dbraw/zinc/30/60/85/643306085.db2.gz UKAJLWJONOFFLI-UHFFFAOYSA-N 0 3 296.361 2.777 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@]2(C)CCCO)c([O-])c1 ZINC000877529140 643333211 /nfs/dbraw/zinc/33/32/11/643333211.db2.gz UJKBIHWAAQORHW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@]2(C)CCCO)c([O-])c1 ZINC000877529140 643333214 /nfs/dbraw/zinc/33/32/14/643333214.db2.gz UJKBIHWAAQORHW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cnn([C@H]2CC[N@H+](Cc3c(C)cccc3[O-])C2)c1 ZINC000877543180 643345023 /nfs/dbraw/zinc/34/50/23/643345023.db2.gz ZOUSKMMRIMPUJR-AWEZNQCLSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@H]2CC[N@@H+](Cc3c(C)cccc3[O-])C2)c1 ZINC000877543180 643345031 /nfs/dbraw/zinc/34/50/31/643345031.db2.gz ZOUSKMMRIMPUJR-AWEZNQCLSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCC1CCOCC1 ZINC000877556906 643358532 /nfs/dbraw/zinc/35/85/32/643358532.db2.gz CGQDRVCQBQIHPN-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1ccc(C)cc1[O-])OC ZINC000877559546 643359446 /nfs/dbraw/zinc/35/94/46/643359446.db2.gz YWYZOADRQBJIKY-WFASDCNBSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000877563335 643362698 /nfs/dbraw/zinc/36/26/98/643362698.db2.gz JOFZNWBAIBQZRR-ARFHVFGLSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000877563335 643362703 /nfs/dbraw/zinc/36/27/03/643362703.db2.gz JOFZNWBAIBQZRR-ARFHVFGLSA-N 0 3 275.392 2.826 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2c(C)cccc2[O-])CC1(C)C ZINC000877565030 643363590 /nfs/dbraw/zinc/36/35/90/643363590.db2.gz AUKQHDWZTHQDIO-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2c(C)cccc2[O-])CC1(C)C ZINC000877565030 643363595 /nfs/dbraw/zinc/36/35/95/643363595.db2.gz AUKQHDWZTHQDIO-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CC[C@@H](C)C[C@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605820 643393693 /nfs/dbraw/zinc/39/36/93/643393693.db2.gz JYVRZIWVBYLBCX-BXUZGUMPSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[N@H+]2C[C@]3(C)COC[C@]3(C)C2)c([O-])c1 ZINC000877626472 643412007 /nfs/dbraw/zinc/41/20/07/643412007.db2.gz WCCKCVLDUUDCHQ-IYBDPMFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)c([O-])c1 ZINC000877626472 643412010 /nfs/dbraw/zinc/41/20/10/643412010.db2.gz WCCKCVLDUUDCHQ-IYBDPMFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1COc2cc(F)ccc2C1 ZINC000877630804 643414736 /nfs/dbraw/zinc/41/47/36/643414736.db2.gz NGWXVIWCFPYBRT-CQSZACIVSA-N 0 3 287.334 2.933 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)c([O-])c1 ZINC000877640823 643425177 /nfs/dbraw/zinc/42/51/77/643425177.db2.gz STYKWIFLCYXDDX-KBXCAEBGSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(CNCc2c(C(F)(F)F)cnn2C)c(O)c1 ZINC000877651628 643432141 /nfs/dbraw/zinc/43/21/41/643432141.db2.gz ZDZOPDLHOSEKHM-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN COCCC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000877651670 643432530 /nfs/dbraw/zinc/43/25/30/643432530.db2.gz ZTDXLTPQXGGBBQ-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H]2CCSC2)c([O-])c1 ZINC000877661533 643439613 /nfs/dbraw/zinc/43/96/13/643439613.db2.gz DCTMGBPBZROORS-LBPRGKRZSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](O)C(F)(F)F)c1[O-] ZINC000877693601 643459739 /nfs/dbraw/zinc/45/97/39/643459739.db2.gz LTBKYXQZJPSPIS-RDDDGLTNSA-N 0 3 297.704 2.755 20 10 CFCDHN CC[C@H]1C[C@@H](C[N@@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702541 643467265 /nfs/dbraw/zinc/46/72/65/643467265.db2.gz AOYJCZOAZWDLPE-JSGCOSHPSA-N 0 3 261.365 2.913 20 10 CFCDHN CC[C@H]1C[C@@H](C[N@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702541 643467267 /nfs/dbraw/zinc/46/72/67/643467267.db2.gz AOYJCZOAZWDLPE-JSGCOSHPSA-N 0 3 261.365 2.913 20 10 CFCDHN Cc1cccc(C[N@@H+]2Cc3cccc([O-])c3C2)c1O ZINC000877702897 643467741 /nfs/dbraw/zinc/46/77/41/643467741.db2.gz JFZQWBUJXXCKGO-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN Cc1cccc(C[N@H+]2Cc3cccc([O-])c3C2)c1O ZINC000877702897 643467744 /nfs/dbraw/zinc/46/77/44/643467744.db2.gz JFZQWBUJXXCKGO-UHFFFAOYSA-N 0 3 255.317 2.922 20 10 CFCDHN CN1Cc2ccccc2[C@@H]1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000877733654 643493339 /nfs/dbraw/zinc/49/33/39/643493339.db2.gz VTNPLBZQSPKEOU-INIZCTEOSA-N 0 3 286.350 2.808 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877741563 643510563 /nfs/dbraw/zinc/51/05/63/643510563.db2.gz WENRECLKUWVKEP-KBPBESRZSA-N 0 3 293.432 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877741563 643510568 /nfs/dbraw/zinc/51/05/68/643510568.db2.gz WENRECLKUWVKEP-KBPBESRZSA-N 0 3 293.432 2.976 20 10 CFCDHN COCC(C)(C)CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877804695 643566087 /nfs/dbraw/zinc/56/60/87/643566087.db2.gz BFIZQTOEIWHAPO-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC2(CCC2)CO1 ZINC000878241509 643804986 /nfs/dbraw/zinc/80/49/86/643804986.db2.gz GYGORTDICOWMSE-AWEZNQCLSA-N 0 3 261.365 2.783 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1CC2(CCC2)CO1 ZINC000878241509 643804989 /nfs/dbraw/zinc/80/49/89/643804989.db2.gz GYGORTDICOWMSE-AWEZNQCLSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H]([NH2+]CC[S@](=O)c1ccccc1)c1ccccc1[O-] ZINC000879649776 644362671 /nfs/dbraw/zinc/36/26/71/644362671.db2.gz UPIBUCBOTDLSRZ-XCLFUZPHSA-N 0 3 289.400 2.851 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1cc(F)ccc1[O-] ZINC000094617965 650959917 /nfs/dbraw/zinc/95/99/17/650959917.db2.gz OHEQNRNEEQWOQC-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1cc(Cn2cc([C@H](C)N)nn2)ccc1N1CCCCC1 ZINC000881379299 644964375 /nfs/dbraw/zinc/96/43/75/644964375.db2.gz NXUBHLKOZWRFEW-AWEZNQCLSA-N 0 3 299.422 2.645 20 10 CFCDHN CCN(CC)c1ccc(CNCc2ccncc2N)cc1 ZINC000882902898 645502814 /nfs/dbraw/zinc/50/28/14/645502814.db2.gz ROWXEVZEURIOBU-UHFFFAOYSA-N 0 3 284.407 2.800 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[S@](C)=O)c([O-])c1 ZINC000252809533 651026312 /nfs/dbraw/zinc/02/63/12/651026312.db2.gz LSNIJWBOEWEVMN-PZROIBLQSA-N 0 3 269.410 2.508 20 10 CFCDHN CN(CC[NH+]1CCCC1)Cc1cc(Cl)ccc1[O-] ZINC000133905760 646253830 /nfs/dbraw/zinc/25/38/30/646253830.db2.gz RYOCSTKJGLQPSN-UHFFFAOYSA-N 0 3 268.788 2.573 20 10 CFCDHN CC[NH+](CC)[C@H]1CCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000134052552 646272190 /nfs/dbraw/zinc/27/21/90/646272190.db2.gz MBWSJOSNIDLPBU-AWEZNQCLSA-N 0 3 282.815 2.962 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)CN(C)C)c1c([O-])cccc1F ZINC000886487555 647016437 /nfs/dbraw/zinc/01/64/37/647016437.db2.gz IVZSOBFVFBCEGB-NSHDSACASA-N 0 3 268.376 2.770 20 10 CFCDHN CCc1ncc(CN[C@@H](C)c2c([O-])cccc2F)o1 ZINC000886620385 647071800 /nfs/dbraw/zinc/07/18/00/647071800.db2.gz IRWIPDQMRFHDNP-VIFPVBQESA-N 0 3 264.300 2.933 20 10 CFCDHN CCc1ncc(C[NH2+][C@@H](C)c2c([O-])cccc2F)o1 ZINC000886620385 647071803 /nfs/dbraw/zinc/07/18/03/647071803.db2.gz IRWIPDQMRFHDNP-VIFPVBQESA-N 0 3 264.300 2.933 20 10 CFCDHN CCC1([NH3+])CCN([C@@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000925761304 648311845 /nfs/dbraw/zinc/31/18/45/648311845.db2.gz ZBIBLYKTCYZVCB-JTQLQIEISA-N 0 3 284.350 2.935 20 10 CFCDHN [O-]c1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@@H]1CNOC1 ZINC000925862342 648348237 /nfs/dbraw/zinc/34/82/37/648348237.db2.gz OUXMQYBPSJFZDV-NVXWUHKLSA-N 0 3 298.386 2.559 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000927017802 648684418 /nfs/dbraw/zinc/68/44/18/648684418.db2.gz MVEHENVCJUKYJQ-CHWSQXEVSA-N 0 3 251.370 2.902 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(C2CC2)nn1C)c1cc(F)ccc1[O-] ZINC000927102082 648711923 /nfs/dbraw/zinc/71/19/23/648711923.db2.gz PYHDQXXCFMZRDH-JTQLQIEISA-N 0 3 289.354 2.993 20 10 CFCDHN Cc1nnsc1[C@H](C)N[C@H](C)c1ccccc1O ZINC000931555385 649453546 /nfs/dbraw/zinc/45/35/46/649453546.db2.gz YNMJWBNNBMPGKI-BDAKNGLRSA-N 0 3 263.366 2.964 20 10 CFCDHN Oc1ccccc1CN1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000305745610 651074167 /nfs/dbraw/zinc/07/41/67/651074167.db2.gz OEIHLNUDJLFOBD-CYBMUJFWSA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000305745610 651074170 /nfs/dbraw/zinc/07/41/70/651074170.db2.gz OEIHLNUDJLFOBD-CYBMUJFWSA-N 0 3 289.297 2.527 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](CF)C2)c1[O-] ZINC000711503843 781449238 /nfs/dbraw/zinc/44/92/38/781449238.db2.gz UQSWPMYNCSFLRT-SECBINFHSA-N 0 3 273.735 2.846 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](CF)C2)c1[O-] ZINC000711503843 781449244 /nfs/dbraw/zinc/44/92/44/781449244.db2.gz UQSWPMYNCSFLRT-SECBINFHSA-N 0 3 273.735 2.846 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CF)C2)c1[O-] ZINC000711503845 781449556 /nfs/dbraw/zinc/44/95/56/781449556.db2.gz UQSWPMYNCSFLRT-VIFPVBQESA-N 0 3 273.735 2.846 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](CF)C2)c1[O-] ZINC000711503845 781449561 /nfs/dbraw/zinc/44/95/61/781449561.db2.gz UQSWPMYNCSFLRT-VIFPVBQESA-N 0 3 273.735 2.846 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(N)cc2)CCN1Cc1ccccc1 ZINC000396480658 769829896 /nfs/dbraw/zinc/82/98/96/769829896.db2.gz LIMVUJJDFKUSCT-MRXNPFEDSA-N 0 3 295.430 2.975 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C2CC2)[C@@H]2CCCOC2)c1 ZINC000724011807 770748711 /nfs/dbraw/zinc/74/87/11/770748711.db2.gz SCAJJJKPFHCUJS-RHSMWYFYSA-N 0 3 275.392 2.995 20 10 CFCDHN C[C@@H]([NH2+]CCO[C@@H]1CC1(F)F)c1cc(F)ccc1[O-] ZINC000690725614 770779365 /nfs/dbraw/zinc/77/93/65/770779365.db2.gz GQCASPPLRUIJEI-PRHODGIISA-N 0 3 275.270 2.606 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CCC[C@@H]3C[C@@H]31)OCO2 ZINC000694257541 775417862 /nfs/dbraw/zinc/41/78/62/775417862.db2.gz QWJYTHJGRZGPSI-MDZLAQPJSA-N 0 3 275.348 2.647 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001140948214 775684531 /nfs/dbraw/zinc/68/45/31/775684531.db2.gz YJDFXXXBYOXLFY-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001140948214 775684534 /nfs/dbraw/zinc/68/45/34/775684534.db2.gz YJDFXXXBYOXLFY-CJNGLKHVSA-N 0 3 263.381 2.684 20 10 CFCDHN Oc1ccc(O)c(CN2CC[C@H](F)C(F)(F)CC2)c1 ZINC001141156379 775963045 /nfs/dbraw/zinc/96/30/45/775963045.db2.gz VNRVQMAYFVCWST-LBPRGKRZSA-N 0 3 275.270 2.667 20 10 CFCDHN Cc1cccc(CC[NH2+][C@H]2CCc3cccc([O-])c32)n1 ZINC000296548319 776041361 /nfs/dbraw/zinc/04/13/61/776041361.db2.gz STEXTADDHLQZBR-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN CN(Cc1c(O)ccc2ccccc21)C1(C)COC1 ZINC001231590164 777269228 /nfs/dbraw/zinc/26/92/28/777269228.db2.gz OAEDANMXZXANOW-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)C1(C)COC1 ZINC001231590164 777269237 /nfs/dbraw/zinc/26/92/37/777269237.db2.gz OAEDANMXZXANOW-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)C1(C)COC1 ZINC001231590164 777269244 /nfs/dbraw/zinc/26/92/44/777269244.db2.gz OAEDANMXZXANOW-UHFFFAOYSA-N 0 3 257.333 2.766 20 10 CFCDHN COc1cc(CN2CCC(F)(F)[C@H](C)C2)c(O)cc1O ZINC001231633996 777286700 /nfs/dbraw/zinc/28/67/00/777286700.db2.gz FSCNJNYINGAQRL-SECBINFHSA-N 0 3 287.306 2.584 20 10 CFCDHN COc1cc(CN(C)Cc2cccs2)c(O)cc1O ZINC001231636486 777287153 /nfs/dbraw/zinc/28/71/53/777287153.db2.gz WRGMFHXFYWOGQT-UHFFFAOYSA-N 0 3 279.361 2.800 20 10 CFCDHN COc1cc(CN2CCCC[C@@](C)(F)C2)c(O)cc1O ZINC001231635394 777287878 /nfs/dbraw/zinc/28/78/78/777287878.db2.gz XWUSGYIZVAQTHJ-OAHLLOKOSA-N 0 3 283.343 2.821 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001231842788 777346738 /nfs/dbraw/zinc/34/67/38/777346738.db2.gz PTMYZBNOXDMAEK-RHSMWYFYSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001231842788 777346743 /nfs/dbraw/zinc/34/67/43/777346743.db2.gz PTMYZBNOXDMAEK-RHSMWYFYSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC(CF)CC1 ZINC001231853655 777351772 /nfs/dbraw/zinc/35/17/72/777351772.db2.gz NOEUZGVQTQAPKH-UHFFFAOYSA-N 0 3 280.387 2.943 20 10 CFCDHN CCCO[C@@H]1CCN(Cc2ccc(N(C)C)cc2OC)C1 ZINC001231851743 777352380 /nfs/dbraw/zinc/35/23/80/777352380.db2.gz HBFRPMMTUXZGEI-MRXNPFEDSA-N 0 3 292.423 2.762 20 10 CFCDHN CCC[C@H]1CCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233014068 777764378 /nfs/dbraw/zinc/76/43/78/777764378.db2.gz YASXZQOZBUPMHZ-LBPRGKRZSA-N 0 3 265.353 2.958 20 10 CFCDHN C[C@@H]1CCCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233012168 777764599 /nfs/dbraw/zinc/76/45/99/777764599.db2.gz JBDHBKOCEVQPPW-SNVBAGLBSA-N 0 3 251.326 2.568 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1cccc3c1CCO3)CC2 ZINC001233277582 777861752 /nfs/dbraw/zinc/86/17/52/777861752.db2.gz IQFXNVKYQVTQJE-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1cccc3c1CCO3)CC2 ZINC001233277582 777861759 /nfs/dbraw/zinc/86/17/59/777861759.db2.gz IQFXNVKYQVTQJE-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H]3C[C@H]2C[C@H]3F)c1O ZINC001233289937 777869448 /nfs/dbraw/zinc/86/94/48/777869448.db2.gz YLFOTOZEVLLART-KPXOXKRLSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1[O-] ZINC001233289937 777869455 /nfs/dbraw/zinc/86/94/55/777869455.db2.gz YLFOTOZEVLLART-KPXOXKRLSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1[O-] ZINC001233289937 777869461 /nfs/dbraw/zinc/86/94/61/777869461.db2.gz YLFOTOZEVLLART-KPXOXKRLSA-N 0 3 285.746 2.987 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c1[O-] ZINC001233287803 777870394 /nfs/dbraw/zinc/87/03/94/777870394.db2.gz HVJFXPPBKBUESH-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CO)c1[O-] ZINC001233287803 777870406 /nfs/dbraw/zinc/87/04/06/777870406.db2.gz HVJFXPPBKBUESH-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN Oc1cccc2c1CN(Cc1cccc3nccn31)CC2 ZINC001233363696 777913967 /nfs/dbraw/zinc/91/39/67/777913967.db2.gz VMJVBVKXTCJJHU-UHFFFAOYSA-N 0 3 279.343 2.598 20 10 CFCDHN C[C@H]1Cc2ccccc2CN1Cc1cc(O)c(O)cc1O ZINC001233486385 777963504 /nfs/dbraw/zinc/96/35/04/777963504.db2.gz LIRJDSCWUZRSJL-NSHDSACASA-N 0 3 285.343 2.750 20 10 CFCDHN CC1(C)CN(Cc2cc(O)c(O)cc2O)CCC1(F)F ZINC001233483230 777963691 /nfs/dbraw/zinc/96/36/91/777963691.db2.gz RIGFLSSATDUDBU-UHFFFAOYSA-N 0 3 287.306 2.671 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCN3CC[C@H]3C2)cccc1-c1ccccc1 ZINC001234997500 778348794 /nfs/dbraw/zinc/34/87/94/778348794.db2.gz AJJHBQVZLZILGE-KRWDZBQOSA-N 0 3 294.398 2.949 20 10 CFCDHN [O-]c1c(C[N@H+]2CCN3CC[C@H]3C2)cccc1-c1ccccc1 ZINC001234997500 778348801 /nfs/dbraw/zinc/34/88/01/778348801.db2.gz AJJHBQVZLZILGE-KRWDZBQOSA-N 0 3 294.398 2.949 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@]3(CC[NH2+]C3)C2)cc1Cl ZINC001234997358 778349599 /nfs/dbraw/zinc/34/95/99/778349599.db2.gz BQXYIIKKQXQTDC-INIZCTEOSA-N 0 3 294.826 2.930 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CC[NH2+][C@H]3C[C@H]32)cc1Cl ZINC001235291347 778445215 /nfs/dbraw/zinc/44/52/15/778445215.db2.gz HWVIZDIXJYYBLK-UONOGXRCSA-N 0 3 294.826 2.889 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001235676456 778533108 /nfs/dbraw/zinc/53/31/08/778533108.db2.gz SPABQQRAOMIUKI-LSDHHAIUSA-N 0 3 295.398 2.985 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001235676456 778533112 /nfs/dbraw/zinc/53/31/12/778533112.db2.gz SPABQQRAOMIUKI-LSDHHAIUSA-N 0 3 295.398 2.985 20 10 CFCDHN CN1CC2(C1)CC[N@H+](Cc1ccc(C(C)(C)C)cc1[O-])C2 ZINC001235680483 778535808 /nfs/dbraw/zinc/53/58/08/778535808.db2.gz VNIPPJREQNQPDP-UHFFFAOYSA-N 0 3 288.435 2.827 20 10 CFCDHN CN1CC2(C1)CC[N@@H+](Cc1ccc(C(C)(C)C)cc1[O-])C2 ZINC001235680483 778535809 /nfs/dbraw/zinc/53/58/09/778535809.db2.gz VNIPPJREQNQPDP-UHFFFAOYSA-N 0 3 288.435 2.827 20 10 CFCDHN CN(Cc1cccc(Cl)c1[O-])C[C@H]1CCC[N@@H+]1C ZINC000160248015 778597491 /nfs/dbraw/zinc/59/74/91/778597491.db2.gz LFMYBUPMQHCJGO-GFCCVEGCSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(Cc1cccc(Cl)c1[O-])C[C@H]1CCC[N@H+]1C ZINC000160248015 778597495 /nfs/dbraw/zinc/59/74/95/778597495.db2.gz LFMYBUPMQHCJGO-GFCCVEGCSA-N 0 3 268.788 2.572 20 10 CFCDHN CCC[C@@H]1C[NH2+]CCN1Cc1cc(Cl)c(OC)cc1[O-] ZINC001236132352 778707103 /nfs/dbraw/zinc/70/71/03/778707103.db2.gz IUSFUMIRZODRSV-GFCCVEGCSA-N 0 3 298.814 2.628 20 10 CFCDHN CCCN(Cc1ccc(Cl)cc1[O-])[C@H]1CC[NH2+]C1 ZINC001236324371 778781339 /nfs/dbraw/zinc/78/13/39/778781339.db2.gz UHNWKQQBTBXMDB-ZDUSSCGKSA-N 0 3 268.788 2.620 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](O)CC2)c([O-])c1 ZINC001236784669 778935153 /nfs/dbraw/zinc/93/51/53/778935153.db2.gz YCWNXUWBPULXLA-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@H](O)CC2)c([O-])c1 ZINC001236784669 778935156 /nfs/dbraw/zinc/93/51/56/778935156.db2.gz YCWNXUWBPULXLA-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN COc1cc([O-])c(CN2CCC[C@H]2C[NH+](C)C)c(Cl)c1 ZINC001236803367 778945648 /nfs/dbraw/zinc/94/56/48/778945648.db2.gz MVZSERGOHJXFJO-NSHDSACASA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236816039 778950137 /nfs/dbraw/zinc/95/01/37/778950137.db2.gz QGZGEAWOIGCJLP-IUODEOHRSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236816039 778950141 /nfs/dbraw/zinc/95/01/41/778950141.db2.gz QGZGEAWOIGCJLP-IUODEOHRSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC001236814987 778951011 /nfs/dbraw/zinc/95/10/11/778951011.db2.gz YXDWJIBDACVSBJ-UHFFFAOYSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC001236814987 778951015 /nfs/dbraw/zinc/95/10/15/778951015.db2.gz YXDWJIBDACVSBJ-UHFFFAOYSA-N 0 3 291.391 2.712 20 10 CFCDHN OC[C@H]1C[C@@H](F)CN(Cc2cc3ccccc3cc2O)C1 ZINC001236826181 778954916 /nfs/dbraw/zinc/95/49/16/778954916.db2.gz HUTQTKXXGHFJRH-BLLLJJGKSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@H](F)C[C@H](CO)C1 ZINC001236826181 778954923 /nfs/dbraw/zinc/95/49/23/778954923.db2.gz HUTQTKXXGHFJRH-BLLLJJGKSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@H](F)C[C@H](CO)C1 ZINC001236826181 778954929 /nfs/dbraw/zinc/95/49/29/778954929.db2.gz HUTQTKXXGHFJRH-BLLLJJGKSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CCN(C2CC2)CC1 ZINC001236827534 778956738 /nfs/dbraw/zinc/95/67/38/778956738.db2.gz URKPSCTZUKWXAI-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN CC[C@H]([NH3+])CN(C)Cc1ccc(C(F)(F)F)cc1[O-] ZINC001236884226 778972233 /nfs/dbraw/zinc/97/22/33/778972233.db2.gz MOQCDWYBJXMMAV-NSHDSACASA-N 0 3 276.302 2.580 20 10 CFCDHN CCCO[C@H]1CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC001237041122 778995908 /nfs/dbraw/zinc/99/59/08/778995908.db2.gz FOENCXAHDJKQQY-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCO[C@H]1CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC001237041122 778995912 /nfs/dbraw/zinc/99/59/12/778995912.db2.gz FOENCXAHDJKQQY-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCO[C@@H]1CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC001237041124 778996459 /nfs/dbraw/zinc/99/64/59/778996459.db2.gz FOENCXAHDJKQQY-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCO[C@@H]1CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC001237041124 778996460 /nfs/dbraw/zinc/99/64/60/778996460.db2.gz FOENCXAHDJKQQY-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@H](CO)C2)c([O-])c1 ZINC001237048456 778998477 /nfs/dbraw/zinc/99/84/77/778998477.db2.gz RXAWNWWNXYUBBX-ZDUSSCGKSA-N 0 3 263.381 2.720 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@H](CO)C2)c([O-])c1 ZINC001237048456 778998478 /nfs/dbraw/zinc/99/84/78/778998478.db2.gz RXAWNWWNXYUBBX-ZDUSSCGKSA-N 0 3 263.381 2.720 20 10 CFCDHN C[C@H]1COCC[N@H+](Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122770 779011677 /nfs/dbraw/zinc/01/16/77/779011677.db2.gz YMWRVUXFRUNVPF-SECBINFHSA-N 0 3 273.735 2.653 20 10 CFCDHN C[C@H]1COCC[N@@H+](Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122770 779011688 /nfs/dbraw/zinc/01/16/88/779011688.db2.gz YMWRVUXFRUNVPF-SECBINFHSA-N 0 3 273.735 2.653 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CO)c1[O-] ZINC001237682084 779160617 /nfs/dbraw/zinc/16/06/17/779160617.db2.gz XNWMQZXIMOWGLC-YGRLFVJLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c1[O-] ZINC001237682084 779160620 /nfs/dbraw/zinc/16/06/20/779160620.db2.gz XNWMQZXIMOWGLC-YGRLFVJLSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3OCC[C@@H]3C2)c1[O-] ZINC001237686727 779160791 /nfs/dbraw/zinc/16/07/91/779160791.db2.gz MELKDQVTEPNOPG-BXUZGUMPSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3OCC[C@@H]3C2)c1[O-] ZINC001237686727 779160794 /nfs/dbraw/zinc/16/07/94/779160794.db2.gz MELKDQVTEPNOPG-BXUZGUMPSA-N 0 3 281.783 2.965 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237686852 779160926 /nfs/dbraw/zinc/16/09/26/779160926.db2.gz QJGLBYXEVTVYFW-LLVKDONJSA-N 0 3 297.782 2.739 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237686852 779160928 /nfs/dbraw/zinc/16/09/28/779160928.db2.gz QJGLBYXEVTVYFW-LLVKDONJSA-N 0 3 297.782 2.739 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@](C)(O)C2)c1[O-] ZINC001237681882 779161487 /nfs/dbraw/zinc/16/14/87/779161487.db2.gz UKRUGXYFACLHBD-ABAIWWIYSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)C2)c1[O-] ZINC001237681882 779161491 /nfs/dbraw/zinc/16/14/91/779161491.db2.gz UKRUGXYFACLHBD-ABAIWWIYSA-N 0 3 283.799 2.947 20 10 CFCDHN CO[C@H](C)C1C[NH+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237690679 779162284 /nfs/dbraw/zinc/16/22/84/779162284.db2.gz ZJRIEZBSAHGESN-SNVBAGLBSA-N 0 3 269.772 2.821 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935816 779211574 /nfs/dbraw/zinc/21/15/74/779211574.db2.gz ZJRNHSOIIRVNNK-VIFPVBQESA-N 0 3 273.735 2.796 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935816 779211577 /nfs/dbraw/zinc/21/15/77/779211577.db2.gz ZJRNHSOIIRVNNK-VIFPVBQESA-N 0 3 273.735 2.796 20 10 CFCDHN Cc1cc(F)cc(CN2CCN(C3CCC3)CC2)c1O ZINC001238057770 779241259 /nfs/dbraw/zinc/24/12/59/779241259.db2.gz MRHBKBVSKJEOJZ-UHFFFAOYSA-N 0 3 278.371 2.510 20 10 CFCDHN CCN(Cc1cnc(F)c(OC)c1)Cc1ccccc1O ZINC001238450348 779318090 /nfs/dbraw/zinc/31/80/90/779318090.db2.gz DBGVEENXSLNWNM-UHFFFAOYSA-N 0 3 290.338 2.957 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H](C)C[C@H]([NH3+])C2)cc1Cl ZINC001236050960 779449992 /nfs/dbraw/zinc/44/99/92/779449992.db2.gz VEIDVZJIZILJFC-CABZTGNLSA-N 0 3 268.788 2.523 20 10 CFCDHN CN(CC[NH+](C)C)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236792581 779639042 /nfs/dbraw/zinc/63/90/42/779639042.db2.gz FJOZFMUTFMTGRT-UHFFFAOYSA-N 0 3 277.195 2.692 20 10 CFCDHN CN(C)CC[N@H+](C)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236792581 779639045 /nfs/dbraw/zinc/63/90/45/779639045.db2.gz FJOZFMUTFMTGRT-UHFFFAOYSA-N 0 3 277.195 2.692 20 10 CFCDHN CN(C)CC[N@@H+](C)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236792581 779639047 /nfs/dbraw/zinc/63/90/47/779639047.db2.gz FJOZFMUTFMTGRT-UHFFFAOYSA-N 0 3 277.195 2.692 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@](C)(O)[C@@H](C)C1 ZINC001237486083 779689132 /nfs/dbraw/zinc/68/91/32/779689132.db2.gz VKAFQSBUZFKJRJ-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@](C)(O)[C@@H](C)C1 ZINC001237486083 779689138 /nfs/dbraw/zinc/68/91/38/779689138.db2.gz VKAFQSBUZFKJRJ-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](O)C2)c1[O-] ZINC001237680626 779706080 /nfs/dbraw/zinc/70/60/80/779706080.db2.gz DYBKXXVDZKVJCM-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](O)C2)c1[O-] ZINC001237680626 779706074 /nfs/dbraw/zinc/70/60/74/779706074.db2.gz DYBKXXVDZKVJCM-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN Cn1c(=O)cccc1C1=CCCN(Cc2ccccc2)C1 ZINC001240386347 780129735 /nfs/dbraw/zinc/12/97/35/780129735.db2.gz AELMGADUTYCHMM-UHFFFAOYSA-N 0 3 280.371 2.675 20 10 CFCDHN CCc1noc([C@H]2CC[C@@H]([NH2+]Cc3ccccc3[O-])C2)n1 ZINC000922865639 780574026 /nfs/dbraw/zinc/57/40/26/780574026.db2.gz JYRQWTMRUQQYJL-WCQYABFASA-N 0 3 287.363 2.764 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cncc(F)c2)c1 ZINC000700798214 780719897 /nfs/dbraw/zinc/71/98/97/780719897.db2.gz VJERLALRZVJKQM-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN [O-]c1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001137837460 781139717 /nfs/dbraw/zinc/13/97/17/781139717.db2.gz HWAKWHTWMXQDDO-CQSZACIVSA-N 0 3 273.311 2.658 20 10 CFCDHN [O-]c1cccc(F)c1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001137837460 781139720 /nfs/dbraw/zinc/13/97/20/781139720.db2.gz HWAKWHTWMXQDDO-CQSZACIVSA-N 0 3 273.311 2.658 20 10 CFCDHN Oc1cccc(F)c1CN1CCC[C@@H]1c1cnccn1 ZINC001137837460 781139722 /nfs/dbraw/zinc/13/97/22/781139722.db2.gz HWAKWHTWMXQDDO-CQSZACIVSA-N 0 3 273.311 2.658 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@H](C)F)c1[O-] ZINC000705762537 781147043 /nfs/dbraw/zinc/14/70/43/781147043.db2.gz SMLUMTUKJSJFNL-QMMMGPOBSA-N 0 3 261.724 2.892 20 10 CFCDHN C[NH+](C)C1CC(NCc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000706103245 781158650 /nfs/dbraw/zinc/15/86/50/781158650.db2.gz SCOMHYZEYFCLHN-UHFFFAOYSA-N 0 3 289.206 2.881 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@H](C(C)(C)C)C2)c1 ZINC000709000571 781287060 /nfs/dbraw/zinc/28/70/60/781287060.db2.gz OQKLYXSYRGBANA-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CC1(C)CC[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])OC1 ZINC000711279953 781405874 /nfs/dbraw/zinc/40/58/74/781405874.db2.gz ZYCIXPVBYUGMSF-ZDUSSCGKSA-N 0 3 267.344 2.826 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])C(C)(C)O ZINC000295001372 199294234 /nfs/dbraw/zinc/29/42/34/199294234.db2.gz MAOQJBXQQKVQKI-SMDDNHRTSA-N 0 3 251.370 2.901 20 10 CFCDHN COc1ccc(CNC[C@@H](OC)C(C)C)cc1C ZINC000072924662 346948990 /nfs/dbraw/zinc/94/89/90/346948990.db2.gz IXWBTKXWXBXSNC-OAHLLOKOSA-N 0 3 251.370 2.764 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)c1ccccc1[O-])[C@@H](O)C(F)F ZINC000295131851 199362463 /nfs/dbraw/zinc/36/24/63/199362463.db2.gz YDBVQLQAQDOMQQ-DMDPSCGWSA-N 0 3 273.323 2.838 20 10 CFCDHN CN(C)c1ccc(CN2CCC(n3cccn3)CC2)cc1 ZINC000092617557 347634987 /nfs/dbraw/zinc/63/49/87/347634987.db2.gz UXIIRDLHUCKKME-UHFFFAOYSA-N 0 3 284.407 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)c1ccccc1)CC2 ZINC000296012550 199752498 /nfs/dbraw/zinc/75/24/98/199752498.db2.gz OZYMIGDCHAUYSX-GDBMZVCRSA-N 0 3 269.344 2.703 20 10 CFCDHN COc1cccc(C[NH2+]CC(C)(C)c2ccccn2)c1[O-] ZINC000294841815 199207811 /nfs/dbraw/zinc/20/78/11/199207811.db2.gz RFCPIFGDBUGEPN-UHFFFAOYSA-N 0 3 286.375 2.863 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC[C@H](C)CCO)c1 ZINC000297350424 200157780 /nfs/dbraw/zinc/15/77/80/200157780.db2.gz PCLAXZDCHRYLPQ-AAEUAGOBSA-N 0 3 251.370 2.760 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297553551 200225980 /nfs/dbraw/zinc/22/59/80/200225980.db2.gz FUNXTQFTSOTDAY-UKRRQHHQSA-N 0 3 263.381 2.766 20 10 CFCDHN CC(C)(C)OC(=O)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297556725 200227096 /nfs/dbraw/zinc/22/70/96/200227096.db2.gz FXLNFTFJZUSJNN-GFCCVEGCSA-N 0 3 277.364 2.701 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297645812 200250965 /nfs/dbraw/zinc/25/09/65/200250965.db2.gz JYIPDYGRTHYCNK-TZMCWYRMSA-N 0 3 263.381 2.768 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])C(C)C ZINC000296431243 284306889 /nfs/dbraw/zinc/30/68/89/284306889.db2.gz LVUBXORABNUUFE-CJNGLKHVSA-N 0 3 292.423 2.854 20 10 CFCDHN CCOC(=O)N1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000019965236 372217875 /nfs/dbraw/zinc/21/78/75/372217875.db2.gz UPDKUJNMKJHUJV-LBPRGKRZSA-N 0 3 292.379 2.664 20 10 CFCDHN COc1ccc(CN[C@@H]2CCCc3c2cnn3C)cc1C ZINC000030908852 372401164 /nfs/dbraw/zinc/40/11/64/372401164.db2.gz ZPQKDVQHQJUXKC-OAHLLOKOSA-N 0 3 285.391 2.904 20 10 CFCDHN CC[C@@H]([NH2+]CCC(=O)N[C@@H](C)CC)c1ccccc1[O-] ZINC000038013588 372766750 /nfs/dbraw/zinc/76/67/50/372766750.db2.gz GNYPTLNBOKPVGP-GXTWGEPZSA-N 0 3 278.396 2.738 20 10 CFCDHN CC[C@@H](C)NC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000038014107 372768765 /nfs/dbraw/zinc/76/87/65/372768765.db2.gz RDRSAMTWXAOXCM-ZIAGYGMSSA-N 0 3 291.439 2.708 20 10 CFCDHN CC(C)C[C@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879704 372964148 /nfs/dbraw/zinc/96/41/48/372964148.db2.gz DLUMNGUWGFKQKR-JTQLQIEISA-N 0 3 251.326 2.645 20 10 CFCDHN CC[C@@H](C)[C@@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880438 372964540 /nfs/dbraw/zinc/96/45/40/372964540.db2.gz ZKMICAGICRMYKU-NXEZZACHSA-N 0 3 251.326 2.645 20 10 CFCDHN CC(C)CCC[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042880326 372964711 /nfs/dbraw/zinc/96/47/11/372964711.db2.gz DPECQIKWARAUDY-UHFFFAOYSA-N 0 3 251.326 2.647 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2nccs2)c1 ZINC000063133390 373787461 /nfs/dbraw/zinc/78/74/61/373787461.db2.gz FXTKRDPDWPZRLU-JTQLQIEISA-N 0 3 278.377 2.751 20 10 CFCDHN CCCCOCCC[NH2+]Cc1cc(OC)ccc1[O-] ZINC000083495524 374748966 /nfs/dbraw/zinc/74/89/66/374748966.db2.gz DYZJEISGBONWEO-UHFFFAOYSA-N 0 3 267.369 2.697 20 10 CFCDHN COc1cccc(CN2CC[C@@H](OCC(C)C)C2)c1O ZINC000091964458 375074940 /nfs/dbraw/zinc/07/49/40/375074940.db2.gz AHQAOXXXPUUPJQ-CQSZACIVSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1[O-] ZINC000091964458 375074950 /nfs/dbraw/zinc/07/49/50/375074950.db2.gz AHQAOXXXPUUPJQ-CQSZACIVSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1[O-] ZINC000091964458 375074954 /nfs/dbraw/zinc/07/49/54/375074954.db2.gz AHQAOXXXPUUPJQ-CQSZACIVSA-N 0 3 279.380 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000093820550 375316973 /nfs/dbraw/zinc/31/69/73/375316973.db2.gz SHRFEYYNKWLLSN-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)c([O-])c1 ZINC000093820550 375316977 /nfs/dbraw/zinc/31/69/77/375316977.db2.gz SHRFEYYNKWLLSN-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@H](C)CCSC)c1[O-] ZINC000093558848 375268072 /nfs/dbraw/zinc/26/80/72/375268072.db2.gz LEHTXOMKRQLPME-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@H](C)CCSC)c1[O-] ZINC000093558848 375268080 /nfs/dbraw/zinc/26/80/80/375268080.db2.gz LEHTXOMKRQLPME-LLVKDONJSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000093609812 375271928 /nfs/dbraw/zinc/27/19/28/375271928.db2.gz ULRREWDOIPWLCL-MAZHCROVSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000093609812 375271931 /nfs/dbraw/zinc/27/19/31/375271931.db2.gz ULRREWDOIPWLCL-MAZHCROVSA-N 0 3 291.391 2.646 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000112017192 375878088 /nfs/dbraw/zinc/87/80/88/375878088.db2.gz FUTNSQFPRSRGDW-ZIAGYGMSSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000112017192 375878091 /nfs/dbraw/zinc/87/80/91/375878091.db2.gz FUTNSQFPRSRGDW-ZIAGYGMSSA-N 0 3 280.799 2.762 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1[O-] ZINC000121251276 376791056 /nfs/dbraw/zinc/79/10/56/376791056.db2.gz ZWWFLGSUVTVXJZ-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1[O-] ZINC000121251276 376791060 /nfs/dbraw/zinc/79/10/60/376791060.db2.gz ZWWFLGSUVTVXJZ-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c1[O-] ZINC000121251130 376791210 /nfs/dbraw/zinc/79/12/10/376791210.db2.gz ZWWFLGSUVTVXJZ-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1[O-] ZINC000121251130 376791218 /nfs/dbraw/zinc/79/12/18/376791218.db2.gz ZWWFLGSUVTVXJZ-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)N1CCCCC1)c1cc(F)ccc1[O-] ZINC000123762709 376976366 /nfs/dbraw/zinc/97/63/66/376976366.db2.gz VFWATCUNFGNVGD-GFCCVEGCSA-N 0 3 294.370 2.585 20 10 CFCDHN Cc1cccc(C[NH2+]CCN2CCCCCC2)c1[O-] ZINC000124686453 377078336 /nfs/dbraw/zinc/07/83/36/377078336.db2.gz FIGJOVZAEKEFNC-UHFFFAOYSA-N 0 3 262.397 2.666 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000124703363 377080255 /nfs/dbraw/zinc/08/02/55/377080255.db2.gz OTECFETZLZHQCH-LLVKDONJSA-N 0 3 280.799 2.620 20 10 CFCDHN COc1ccc(OC)c(CNCc2ccccc2O)c1 ZINC000133890453 377965809 /nfs/dbraw/zinc/96/58/09/377965809.db2.gz HFOLYNBVZOFIOP-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CCCOC)c([O-])c1 ZINC000134051144 377979694 /nfs/dbraw/zinc/97/96/94/377979694.db2.gz LRIYABQNPITWML-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CCCOC)c([O-])c1 ZINC000134051144 377979698 /nfs/dbraw/zinc/97/96/98/377979698.db2.gz LRIYABQNPITWML-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1[O-] ZINC000136717010 378207915 /nfs/dbraw/zinc/20/79/15/378207915.db2.gz AWMPLPCCMAJXPB-AWEZNQCLSA-N 0 3 291.391 2.982 20 10 CFCDHN C[S@](=O)C[C@@H](NCc1ccccc1O)c1ccccc1 ZINC000154687130 378589259 /nfs/dbraw/zinc/58/92/59/378589259.db2.gz IUEKJIBRRFXKOZ-FOIQADDNSA-N 0 3 289.400 2.602 20 10 CFCDHN C[S@](=O)C[C@H](NCc1ccccc1O)c1ccccc1 ZINC000154686988 378589363 /nfs/dbraw/zinc/58/93/63/378589363.db2.gz IUEKJIBRRFXKOZ-MGPUTAFESA-N 0 3 289.400 2.602 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@@H]2CCCOC2)c1[O-] ZINC000529637070 383739730 /nfs/dbraw/zinc/73/97/30/383739730.db2.gz NIAYJPKSENAWPP-NSHDSACASA-N 0 3 299.798 2.961 20 10 CFCDHN Cc1ccc(CN(C)C)cc1NC(=O)Cc1ccc(N)cc1 ZINC000178829347 380487978 /nfs/dbraw/zinc/48/79/78/380487978.db2.gz RERUMBUZPHRZDK-UHFFFAOYSA-N 0 3 297.402 2.820 20 10 CFCDHN COc1cc(C[N@H+](C)Cc2ccccc2[O-])ccc1O ZINC000179555788 380557466 /nfs/dbraw/zinc/55/74/66/380557466.db2.gz HLHMKZAFVMTDOP-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN COc1cc(C[N@@H+](C)Cc2ccccc2[O-])ccc1O ZINC000179555788 380557475 /nfs/dbraw/zinc/55/74/75/380557475.db2.gz HLHMKZAFVMTDOP-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN CCN1CC[C@H]([N@H+](C)Cc2ccccc2[O-])[C@H](C)C1 ZINC000179579567 380560100 /nfs/dbraw/zinc/56/01/00/380560100.db2.gz RCAHHVUDNPZOJH-HIFRSBDPSA-N 0 3 262.397 2.554 20 10 CFCDHN CCN1CC[C@H]([N@@H+](C)Cc2ccccc2[O-])[C@H](C)C1 ZINC000179579567 380560108 /nfs/dbraw/zinc/56/01/08/380560108.db2.gz RCAHHVUDNPZOJH-HIFRSBDPSA-N 0 3 262.397 2.554 20 10 CFCDHN Cc1cnc(CC[N@@H+](C)Cc2ccccc2[O-])s1 ZINC000179582682 380560932 /nfs/dbraw/zinc/56/09/32/380560932.db2.gz YCAKGYOGJNJJQV-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1cnc(CC[N@H+](C)Cc2ccccc2[O-])s1 ZINC000179582682 380560934 /nfs/dbraw/zinc/56/09/34/380560934.db2.gz YCAKGYOGJNJJQV-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000179667881 380570161 /nfs/dbraw/zinc/57/01/61/380570161.db2.gz BLYNNRYOBZFGNT-CHWSQXEVSA-N 0 3 273.380 2.884 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCOC2)c1[O-] ZINC000180342546 380646044 /nfs/dbraw/zinc/64/60/44/380646044.db2.gz VYHYOANZSMSOJL-LLVKDONJSA-N 0 3 269.772 2.870 20 10 CFCDHN COc1cc(C[N@H+](C)Cc2cc(F)ccc2[O-])ccc1O ZINC000179911531 380595405 /nfs/dbraw/zinc/59/54/05/380595405.db2.gz LRHCCBGUAGBLRA-UHFFFAOYSA-N 0 3 291.322 2.878 20 10 CFCDHN COc1cc(C[N@@H+](C)Cc2cc(F)ccc2[O-])ccc1O ZINC000179911531 380595412 /nfs/dbraw/zinc/59/54/12/380595412.db2.gz LRHCCBGUAGBLRA-UHFFFAOYSA-N 0 3 291.322 2.878 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@H](C(C)C)C2)c1 ZINC000180668939 380688350 /nfs/dbraw/zinc/68/83/50/380688350.db2.gz QDLUQZZOBXVUNI-HNNXBMFYSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@H](C(C)C)C2)c1 ZINC000180668939 380688352 /nfs/dbraw/zinc/68/83/52/380688352.db2.gz QDLUQZZOBXVUNI-HNNXBMFYSA-N 0 3 281.421 2.974 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccc(F)cc1 ZINC000180900326 380710381 /nfs/dbraw/zinc/71/03/81/380710381.db2.gz SWZYRVJZSUCFOR-MRXNPFEDSA-N 0 3 293.313 2.668 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c1 ZINC000368100903 380923138 /nfs/dbraw/zinc/92/31/38/380923138.db2.gz IXXZJZWVKOKMDQ-VXGBXAGGSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c1 ZINC000368100900 380924055 /nfs/dbraw/zinc/92/40/55/380924055.db2.gz IXXZJZWVKOKMDQ-NEPJUHHUSA-N 0 3 271.364 2.632 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000295926085 381161558 /nfs/dbraw/zinc/16/15/58/381161558.db2.gz JZRHLVJJVUQPML-RDJZCZTQSA-N 0 3 299.370 2.711 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCN(C3CC3)C[C@H](C)C2)c1 ZINC000295992251 381200153 /nfs/dbraw/zinc/20/01/53/381200153.db2.gz KHSNMYVTUWHQAQ-CQSZACIVSA-N 0 3 274.408 2.617 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCN(C3CC3)C[C@H](C)C2)c1 ZINC000295992251 381200162 /nfs/dbraw/zinc/20/01/62/381200162.db2.gz KHSNMYVTUWHQAQ-CQSZACIVSA-N 0 3 274.408 2.617 20 10 CFCDHN C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000296008038 381208637 /nfs/dbraw/zinc/20/86/37/381208637.db2.gz QVSZALZJRBEFPY-YUELXQCFSA-N 0 3 292.398 2.990 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCN(CC3CC3)CC1)CC2 ZINC000296031225 381220508 /nfs/dbraw/zinc/22/05/08/381220508.db2.gz QCGYXQXYCHPWMU-MRXNPFEDSA-N 0 3 286.419 2.844 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCC(C)(F)F)c1 ZINC000296050031 381232664 /nfs/dbraw/zinc/23/26/64/381232664.db2.gz OMUPZDYJYKVKAO-UHFFFAOYSA-N 0 3 259.296 2.926 20 10 CFCDHN C[C@H]([NH2+]CCN1CCCC[C@H]1C)c1ccccc1[O-] ZINC000183420066 381269454 /nfs/dbraw/zinc/26/94/54/381269454.db2.gz OKHCRAGYOGDDMN-KGLIPLIRSA-N 0 3 262.397 2.917 20 10 CFCDHN CC1([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)OCCO1 ZINC000183242819 381240787 /nfs/dbraw/zinc/24/07/87/381240787.db2.gz LREMCXXEIRUOGB-ZDUSSCGKSA-N 0 3 295.354 2.506 20 10 CFCDHN CC1([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)OCCO1 ZINC000183242819 381240791 /nfs/dbraw/zinc/24/07/91/381240791.db2.gz LREMCXXEIRUOGB-ZDUSSCGKSA-N 0 3 295.354 2.506 20 10 CFCDHN CSC1(C[NH2+][C@H](C)c2ccccc2[O-])CCOCC1 ZINC000183612802 381293656 /nfs/dbraw/zinc/29/36/56/381293656.db2.gz WLXWCODOWDCCPJ-GFCCVEGCSA-N 0 3 281.421 2.955 20 10 CFCDHN C[C@H]([NH2+]CCCOC1CCOCC1)c1ccccc1[O-] ZINC000183612011 381293797 /nfs/dbraw/zinc/29/37/97/381293797.db2.gz YTCKZDZNPPHXLV-ZDUSSCGKSA-N 0 3 279.380 2.629 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])[nH]n1 ZINC000183621586 381294949 /nfs/dbraw/zinc/29/49/49/381294949.db2.gz ANEPZKSBWRDJBH-PWSUYJOCSA-N 0 3 259.353 2.706 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])n[nH]1 ZINC000183621586 381294959 /nfs/dbraw/zinc/29/49/59/381294959.db2.gz ANEPZKSBWRDJBH-PWSUYJOCSA-N 0 3 259.353 2.706 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1[O-] ZINC000183453173 381273329 /nfs/dbraw/zinc/27/33/29/381273329.db2.gz BAGZFNAMLHIIKW-KGLIPLIRSA-N 0 3 296.370 2.848 20 10 CFCDHN COCCCN1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000183484494 381276997 /nfs/dbraw/zinc/27/69/97/381276997.db2.gz YWSHIPJJSVFOCU-AWEZNQCLSA-N 0 3 292.423 2.544 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000183492746 381280137 /nfs/dbraw/zinc/28/01/37/381280137.db2.gz FOWIYIPRJNHEEN-GHMZBOCLSA-N 0 3 259.353 2.846 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@](C)(OC)CC2)c1 ZINC000369529251 381281487 /nfs/dbraw/zinc/28/14/87/381281487.db2.gz DLDSDPDRHXRNBX-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@](C)(OC)CC2)c1 ZINC000369529251 381281493 /nfs/dbraw/zinc/28/14/93/381281493.db2.gz DLDSDPDRHXRNBX-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)(C)[C@H](CCO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296308163 381341673 /nfs/dbraw/zinc/34/16/73/381341673.db2.gz DZAZQLAIIYEXMQ-OCCSQVGLSA-N 0 3 263.381 2.766 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(C)C ZINC000296349044 381356675 /nfs/dbraw/zinc/35/66/75/381356675.db2.gz IGABYDDDYJLIJR-WFASDCNBSA-N 0 3 278.396 2.546 20 10 CFCDHN COCC1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCC1 ZINC000296389785 381374662 /nfs/dbraw/zinc/37/46/62/381374662.db2.gz JTUBKVLHDVPLPF-CYBMUJFWSA-N 0 3 261.365 2.786 20 10 CFCDHN Cn1ccnc1C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000184730736 381472507 /nfs/dbraw/zinc/47/25/07/381472507.db2.gz SLFNJUBDQNEPAN-AWEZNQCLSA-N 0 3 285.391 2.580 20 10 CFCDHN Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000184730736 381472513 /nfs/dbraw/zinc/47/25/13/381472513.db2.gz SLFNJUBDQNEPAN-AWEZNQCLSA-N 0 3 285.391 2.580 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@]3(CCOC3)C2)c1[O-] ZINC000184700996 381462674 /nfs/dbraw/zinc/46/26/74/381462674.db2.gz BBYCEUFRCXIQHF-HNNXBMFYSA-N 0 3 297.782 2.667 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@]3(CCOC3)C2)c1[O-] ZINC000184700996 381462676 /nfs/dbraw/zinc/46/26/76/381462676.db2.gz BBYCEUFRCXIQHF-HNNXBMFYSA-N 0 3 297.782 2.667 20 10 CFCDHN CCOCC[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184723793 381469623 /nfs/dbraw/zinc/46/96/23/381469623.db2.gz OHCHEIILIDCWAC-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN CCOCC[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184723793 381469627 /nfs/dbraw/zinc/46/96/27/381469627.db2.gz OHCHEIILIDCWAC-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN C[C@@H](NCc1ccnn1C)c1cc2c(cc1O)CCCC2 ZINC000184996377 381507383 /nfs/dbraw/zinc/50/73/83/381507383.db2.gz PZCSLPJNRTZPBF-GFCCVEGCSA-N 0 3 285.391 2.855 20 10 CFCDHN C[C@H](NCc1ccnn1C)c1cc2c(cc1O)CCCC2 ZINC000184996358 381508045 /nfs/dbraw/zinc/50/80/45/381508045.db2.gz PZCSLPJNRTZPBF-LBPRGKRZSA-N 0 3 285.391 2.855 20 10 CFCDHN C[C@H]([NH2+]CCn1ccnc1)c1cc2c(cc1[O-])CCCC2 ZINC000184868674 381488849 /nfs/dbraw/zinc/48/88/49/381488849.db2.gz HGUUQVHFTRILKJ-ZDUSSCGKSA-N 0 3 285.391 2.818 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185122624 381541768 /nfs/dbraw/zinc/54/17/68/381541768.db2.gz JQWMTTACNIOXSO-GPNNCHTKSA-N 0 3 287.334 2.840 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1ccc(C)cc1[O-])C1CC1 ZINC000185308188 381593226 /nfs/dbraw/zinc/59/32/26/381593226.db2.gz XREQEXAVJAWPCR-ZDUSSCGKSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185316557 381595324 /nfs/dbraw/zinc/59/53/24/381595324.db2.gz IGISQLVQNSBZNA-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000185370865 381615426 /nfs/dbraw/zinc/61/54/26/381615426.db2.gz WMWFEDBGFNUVNH-WFASDCNBSA-N 0 3 289.350 2.786 20 10 CFCDHN CCN1CCCC[C@H]1C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185418121 381625948 /nfs/dbraw/zinc/62/59/48/381625948.db2.gz WBVPNPLAJXVVKD-KBPBESRZSA-N 0 3 292.423 2.926 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185483271 381647678 /nfs/dbraw/zinc/64/76/78/381647678.db2.gz PRMRVHNJUYCVGZ-PWSUYJOCSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@H]([NH2+]CC[S@](=O)C(C)(C)C)c1cc(F)ccc1[O-] ZINC000185475966 381643953 /nfs/dbraw/zinc/64/39/53/381643953.db2.gz FENRVFJTBQCQPB-OVWNDWIMSA-N 0 3 287.400 2.729 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)CC(C)(C)C)c1 ZINC000185482014 381646074 /nfs/dbraw/zinc/64/60/74/381646074.db2.gz XRTRTSLBXBZTOT-NWDGAFQWSA-N 0 3 281.396 2.849 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)c2ccsc2)c1 ZINC000185513145 381654952 /nfs/dbraw/zinc/65/49/52/381654952.db2.gz QCDBCZYDQOARPR-ZUZCIYMTSA-N 0 3 293.388 2.847 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000359908193 381672290 /nfs/dbraw/zinc/67/22/90/381672290.db2.gz XOGJHFCJMFNWQF-GFCCVEGCSA-N 0 3 287.338 2.701 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000359908193 381672299 /nfs/dbraw/zinc/67/22/99/381672299.db2.gz XOGJHFCJMFNWQF-GFCCVEGCSA-N 0 3 287.338 2.701 20 10 CFCDHN C[C@@H](CCO)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185500351 381651378 /nfs/dbraw/zinc/65/13/78/381651378.db2.gz RAWMOKCKSOXMCS-RYUDHWBXSA-N 0 3 263.381 2.693 20 10 CFCDHN COc1cccc(CN2CC[C@H](O)c3ccccc3C2)c1O ZINC000371876469 381716317 /nfs/dbraw/zinc/71/63/17/381716317.db2.gz MMNSMSZHDJDGRY-INIZCTEOSA-N 0 3 299.370 2.840 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c([O-])c1C ZINC000359963513 381700324 /nfs/dbraw/zinc/70/03/24/381700324.db2.gz ZRVGYSPWYAFYNE-JSGCOSHPSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CO[C@@H]2CCOC2)c1 ZINC000185673126 381701036 /nfs/dbraw/zinc/70/10/36/381701036.db2.gz DFLXCRARZAXSIW-MELADBBJSA-N 0 3 279.380 2.545 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1[O-] ZINC000360042751 381747808 /nfs/dbraw/zinc/74/78/08/381747808.db2.gz YELGLIWQKOEKRB-FVQBIDKESA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cccc(C(N)=O)c2)c([O-])c1 ZINC000185983717 381795657 /nfs/dbraw/zinc/79/56/57/381795657.db2.gz URCVYDRQPCUWIX-CYBMUJFWSA-N 0 3 298.386 2.693 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCNC(=O)C2CCC2)c([O-])c1 ZINC000186091967 381821088 /nfs/dbraw/zinc/82/10/88/381821088.db2.gz WFVPBCIBGSWYJG-CYBMUJFWSA-N 0 3 290.407 2.658 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000186143963 381834011 /nfs/dbraw/zinc/83/40/11/381834011.db2.gz JCKUZXRROMQVJR-CMPLNLGQSA-N 0 3 269.360 2.979 20 10 CFCDHN COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000186154259 381838153 /nfs/dbraw/zinc/83/81/53/381838153.db2.gz CZDHXJRDQBPGEA-NOZJJQNGSA-N 0 3 253.317 2.607 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCCCCO)c1 ZINC000186231157 381859394 /nfs/dbraw/zinc/85/93/94/381859394.db2.gz QELPVQPBBJTVRN-ZDUSSCGKSA-N 0 3 251.370 2.904 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCOCC1)c1cc(F)ccc1[O-] ZINC000186234997 381859717 /nfs/dbraw/zinc/85/97/17/381859717.db2.gz KWQZZLRLEASNJA-ZYHUDNBSSA-N 0 3 253.317 2.751 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000372969716 381898098 /nfs/dbraw/zinc/89/80/98/381898098.db2.gz ZAINERQZEFBMSJ-CYBMUJFWSA-N 0 3 282.815 2.962 20 10 CFCDHN CN(C)[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2[O-])CC1 ZINC000372969716 381898101 /nfs/dbraw/zinc/89/81/01/381898101.db2.gz ZAINERQZEFBMSJ-CYBMUJFWSA-N 0 3 282.815 2.962 20 10 CFCDHN CN(C)[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2[O-])CC1 ZINC000372969716 381898105 /nfs/dbraw/zinc/89/81/05/381898105.db2.gz ZAINERQZEFBMSJ-CYBMUJFWSA-N 0 3 282.815 2.962 20 10 CFCDHN Cc1cc(CN2CCCO[C@@H](C)C2)ccc1N(C)C ZINC000292962382 381925378 /nfs/dbraw/zinc/92/53/78/381925378.db2.gz CVPLZGLHJFVPPQ-AWEZNQCLSA-N 0 3 262.397 2.672 20 10 CFCDHN Cc1c([C@H]2CCC[N@@H+]2Cc2ccccc2[O-])cnn1C ZINC000373153564 381938223 /nfs/dbraw/zinc/93/82/23/381938223.db2.gz MKJQJIVALMRUOG-OAHLLOKOSA-N 0 3 271.364 2.771 20 10 CFCDHN Cc1c([C@H]2CCC[N@H+]2Cc2ccccc2[O-])cnn1C ZINC000373153564 381938226 /nfs/dbraw/zinc/93/82/26/381938226.db2.gz MKJQJIVALMRUOG-OAHLLOKOSA-N 0 3 271.364 2.771 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC[C@@H]2CCO)c1 ZINC000188009376 382324546 /nfs/dbraw/zinc/32/45/46/382324546.db2.gz DVGGBEWPGPXISH-ZOWXZIJZSA-N 0 3 279.380 2.603 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCOC[C@@H]1[C@@H]1CCCO1 ZINC000377703812 382325672 /nfs/dbraw/zinc/32/56/72/382325672.db2.gz RCDKORXJSAHZJG-INMHGKMJSA-N 0 3 291.391 2.723 20 10 CFCDHN CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccccc1[O-] ZINC000188036883 382330743 /nfs/dbraw/zinc/33/07/43/382330743.db2.gz RPHRQCVVOIWWAA-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN CC(C)C[C@]1(CO)CCC[N@H+]1Cc1ccccc1[O-] ZINC000188036883 382330747 /nfs/dbraw/zinc/33/07/47/382330747.db2.gz RPHRQCVVOIWWAA-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c([O-])c1C ZINC000377803359 382349350 /nfs/dbraw/zinc/34/93/50/382349350.db2.gz VKVUDCRXROGYPA-OLZOCXBDSA-N 0 3 285.391 2.940 20 10 CFCDHN Oc1ccccc1CN1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000294014637 382378341 /nfs/dbraw/zinc/37/83/41/382378341.db2.gz NCLUVZBNPXWKEU-HOTGVXAUSA-N 0 3 259.349 2.536 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000294028621 382385070 /nfs/dbraw/zinc/38/50/70/382385070.db2.gz NZEITIPESXFYJL-DLBZAZTESA-N 0 3 273.376 2.844 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cccc(C)c1[O-])OC ZINC000294141320 382432269 /nfs/dbraw/zinc/43/22/69/382432269.db2.gz GKSGZLPVLSHCFL-RISCZKNCSA-N 0 3 251.370 2.851 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@]2(O)CCC[C@@H]2C)c1[O-] ZINC000294149908 382434650 /nfs/dbraw/zinc/43/46/50/382434650.db2.gz VIHBOROLTPSREH-BONVTDFDSA-N 0 3 299.798 2.695 20 10 CFCDHN CN(C)c1ccc(CN2CCCOC(C)(C)C2)cc1F ZINC000378346006 382443071 /nfs/dbraw/zinc/44/30/71/382443071.db2.gz OSQYPYNUULBRKX-UHFFFAOYSA-N 0 3 280.387 2.893 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC(c3c[nH]cn3)CC2)c1 ZINC000378440150 382461543 /nfs/dbraw/zinc/46/15/43/382461543.db2.gz ZSVGJHSXKRGVDY-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H](OC)CC2)c1[O-] ZINC000378629872 382494291 /nfs/dbraw/zinc/49/42/91/382494291.db2.gz DXKKZYUIINLYMW-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H](OC)CC2)c1[O-] ZINC000378629872 382494296 /nfs/dbraw/zinc/49/42/96/382494296.db2.gz DXKKZYUIINLYMW-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1cnccc1CNCc1ccc(N(C)C)c(F)c1 ZINC000294932604 382544276 /nfs/dbraw/zinc/54/42/76/382544276.db2.gz DFXKWGXYCOFTFZ-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CO[C@H](C[NH2+]Cc1ccccc1[O-])Cc1ccccc1 ZINC000294821320 382531128 /nfs/dbraw/zinc/53/11/28/382531128.db2.gz OWRISQKXZVIRDV-INIZCTEOSA-N 0 3 271.360 2.740 20 10 CFCDHN C[N@H+](CCOCC(F)(F)C(F)F)Cc1ccccc1[O-] ZINC000189663292 382633640 /nfs/dbraw/zinc/63/36/40/382633640.db2.gz GZVKKXLJOZMNNA-UHFFFAOYSA-N 0 3 295.276 2.741 20 10 CFCDHN C[N@@H+](CCOCC(F)(F)C(F)F)Cc1ccccc1[O-] ZINC000189663292 382633642 /nfs/dbraw/zinc/63/36/42/382633642.db2.gz GZVKKXLJOZMNNA-UHFFFAOYSA-N 0 3 295.276 2.741 20 10 CFCDHN C[C@](O)(CC[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000190276237 382660352 /nfs/dbraw/zinc/66/03/52/382660352.db2.gz INFNFQRNMOQQIK-KRWDZBQOSA-N 0 3 289.350 2.919 20 10 CFCDHN COc1cccc(C[N@@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190846011 382682288 /nfs/dbraw/zinc/68/22/88/382682288.db2.gz AOKIAEDSTLOJJH-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN COc1cccc(C[N@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190846011 382682289 /nfs/dbraw/zinc/68/22/89/382682289.db2.gz AOKIAEDSTLOJJH-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN Cc1cccc(C[N@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190840453 382682314 /nfs/dbraw/zinc/68/23/14/382682314.db2.gz QAUDPGWTJBQBAH-LLVKDONJSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190840453 382682315 /nfs/dbraw/zinc/68/23/15/382682315.db2.gz QAUDPGWTJBQBAH-LLVKDONJSA-N 0 3 251.395 2.886 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCSC[C@H](C)C2)c1 ZINC000190850072 382682532 /nfs/dbraw/zinc/68/25/32/382682532.db2.gz JUYJBYXXYNKTGM-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCSC[C@H](C)C2)c1 ZINC000190850072 382682533 /nfs/dbraw/zinc/68/25/33/382682533.db2.gz JUYJBYXXYNKTGM-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c1[O-] ZINC000249205988 383334064 /nfs/dbraw/zinc/33/40/64/383334064.db2.gz RVPCKYHLKVRDFC-XQQFMLRXSA-N 0 3 297.782 2.711 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H]2OCCC[C@H]12)c1cc(F)ccc1[O-] ZINC000251848015 383396965 /nfs/dbraw/zinc/39/69/65/383396965.db2.gz NGRDPKOUTBNGJO-XKFJNSEWSA-N 0 3 265.328 2.749 20 10 CFCDHN Cc1cccc(CNc2ccc3c(c2)OCCNC3)c1O ZINC000530182585 383767810 /nfs/dbraw/zinc/76/78/10/383767810.db2.gz VTQHZXSMARILTI-UHFFFAOYSA-N 0 3 284.359 2.795 20 10 CFCDHN Cc1cc(O)c(CN[C@H](CO)c2ccc(F)cc2)cc1C ZINC000266124439 384085306 /nfs/dbraw/zinc/08/53/06/384085306.db2.gz BEWHHDKDPHIIAH-MRXNPFEDSA-N 0 3 289.350 2.971 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1CCN(c2nccs2)CC1 ZINC000269291987 384743312 /nfs/dbraw/zinc/74/33/12/384743312.db2.gz LPDUZUAVMRJXCL-UHFFFAOYSA-N 0 3 289.404 2.607 20 10 CFCDHN CCOCc1cc(CN[C@@]2(C)CCOC2)ccc1OC ZINC000270188605 385008307 /nfs/dbraw/zinc/00/83/07/385008307.db2.gz XTTAWOADCNSYRQ-INIZCTEOSA-N 0 3 279.380 2.500 20 10 CFCDHN CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)CCCO1 ZINC000281162606 385184464 /nfs/dbraw/zinc/18/44/64/385184464.db2.gz GGYRMYKQEXJRQM-MRXNPFEDSA-N 0 3 262.397 2.754 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(N(C)C)cc2)CCCO1 ZINC000281162603 385185110 /nfs/dbraw/zinc/18/51/10/385185110.db2.gz GGYRMYKQEXJRQM-INIZCTEOSA-N 0 3 262.397 2.754 20 10 CFCDHN C[N@H+](CCCN1CCCC1)Cc1cccc(Cl)c1[O-] ZINC000281337956 385190109 /nfs/dbraw/zinc/19/01/09/385190109.db2.gz SLIDPZZCQLUCGF-UHFFFAOYSA-N 0 3 282.815 2.963 20 10 CFCDHN C[N@@H+](CCCN1CCCC1)Cc1cccc(Cl)c1[O-] ZINC000281337956 385190111 /nfs/dbraw/zinc/19/01/11/385190111.db2.gz SLIDPZZCQLUCGF-UHFFFAOYSA-N 0 3 282.815 2.963 20 10 CFCDHN CN(CCC[NH+]1CCCC1)Cc1cccc(Cl)c1[O-] ZINC000281337956 385190115 /nfs/dbraw/zinc/19/01/15/385190115.db2.gz SLIDPZZCQLUCGF-UHFFFAOYSA-N 0 3 282.815 2.963 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2([S@@](C)=O)CC2)c([O-])c1C ZINC000282241829 385257608 /nfs/dbraw/zinc/25/76/08/385257608.db2.gz JBLBFCLSWIYBPS-HXPMCKFVSA-N 0 3 281.421 2.571 20 10 CFCDHN CCCC[N@H+](CCC(=O)NC(C)C)Cc1ccccc1[O-] ZINC000282405364 385302676 /nfs/dbraw/zinc/30/26/76/385302676.db2.gz IENHUDQWNRXLLJ-UHFFFAOYSA-N 0 3 292.423 2.909 20 10 CFCDHN CCCC[N@@H+](CCC(=O)NC(C)C)Cc1ccccc1[O-] ZINC000282405364 385302683 /nfs/dbraw/zinc/30/26/83/385302683.db2.gz IENHUDQWNRXLLJ-UHFFFAOYSA-N 0 3 292.423 2.909 20 10 CFCDHN CNC(=O)CC[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000271154237 385353553 /nfs/dbraw/zinc/35/35/53/385353553.db2.gz MOEFVPBLSXXDCJ-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CNC(=O)CC[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000271154237 385353559 /nfs/dbraw/zinc/35/35/59/385353559.db2.gz MOEFVPBLSXXDCJ-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1[O-] ZINC000271728849 385390126 /nfs/dbraw/zinc/39/01/26/385390126.db2.gz MPAQTJFHUCISJQ-CQSZACIVSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1[O-] ZINC000271728849 385390127 /nfs/dbraw/zinc/39/01/27/385390127.db2.gz MPAQTJFHUCISJQ-CQSZACIVSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC[C@H](C)O)c1[O-] ZINC000271780209 385391074 /nfs/dbraw/zinc/39/10/74/385391074.db2.gz HNOPOMOWZOLUTB-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC[C@H](C)O)c1[O-] ZINC000271780209 385391079 /nfs/dbraw/zinc/39/10/79/385391079.db2.gz HNOPOMOWZOLUTB-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)c1[O-] ZINC000271772633 385391526 /nfs/dbraw/zinc/39/15/26/385391526.db2.gz GKODBXYOGIPOCY-CYBMUJFWSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@H](CO)C(C)(C)C)c1[O-] ZINC000271772633 385391529 /nfs/dbraw/zinc/39/15/29/385391529.db2.gz GKODBXYOGIPOCY-CYBMUJFWSA-N 0 3 251.370 2.539 20 10 CFCDHN CC[N@H+](CCCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000271783798 385392110 /nfs/dbraw/zinc/39/21/10/385392110.db2.gz HYRDHTBVZOBVEL-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN CC[N@@H+](CCCO)Cc1cc(Cl)cc(C)c1[O-] ZINC000271783798 385392111 /nfs/dbraw/zinc/39/21/11/385392111.db2.gz HYRDHTBVZOBVEL-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@H]2CCC[C@@H]2O)c1[O-] ZINC000271797300 385392196 /nfs/dbraw/zinc/39/21/96/385392196.db2.gz KGBHKOKGDLPXRP-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c1[O-] ZINC000271797300 385392199 /nfs/dbraw/zinc/39/21/99/385392199.db2.gz KGBHKOKGDLPXRP-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1cc(OC)ccc1[O-] ZINC000271823063 385394043 /nfs/dbraw/zinc/39/40/43/385394043.db2.gz NGTCQLXAPKYECS-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN CSC[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000271829577 385394239 /nfs/dbraw/zinc/39/42/39/385394239.db2.gz OOYDCZXOQPZRQV-ZDUSSCGKSA-N 0 3 289.828 2.558 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCc3ccccc3[C@H]2CO)c1[O-] ZINC000271874499 385394896 /nfs/dbraw/zinc/39/48/96/385394896.db2.gz STMARLWHEFVCFT-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1cccc(C[N@H+]2CCc3ccccc3[C@H]2CO)c1[O-] ZINC000271874499 385394899 /nfs/dbraw/zinc/39/48/99/385394899.db2.gz STMARLWHEFVCFT-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1cccc(CN2CCc3ccccc3[C@H]2CO)c1O ZINC000271874499 385394901 /nfs/dbraw/zinc/39/49/01/385394901.db2.gz STMARLWHEFVCFT-QGZVFWFLSA-N 0 3 283.371 2.792 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CSC2(C)C)cc1 ZINC000282823510 385395131 /nfs/dbraw/zinc/39/51/31/385395131.db2.gz NKTHACPHIRNYQG-ZDUSSCGKSA-N 0 3 250.411 2.736 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2CCCSC2)c1 ZINC000271869533 385395445 /nfs/dbraw/zinc/39/54/45/385395445.db2.gz XIYKEJMQJXKPLQ-GFCCVEGCSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2CCCc3nn(C)cc32)c1 ZINC000282915604 385410332 /nfs/dbraw/zinc/41/03/32/385410332.db2.gz GVQFLSFRLCKWJS-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCCc3nn(C)cc32)c1 ZINC000282915604 385410336 /nfs/dbraw/zinc/41/03/36/385410336.db2.gz GVQFLSFRLCKWJS-AWEZNQCLSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)CCO)c([O-])c1 ZINC000283693777 385489777 /nfs/dbraw/zinc/48/97/77/385489777.db2.gz ANKANFZMCWUAME-MFKMUULPSA-N 0 3 251.370 2.678 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c1 ZINC000284128875 385538760 /nfs/dbraw/zinc/53/87/60/385538760.db2.gz CUIIYILSWRCCRB-XEZPLFJOSA-N 0 3 295.423 2.509 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C2CCN(C)CC2)c([O-])c1 ZINC000284180473 385545324 /nfs/dbraw/zinc/54/53/24/385545324.db2.gz QZONVOFYOIIPSF-CYBMUJFWSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)N(C)C)c([O-])c1 ZINC000283967226 385519351 /nfs/dbraw/zinc/51/93/51/385519351.db2.gz GJACGNXKHXSGPZ-CHWSQXEVSA-N 0 3 250.386 2.610 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c([O-])c1 ZINC000285008368 385551682 /nfs/dbraw/zinc/55/16/82/385551682.db2.gz HBLVWTCXJQWMSG-NQCMUKECSA-N 0 3 283.437 2.817 20 10 CFCDHN COC(=O)[C@]12C[N@H+](Cc3ccccc3[O-])C[C@H]1CCCC2 ZINC000285221638 385553073 /nfs/dbraw/zinc/55/30/73/385553073.db2.gz RTRJUPGCLLXQCP-RHSMWYFYSA-N 0 3 289.375 2.557 20 10 CFCDHN COC(=O)[C@]12C[N@@H+](Cc3ccccc3[O-])C[C@H]1CCCC2 ZINC000285221638 385553077 /nfs/dbraw/zinc/55/30/77/385553077.db2.gz RTRJUPGCLLXQCP-RHSMWYFYSA-N 0 3 289.375 2.557 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC3(CCOCC3)CC2)c1 ZINC000285303843 385554201 /nfs/dbraw/zinc/55/42/01/385554201.db2.gz VZTTWMGVSAXBHZ-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285336357 385554611 /nfs/dbraw/zinc/55/46/11/385554611.db2.gz UOAAORYMAOBZMG-KBPBESRZSA-N 0 3 290.407 2.671 20 10 CFCDHN CCOc1cccc(C[NH2+]C2(CCO)CCCC2)c1[O-] ZINC000285488951 385556285 /nfs/dbraw/zinc/55/62/85/385556285.db2.gz LYXQHLKNKYVEQP-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COc1ccc(N2CCN(CCCCF)CC2)cc1F ZINC000286464534 385628177 /nfs/dbraw/zinc/62/81/77/385628177.db2.gz OVSKSOZJHTZSDD-UHFFFAOYSA-N 0 3 284.350 2.706 20 10 CFCDHN C[C@H]([NH2+]CCOc1ncccc1F)c1ccccc1[O-] ZINC000272881212 385640920 /nfs/dbraw/zinc/64/09/20/385640920.db2.gz QNEHIPQKNXQCMG-NSHDSACASA-N 0 3 276.311 2.656 20 10 CFCDHN C[C@]1([NH2+]Cc2cc(F)ccc2[O-])CCO[C@H]1C1CC1 ZINC000273241075 385675299 /nfs/dbraw/zinc/67/52/99/385675299.db2.gz YTARCRYOKVVFKE-GJZGRUSLSA-N 0 3 265.328 2.579 20 10 CFCDHN Cc1ccc([C@H](C)NC[C@@H](O)C(F)(F)F)c(O)c1C ZINC000273306103 385677346 /nfs/dbraw/zinc/67/73/46/385677346.db2.gz CWMKCMMHPHBHAC-GXSJLCMTSA-N 0 3 277.286 2.583 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCn2ccnc2)c([O-])c1C ZINC000273392049 385680833 /nfs/dbraw/zinc/68/08/33/385680833.db2.gz LBRLWVPFHAWTSX-CYBMUJFWSA-N 0 3 259.353 2.556 20 10 CFCDHN Cc1ccc([C@@H](C)NCc2cnn(C)c2)c(O)c1C ZINC000273423129 385683113 /nfs/dbraw/zinc/68/31/13/385683113.db2.gz SOGZTTHOMWHVDM-GFCCVEGCSA-N 0 3 259.353 2.593 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cc(F)ccc1[O-] ZINC000273516876 385685930 /nfs/dbraw/zinc/68/59/30/385685930.db2.gz SSPRPEOJOUEVKK-AAEUAGOBSA-N 0 3 295.354 2.868 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000273540945 385687968 /nfs/dbraw/zinc/68/79/68/385687968.db2.gz YICZVWPQUQSROK-FOGDFJRCSA-N 0 3 253.317 2.749 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000273548973 385688322 /nfs/dbraw/zinc/68/83/22/385688322.db2.gz FNPNKORZTVKXIS-MKBNYLNASA-N 0 3 290.407 2.534 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)cc2[O-])o1 ZINC000273589312 385689869 /nfs/dbraw/zinc/68/98/69/385689869.db2.gz OSBDRTPIGQZTTG-SWLSCSKDSA-N 0 3 275.348 2.986 20 10 CFCDHN CC[C@@](C)(O)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273584305 385690109 /nfs/dbraw/zinc/69/01/09/385690109.db2.gz NISFJJDQZAGSQY-IUODEOHRSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cc(C)ccc2[O-])o1 ZINC000273612088 385691447 /nfs/dbraw/zinc/69/14/47/385691447.db2.gz WFIUXZBNHPXIKH-WFASDCNBSA-N 0 3 275.348 2.986 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1[O-] ZINC000273047715 385670365 /nfs/dbraw/zinc/67/03/65/385670365.db2.gz JTVITDZCSLTZAQ-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN OCC[C@H](N[C@@H]1CCc2cccc(O)c21)c1ccco1 ZINC000296465607 285265557 /nfs/dbraw/zinc/26/55/57/285265557.db2.gz OBDWRWOIBLNWAD-QWHCGFSZSA-N 0 3 273.332 2.686 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000179562272 285398376 /nfs/dbraw/zinc/39/83/76/285398376.db2.gz XZTFKFCDAOCKPK-MRXNPFEDSA-N 0 3 274.408 2.843 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000179562272 285398379 /nfs/dbraw/zinc/39/83/79/285398379.db2.gz XZTFKFCDAOCKPK-MRXNPFEDSA-N 0 3 274.408 2.843 20 10 CFCDHN Oc1ccccc1CN(Cc1ccncc1)C[C@H]1CCCO1 ZINC000123508146 285398508 /nfs/dbraw/zinc/39/85/08/285398508.db2.gz IQHWHXLNVMKXDZ-QGZVFWFLSA-N 0 3 298.386 2.968 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000368593089 285398619 /nfs/dbraw/zinc/39/86/19/285398619.db2.gz SAZWAXHEEKFEED-CQSZACIVSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000368593089 285398621 /nfs/dbraw/zinc/39/86/21/285398621.db2.gz SAZWAXHEEKFEED-CQSZACIVSA-N 0 3 261.365 2.641 20 10 CFCDHN CC(C)(C)C[C@@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297532005 393446490 /nfs/dbraw/zinc/44/64/90/393446490.db2.gz DPVVWFVJSBMELU-CHWSQXEVSA-N 0 3 263.381 2.766 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+]Cc2ccc(OC)cc2[O-])C12CCC2 ZINC000372635865 393454337 /nfs/dbraw/zinc/45/43/37/393454337.db2.gz NVWDAOZXXPBVIX-HOTGVXAUSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccccc2[O-])C[C@@]2(CCO[C@H](C)C2)O1 ZINC000373978971 393477569 /nfs/dbraw/zinc/47/75/69/393477569.db2.gz UMMWPFKDDZHSIW-CPUCHLNUSA-N 0 3 291.391 2.551 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccccc2[O-])C[C@@]2(CCO[C@H](C)C2)O1 ZINC000373978971 393477573 /nfs/dbraw/zinc/47/75/73/393477573.db2.gz UMMWPFKDDZHSIW-CPUCHLNUSA-N 0 3 291.391 2.551 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@]1(CO)CCCc2ccccc21 ZINC000374134316 393485217 /nfs/dbraw/zinc/48/52/17/393485217.db2.gz AQPZUXNHVCYYEE-SFHVURJKSA-N 0 3 283.371 2.706 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000374253854 393489653 /nfs/dbraw/zinc/48/96/53/393489653.db2.gz KKRVVMKWOGHIQM-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000374253854 393489657 /nfs/dbraw/zinc/48/96/57/393489657.db2.gz KKRVVMKWOGHIQM-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](C3(C)OCCO3)C2)c1 ZINC000183245034 393518941 /nfs/dbraw/zinc/51/89/41/393518941.db2.gz XCVQUJDTCPDZPC-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c1 ZINC000183245034 393518947 /nfs/dbraw/zinc/51/89/47/393518947.db2.gz XCVQUJDTCPDZPC-HNNXBMFYSA-N 0 3 291.391 2.676 20 10 CFCDHN CN(C)CCN(C(=O)/C=C\c1ccn(C)c1)c1ccccc1 ZINC000493093632 394146531 /nfs/dbraw/zinc/14/65/31/394146531.db2.gz ZSFPJCDHKMBQAM-KTKRTIGZSA-N 0 3 297.402 2.633 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCCC[C@H](CO)C2)c1 ZINC000366813037 394247752 /nfs/dbraw/zinc/24/77/52/394247752.db2.gz VVCGVJLANCMFFN-STQMWFEESA-N 0 3 279.380 2.556 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCCC[C@H](CO)C2)c1 ZINC000366813037 394247757 /nfs/dbraw/zinc/24/77/57/394247757.db2.gz VVCGVJLANCMFFN-STQMWFEESA-N 0 3 279.380 2.556 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](O)c2ccccc2)c1[O-] ZINC000035601311 172289984 /nfs/dbraw/zinc/28/99/84/172289984.db2.gz UCYHINXBNQZISQ-HNNXBMFYSA-N 0 3 287.359 2.614 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1[O-] ZINC000037643961 173590453 /nfs/dbraw/zinc/59/04/53/173590453.db2.gz WIOIGWIIPLFCEA-HIFRSBDPSA-N 0 3 262.397 2.775 20 10 CFCDHN CCN1CCC([NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1 ZINC000038097999 174111836 /nfs/dbraw/zinc/11/18/36/174111836.db2.gz YQADXACJZKINMF-ZDUSSCGKSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cnn1C ZINC000037167841 260073064 /nfs/dbraw/zinc/07/30/64/260073064.db2.gz QACMEJCNNVVLTJ-WDEREUQCSA-N 0 3 259.353 2.846 20 10 CFCDHN COc1cccc(C[NH2+][C@](C)(CO)C2CCCCC2)c1[O-] ZINC000152764562 261069305 /nfs/dbraw/zinc/06/93/05/261069305.db2.gz MPSRTMXOYBYUFT-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@]3(C2)CCCOC3)cc1F ZINC000367436839 262020544 /nfs/dbraw/zinc/02/05/44/262020544.db2.gz HIXGCLLHTUZGAY-KRWDZBQOSA-N 0 3 292.398 2.894 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCN(c2ccncn2)C1)c1ccccc1[O-] ZINC000367829694 267120584 /nfs/dbraw/zinc/12/05/84/267120584.db2.gz BWUZADREADQHBA-KBPBESRZSA-N 0 3 298.390 2.502 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@](O)(C2CC2)C1 ZINC000368035888 267139502 /nfs/dbraw/zinc/13/95/02/267139502.db2.gz HEOGJLIIEAJLIT-ZBFHGGJFSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@](O)(C2CC2)C1 ZINC000368035888 267139503 /nfs/dbraw/zinc/13/95/03/267139503.db2.gz HEOGJLIIEAJLIT-ZBFHGGJFSA-N 0 3 261.365 2.690 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@@](=O)C[C@H](C)C1 ZINC000368038968 267139805 /nfs/dbraw/zinc/13/98/05/267139805.db2.gz QFIOOAYFRYWXNC-BBEGDGIKSA-N 0 3 281.421 2.544 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(-n2ccnc2)nc1)c1ccccc1[O-] ZINC000370052872 267287037 /nfs/dbraw/zinc/28/70/37/267287037.db2.gz KKOVGFOMIAMGHD-ZDUSSCGKSA-N 0 3 294.358 2.824 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCO[C@@H]2C2CC2)cc1F ZINC000371206324 267369900 /nfs/dbraw/zinc/36/99/00/267369900.db2.gz FTMYNHGYNAPRBM-GOEBONIOSA-N 0 3 278.371 2.549 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCc2c[nH]nc2C1)c1ccccc1[O-] ZINC000372346520 267554164 /nfs/dbraw/zinc/55/41/64/267554164.db2.gz KLTVYIDPBMGJCK-TZMCWYRMSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2c[nH]nc2C1)c1ccccc1[O-] ZINC000372346518 267554319 /nfs/dbraw/zinc/55/43/19/267554319.db2.gz KLTVYIDPBMGJCK-OCCSQVGLSA-N 0 3 271.364 2.714 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000020091998 276174514 /nfs/dbraw/zinc/17/45/14/276174514.db2.gz IKZGMFLHAAAXCA-UONOGXRCSA-N 0 3 262.397 2.836 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C(C)(C)COC)c1 ZINC000292802064 276375197 /nfs/dbraw/zinc/37/51/97/276375197.db2.gz NRHBSFPWZKRLBD-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C(C)(C)COC)c1 ZINC000292802064 276375199 /nfs/dbraw/zinc/37/51/99/276375199.db2.gz NRHBSFPWZKRLBD-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)C2CCCC2)c([O-])c1 ZINC000290203135 278855061 /nfs/dbraw/zinc/85/50/61/278855061.db2.gz PHOBFRDVEGMQIQ-SWLSCSKDSA-N 0 3 263.381 2.902 20 10 CFCDHN CC(C)C[C@@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094617833 278993925 /nfs/dbraw/zinc/99/39/25/278993925.db2.gz FDWGJIBHCIXGNC-PWSUYJOCSA-N 0 3 255.333 2.589 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000377619039 280218911 /nfs/dbraw/zinc/21/89/11/280218911.db2.gz DFASUKQXYLZQSE-LSDHHAIUSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOC[C@@H]1C1CC1 ZINC000377619039 280218914 /nfs/dbraw/zinc/21/89/14/280218914.db2.gz DFASUKQXYLZQSE-LSDHHAIUSA-N 0 3 261.365 2.954 20 10 CFCDHN Cc1cccc(C[N@H+]2CCN(C3CC3)C[C@H](C)C2)c1[O-] ZINC000295956797 281216174 /nfs/dbraw/zinc/21/61/74/281216174.db2.gz HOTJXWIMTCQYJG-CYBMUJFWSA-N 0 3 274.408 2.617 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCN(C3CC3)C[C@H](C)C2)c1[O-] ZINC000295956797 281216175 /nfs/dbraw/zinc/21/61/75/281216175.db2.gz HOTJXWIMTCQYJG-CYBMUJFWSA-N 0 3 274.408 2.617 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@@H]3C13CCC3)CC2 ZINC000297129136 304846009 /nfs/dbraw/zinc/84/60/09/304846009.db2.gz YWTYHYYBRUYLOC-IXKJSCDLSA-N 0 3 285.387 2.927 20 10 CFCDHN CC(C)(C)C[C@@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296242279 327091614 /nfs/dbraw/zinc/09/16/14/327091614.db2.gz AWJCHCKHGJKRAV-STQMWFEESA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@]1(C[NH2+]Cc2ccccc2[O-])COc2ccccc2O1 ZINC000527735543 330278776 /nfs/dbraw/zinc/27/87/76/330278776.db2.gz OCAMFFXTKAERMJ-KRWDZBQOSA-N 0 3 285.343 2.712 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC[C@H]2CCCOC2)cc1C ZINC000527741342 330282715 /nfs/dbraw/zinc/28/27/15/330282715.db2.gz ZONJYQVSEZVFMJ-CQSZACIVSA-N 0 3 263.381 2.915 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc1C ZINC000527804648 330284364 /nfs/dbraw/zinc/28/43/64/330284364.db2.gz RCNZKYPPEIOKMG-DVZHBHJUSA-N 0 3 263.381 2.911 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1 ZINC000527999155 330299743 /nfs/dbraw/zinc/29/97/43/330299743.db2.gz CODZEDMNLXMIOD-RPHNGCRZSA-N 0 3 279.380 2.863 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1cc(F)ccc1[O-] ZINC000528004648 330300377 /nfs/dbraw/zinc/30/03/77/330300377.db2.gz RGKOULNDKLYDHC-QSJCVTFJSA-N 0 3 267.344 2.994 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000289509762 518855665 /nfs/dbraw/zinc/85/56/65/518855665.db2.gz UPLJVVUGKWUFDG-AWEZNQCLSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000289509762 518855671 /nfs/dbraw/zinc/85/56/71/518855671.db2.gz UPLJVVUGKWUFDG-AWEZNQCLSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)OCCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094616988 519764509 /nfs/dbraw/zinc/76/45/09/519764509.db2.gz UQDREFOIDSRABP-LLVKDONJSA-N 0 3 255.333 2.997 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@]2(CC)CO)c([O-])c1 ZINC000191956911 520349691 /nfs/dbraw/zinc/34/96/91/520349691.db2.gz UMIHCXNRBRCGFX-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@]2(CC)CO)c([O-])c1 ZINC000191956911 520349699 /nfs/dbraw/zinc/34/96/99/520349699.db2.gz UMIHCXNRBRCGFX-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CC1(C)C[N@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000310943171 520474969 /nfs/dbraw/zinc/47/49/69/520474969.db2.gz KETXPAGDMFINJK-UHFFFAOYSA-N 0 3 253.317 2.532 20 10 CFCDHN CC1(C)C[N@@H+](Cc2cc(F)ccc2[O-])CCCO1 ZINC000310943171 520474981 /nfs/dbraw/zinc/47/49/81/520474981.db2.gz KETXPAGDMFINJK-UHFFFAOYSA-N 0 3 253.317 2.532 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H](CC)c1ccccc1[O-] ZINC000293613781 520610624 /nfs/dbraw/zinc/61/06/24/520610624.db2.gz FHKFETNYUKHZLM-UKRRQHHQSA-N 0 3 292.423 2.985 20 10 CFCDHN CCC[C@@H](O)C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000294952613 520797108 /nfs/dbraw/zinc/79/71/08/520797108.db2.gz MQDIOLLCHQPYII-HZPDHXFCSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@@H](O)C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000294952613 520797109 /nfs/dbraw/zinc/79/71/09/520797109.db2.gz MQDIOLLCHQPYII-HZPDHXFCSA-N 0 3 293.407 2.534 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000283831215 520805545 /nfs/dbraw/zinc/80/55/45/520805545.db2.gz APHDVMRPPLNQEZ-CHWSQXEVSA-N 0 3 251.370 2.821 20 10 CFCDHN CCN(CC)c1ccc(CNCc2c(C)cnn2C)cc1 ZINC000285393510 520908334 /nfs/dbraw/zinc/90/83/34/520908334.db2.gz HQVSIKFJUFUPQY-UHFFFAOYSA-N 0 3 286.423 2.865 20 10 CFCDHN CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 ZINC000276280977 521040715 /nfs/dbraw/zinc/04/07/15/521040715.db2.gz FGWBGNJYDDTFPG-QWHCGFSZSA-N 0 3 279.380 2.681 20 10 CFCDHN CC[N@@H+](Cc1cc(C)c(C)cc1[O-])C[C@H](C)OC ZINC000291070798 521286997 /nfs/dbraw/zinc/28/69/97/521286997.db2.gz ITEGLDSHOGTOAM-ZDUSSCGKSA-N 0 3 251.370 2.866 20 10 CFCDHN CC[N@H+](Cc1cc(C)c(C)cc1[O-])C[C@H](C)OC ZINC000291070798 521287006 /nfs/dbraw/zinc/28/70/06/521287006.db2.gz ITEGLDSHOGTOAM-ZDUSSCGKSA-N 0 3 251.370 2.866 20 10 CFCDHN CCOc1cccc(C[N@H+](C(C)C)[C@H]2CCOC2)c1[O-] ZINC000291184182 521330900 /nfs/dbraw/zinc/33/09/00/521330900.db2.gz FXBFCYAJCHDGCB-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@@H+](C(C)C)[C@H]2CCOC2)c1[O-] ZINC000291184182 521330908 /nfs/dbraw/zinc/33/09/08/521330908.db2.gz FXBFCYAJCHDGCB-AWEZNQCLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[NH2+]CC[C@H]2CCCCO2)c1[O-] ZINC000227340272 521364502 /nfs/dbraw/zinc/36/45/02/521364502.db2.gz WACIAEWUWYXJKR-CQSZACIVSA-N 0 3 279.380 2.840 20 10 CFCDHN CCOC1(C)CC[NH+](Cc2cc(OC)ccc2[O-])CC1 ZINC000292887255 521635215 /nfs/dbraw/zinc/63/52/15/521635215.db2.gz YLQCKJSDCVFZGS-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCNC(=O)[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263720511 521745425 /nfs/dbraw/zinc/74/54/25/521745425.db2.gz WIZGSRNGTXUXHJ-ZDUSSCGKSA-N 0 3 298.386 2.673 20 10 CFCDHN CC[C@@H](CCO)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228676299 522507759 /nfs/dbraw/zinc/50/77/59/522507759.db2.gz YUYZLQHOAIQJDW-JTQLQIEISA-N 0 3 287.787 2.552 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC(OC)CC2)c1O ZINC000228585559 522535578 /nfs/dbraw/zinc/53/55/78/522535578.db2.gz UYMKMSCXSJPZPJ-UHFFFAOYSA-N 0 3 285.771 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](CO)CC(C)C)c1[O-] ZINC000228672131 522541808 /nfs/dbraw/zinc/54/18/08/522541808.db2.gz UEYDYVPEAHZCDA-LBPRGKRZSA-N 0 3 287.787 2.551 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)N(C)C1CC1)c1ccccc1[O-] ZINC000155698860 522628186 /nfs/dbraw/zinc/62/81/86/522628186.db2.gz GYGVLCZFOZRRNL-WFASDCNBSA-N 0 3 262.397 2.916 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000279007705 522636231 /nfs/dbraw/zinc/63/62/31/522636231.db2.gz SMPBJELHQIAFFD-HIFRSBDPSA-N 0 3 285.391 2.892 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)CCC2CC2)cc1OC ZINC000160459886 522768326 /nfs/dbraw/zinc/76/83/26/522768326.db2.gz IVVWJCGVWXTZHB-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)CCC2CC2)cc1OC ZINC000160459886 522768333 /nfs/dbraw/zinc/76/83/33/522768333.db2.gz IVVWJCGVWXTZHB-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CC2(SC)CCC2)cc1OC ZINC000193364280 522776945 /nfs/dbraw/zinc/77/69/45/522776945.db2.gz URQSTERHTNDQMG-UHFFFAOYSA-N 0 3 297.420 2.785 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2C[C@H]3CCCC[C@H]32)cc1OC ZINC000367974900 522777466 /nfs/dbraw/zinc/77/74/66/522777466.db2.gz UYDZXUHAWIUILQ-DGCLKSJQSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2C[C@H]3CCCC[C@H]32)cc1OC ZINC000367974900 522777485 /nfs/dbraw/zinc/77/74/85/522777485.db2.gz UYDZXUHAWIUILQ-DGCLKSJQSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc(O)c(CN2C[C@H]3CCCC[C@H]32)cc1OC ZINC000367974900 522777494 /nfs/dbraw/zinc/77/74/94/522777494.db2.gz UYDZXUHAWIUILQ-DGCLKSJQSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc(O)c(CN2CCc3ccccc3C2)cc1OC ZINC000158822300 522777828 /nfs/dbraw/zinc/77/78/28/522777828.db2.gz HZTXAVBIVSLEOJ-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN CC[C@H](O)CNCc1ccc(N(C)C)cc1C(F)(F)F ZINC000291709241 522820121 /nfs/dbraw/zinc/82/01/21/522820121.db2.gz LCDABLFMEBFSPX-LBPRGKRZSA-N 0 3 290.329 2.632 20 10 CFCDHN CC[C@@H]([NH2+]CC1([S@@](C)=O)CCC1)c1ccccc1[O-] ZINC000280959982 522821963 /nfs/dbraw/zinc/82/19/63/522821963.db2.gz HOCLGIWFYKJNAV-BFUOFWGJSA-N 0 3 281.421 2.734 20 10 CFCDHN CC[C@@H]([NH2+]CCC(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000280299575 522824194 /nfs/dbraw/zinc/82/41/94/522824194.db2.gz ZTQXWLVGTOODNB-CQSZACIVSA-N 0 3 278.396 2.656 20 10 CFCDHN CC[C@@H]([NH2+]CCCO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279981388 522831438 /nfs/dbraw/zinc/83/14/38/522831438.db2.gz DQNYRTXHRHOJOU-GOEBONIOSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H](O)CC)c1ccc(C)cc1[O-] ZINC000280022386 522839370 /nfs/dbraw/zinc/83/93/70/522839370.db2.gz HNVVNDFVFFASLM-GXTWGEPZSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1ccccc1[O-] ZINC000155698748 522847878 /nfs/dbraw/zinc/84/78/78/522847878.db2.gz GYGVLCZFOZRRNL-IUODEOHRSA-N 0 3 262.397 2.916 20 10 CFCDHN CC[C@@H]([NH2+]C[C@](C)(O)CC)c1ccc(C)cc1[O-] ZINC000280124054 522867800 /nfs/dbraw/zinc/86/78/00/522867800.db2.gz OMUKKBGDEBBYRM-UKRRQHHQSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]Cc1c[nH]nc1C)c1ccc(C)cc1[O-] ZINC000280050410 522870367 /nfs/dbraw/zinc/87/03/67/522870367.db2.gz JOXKXKGMPJUANP-CQSZACIVSA-N 0 3 259.353 2.973 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(C(C)C)C1=O)c1ccc(C)cc1[O-] ZINC000279942921 522948138 /nfs/dbraw/zinc/94/81/38/522948138.db2.gz BHYSFHJDTOLABD-CABCVRRESA-N 0 3 290.407 2.751 20 10 CFCDHN C[N@H+](CCc1cccs1)Cc1cc2c(cc1[O-])OCO2 ZINC000173404125 522971841 /nfs/dbraw/zinc/97/18/41/522971841.db2.gz FNRIFWKCOVSQSX-UHFFFAOYSA-N 0 3 291.372 2.857 20 10 CFCDHN C[N@@H+](CCc1cccs1)Cc1cc2c(cc1[O-])OCO2 ZINC000173404125 522971853 /nfs/dbraw/zinc/97/18/53/522971853.db2.gz FNRIFWKCOVSQSX-UHFFFAOYSA-N 0 3 291.372 2.857 20 10 CFCDHN COCc1ccc(CNCc2cccc(OC)c2O)cc1 ZINC000237218409 522986941 /nfs/dbraw/zinc/98/69/41/522986941.db2.gz SOLRGNFSWPPXDZ-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COCc1ccc(C[NH2+]Cc2cccc(OC)c2[O-])cc1 ZINC000237218409 522986949 /nfs/dbraw/zinc/98/69/49/522986949.db2.gz SOLRGNFSWPPXDZ-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN CN(Cc1ccc(N(C)C)cc1)C[C@H]1CCCCO1 ZINC000102675121 523262452 /nfs/dbraw/zinc/26/24/52/523262452.db2.gz ALMDOPOTMRPCCN-MRXNPFEDSA-N 0 3 262.397 2.754 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000191957097 523741622 /nfs/dbraw/zinc/74/16/22/523741622.db2.gz UJHZYRNSIIGRHY-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000191957097 523741626 /nfs/dbraw/zinc/74/16/26/523741626.db2.gz UJHZYRNSIIGRHY-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000156094036 523856619 /nfs/dbraw/zinc/85/66/19/523856619.db2.gz CHXVLGSODXCNKG-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000156094036 523856625 /nfs/dbraw/zinc/85/66/25/523856625.db2.gz CHXVLGSODXCNKG-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000273603150 523953562 /nfs/dbraw/zinc/95/35/62/523953562.db2.gz SKTKNBBHABDGOA-QMTHXVAHSA-N 0 3 255.333 2.853 20 10 CFCDHN CO[C@H]1COC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000289806223 524010351 /nfs/dbraw/zinc/01/03/51/524010351.db2.gz MQRGWGGGWXMQKL-WMZOPIPTSA-N 0 3 299.370 2.563 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)N(C)C)c([O-])c1 ZINC000283967232 524329683 /nfs/dbraw/zinc/32/96/83/524329683.db2.gz GJACGNXKHXSGPZ-QWHCGFSZSA-N 0 3 250.386 2.610 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C)[C@H](O)c2ccccc2)c1[O-] ZINC000290273411 524438150 /nfs/dbraw/zinc/43/81/50/524438150.db2.gz YDNOQDBVNWWIBL-DYVFJYSZSA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1cc(CN(C)C[C@H]2CCCO2)ccc1N(C)C ZINC000293377040 524662286 /nfs/dbraw/zinc/66/22/86/524662286.db2.gz GAJNGGZTIOSIKI-OAHLLOKOSA-N 0 3 262.397 2.672 20 10 CFCDHN COc1ccc(O)c(CN2CCC(F)(F)[C@@H](C)C2)c1 ZINC000291688041 524736142 /nfs/dbraw/zinc/73/61/42/524736142.db2.gz XWVAPXVEEOBBKL-JTQLQIEISA-N 0 3 271.307 2.878 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](C)c2cnn(C)c2)c1 ZINC000273618419 524765501 /nfs/dbraw/zinc/76/55/01/524765501.db2.gz YIFSMDFRIGOOJB-GHMZBOCLSA-N 0 3 275.352 2.546 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)C2CCCC2)c1 ZINC000290215954 524767464 /nfs/dbraw/zinc/76/74/64/524767464.db2.gz QKESNVDWRNAIAN-IAQYHMDHSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCSC2)c1 ZINC000230667617 524773650 /nfs/dbraw/zinc/77/36/50/524773650.db2.gz PCBOFWPVDARNKL-UWVGGRQHSA-N 0 3 253.367 2.557 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H]2CCCc3c[nH]nc32)c1 ZINC000273343650 524775517 /nfs/dbraw/zinc/77/55/17/524775517.db2.gz ACJWRETWIDWYTQ-HZMBPMFUSA-N 0 3 287.363 2.852 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCSC2)c1 ZINC000230667608 524775602 /nfs/dbraw/zinc/77/56/02/524775602.db2.gz PCBOFWPVDARNKL-VHSXEESVSA-N 0 3 253.367 2.557 20 10 CFCDHN Cc1cccc2c1OC[C@@H]([NH2+]Cc1ccccc1[O-])C2 ZINC000289587149 524958023 /nfs/dbraw/zinc/95/80/23/524958023.db2.gz MVANHSYMJGXGEZ-HNNXBMFYSA-N 0 3 269.344 2.794 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1ccccc1[O-])c1ccc(F)cc1 ZINC000157857891 525179804 /nfs/dbraw/zinc/17/98/04/525179804.db2.gz XSTRBBRHJVJMKI-INIZCTEOSA-N 0 3 275.323 2.529 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)cc1C ZINC000275935970 525316740 /nfs/dbraw/zinc/31/67/40/525316740.db2.gz HVBIHMDBKKEPAL-SHTZXODSSA-N 0 3 263.381 2.744 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H]2CC[C@H](O)CC2)cc1C ZINC000275935970 525316747 /nfs/dbraw/zinc/31/67/47/525316747.db2.gz HVBIHMDBKKEPAL-SHTZXODSSA-N 0 3 263.381 2.744 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H](O)c2ccc(F)cc2)cc1C ZINC000277635359 525322676 /nfs/dbraw/zinc/32/26/76/525322676.db2.gz CROQKKDJWQARJS-QGZVFWFLSA-N 0 3 289.350 2.971 20 10 CFCDHN C[C@]12CCN(Cc3cc4c(cc3O)OCO4)C[C@H]1C2(F)F ZINC000292072834 525346857 /nfs/dbraw/zinc/34/68/57/525346857.db2.gz LMNFYOONZGSGJL-KGLIPLIRSA-N 0 3 297.301 2.598 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)CN2CCCCC2)c1 ZINC000071407939 525351661 /nfs/dbraw/zinc/35/16/61/525351661.db2.gz XBPRMAMTWZCMMM-AWEZNQCLSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]Cc2ccc3c(c2)OCO3)c1 ZINC000071406386 525353414 /nfs/dbraw/zinc/35/34/14/525353414.db2.gz BDTUMIHOHFKBII-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccc3c(c2)OCO3)c1 ZINC000071406386 525353421 /nfs/dbraw/zinc/35/34/21/525353421.db2.gz BDTUMIHOHFKBII-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094617091 525408716 /nfs/dbraw/zinc/40/87/16/525408716.db2.gz UVBNOISXRMQYMS-ZBEGNZNMSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H](NCc1ccn(C)c1)c1ccc(N(C)C)cc1 ZINC000158484632 525543166 /nfs/dbraw/zinc/54/31/66/525543166.db2.gz FDSHMBJDJLZRMO-CYBMUJFWSA-N 0 3 257.381 2.942 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCO[C@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000300419135 525627385 /nfs/dbraw/zinc/62/73/85/525627385.db2.gz PSDWOQVIJFQCLH-FGEZKYSXSA-N 0 3 265.328 2.749 20 10 CFCDHN C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000280415661 525792743 /nfs/dbraw/zinc/79/27/43/525792743.db2.gz IHFORCZWUZGMAB-FZMZJTMJSA-N 0 3 267.344 2.657 20 10 CFCDHN C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000280415661 525792754 /nfs/dbraw/zinc/79/27/54/525792754.db2.gz IHFORCZWUZGMAB-FZMZJTMJSA-N 0 3 267.344 2.657 20 10 CFCDHN COc1cccc(CN(C)Cc2ccc(O)cc2)c1O ZINC000290405998 525911708 /nfs/dbraw/zinc/91/17/08/525911708.db2.gz JTCLXAGUZMXELL-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN C[C@@]12CCN(Cc3cc4c(cc3O)OCO4)C[C@@H]1C2(F)F ZINC000292072835 525912302 /nfs/dbraw/zinc/91/23/02/525912302.db2.gz LMNFYOONZGSGJL-UONOGXRCSA-N 0 3 297.301 2.598 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CCN(C)C)c([O-])c1 ZINC000049553636 525933146 /nfs/dbraw/zinc/93/31/46/525933146.db2.gz DIVKWVHBQWDJEY-STQMWFEESA-N 0 3 250.386 2.691 20 10 CFCDHN COc1cccc(C[NH2+]CC2(O)CCCCCC2)c1[O-] ZINC000079619225 526012744 /nfs/dbraw/zinc/01/27/44/526012744.db2.gz HMUGGODDKONKQT-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COc1cccc(C[NH2+]CCCOc2ccccc2)c1[O-] ZINC000052091990 526013658 /nfs/dbraw/zinc/01/36/58/526013658.db2.gz QFYJSPZAMBEZTC-UHFFFAOYSA-N 0 3 287.359 2.960 20 10 CFCDHN COc1cccc(C[NH2+]CCOc2ccccc2)c1[O-] ZINC000042895610 526016569 /nfs/dbraw/zinc/01/65/69/526016569.db2.gz SFNYPBVOZKGMKV-UHFFFAOYSA-N 0 3 273.332 2.569 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c1[O-] ZINC000292731513 526028599 /nfs/dbraw/zinc/02/85/99/526028599.db2.gz GIDADUVCKYVXBU-INIZCTEOSA-N 0 3 293.407 2.678 20 10 CFCDHN COc1cccc(CN[C@H](C)c2cccnc2)c1O ZINC000020127600 526036390 /nfs/dbraw/zinc/03/63/90/526036390.db2.gz DZFAVKBBAHTMLM-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H]3CCC[C@@H]31)OCO2 ZINC000156039809 526335258 /nfs/dbraw/zinc/33/52/58/526335258.db2.gz SZXMVIJEOGZEPP-AAEUAGOBSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H]3CCC[C@@H]31)OCO2 ZINC000156039809 526335261 /nfs/dbraw/zinc/33/52/61/526335261.db2.gz SZXMVIJEOGZEPP-AAEUAGOBSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cccc(Cl)c1C[NH2+]C1CCN(C2CC2)CC1 ZINC000083551646 526364175 /nfs/dbraw/zinc/36/41/75/526364175.db2.gz SVNXNDFFFACBJO-UHFFFAOYSA-N 0 3 280.799 2.762 20 10 CFCDHN O=[N+]([O-])c1cccc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000052926108 527386344 /nfs/dbraw/zinc/38/63/44/527386344.db2.gz OSKVEKOKWSCQRG-UHFFFAOYSA-N 0 3 258.277 2.590 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000289870240 527599658 /nfs/dbraw/zinc/59/96/58/527599658.db2.gz OYIFCNDFHUMBQE-AEFFLSMTSA-N 0 3 283.371 2.648 20 10 CFCDHN CCC1(C[NH2+]Cc2c([O-])cccc2OC)CCOCC1 ZINC000744450148 574075268 /nfs/dbraw/zinc/07/52/68/574075268.db2.gz NQTUEMLTKWCXMA-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN COc1cc(C)cc(CN(C)C[C@@H]2CCCCO2)c1O ZINC000754723347 574116462 /nfs/dbraw/zinc/11/64/62/574116462.db2.gz QKGDIEUFXWCYOR-AWEZNQCLSA-N 0 3 279.380 2.710 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCCN(C)C2)c2c1c(F)ccc2[O-] ZINC000756445242 574117066 /nfs/dbraw/zinc/11/70/66/574117066.db2.gz MKOMOYVEOOTECS-MDZLAQPJSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CC[C@@H](C)C2)c1 ZINC000756630490 574127556 /nfs/dbraw/zinc/12/75/56/574127556.db2.gz WHUKRRSVPSLSBA-ZIAGYGMSSA-N 0 3 262.397 2.693 20 10 CFCDHN C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)c1cc([O-])cs1 ZINC000731869525 574131171 /nfs/dbraw/zinc/13/11/71/574131171.db2.gz KQRIUMQUZPKPOG-GFCCVEGCSA-N 0 3 296.436 2.838 20 10 CFCDHN C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([O-])cs1 ZINC000731869525 574131172 /nfs/dbraw/zinc/13/11/72/574131172.db2.gz KQRIUMQUZPKPOG-GFCCVEGCSA-N 0 3 296.436 2.838 20 10 CFCDHN C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870857 574131211 /nfs/dbraw/zinc/13/12/11/574131211.db2.gz ZZXXNRAYGAWHNN-GRYCIOLGSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([O-])cs1 ZINC000731870857 574131212 /nfs/dbraw/zinc/13/12/12/574131212.db2.gz ZZXXNRAYGAWHNN-GRYCIOLGSA-N 0 3 296.436 2.550 20 10 CFCDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)C1=CC(=O)CS1 ZINC000731870857 574131214 /nfs/dbraw/zinc/13/12/14/574131214.db2.gz ZZXXNRAYGAWHNN-GRYCIOLGSA-N 0 3 296.436 2.550 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@](C)(O)[C@@H](C)CC)c([O-])c1 ZINC000732820960 574173535 /nfs/dbraw/zinc/17/35/35/574173535.db2.gz QSOJMCABRFRREQ-LRDDRELGSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCc2cnc(C3CC3)nc2)c1 ZINC000756036189 574205641 /nfs/dbraw/zinc/20/56/41/574205641.db2.gz YNHSXDZKLRUVIH-UHFFFAOYSA-N 0 3 283.375 2.700 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756345462 574227655 /nfs/dbraw/zinc/22/76/55/574227655.db2.gz XQHSAINANZZUOZ-DGCLKSJQSA-N 0 3 289.354 2.956 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)Cc1cccc(O)c1 ZINC000729680863 574227632 /nfs/dbraw/zinc/22/76/32/574227632.db2.gz CURSWOFPSHNVCO-GFCCVEGCSA-N 0 3 287.359 2.827 20 10 CFCDHN CN1CC[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000729682159 574228017 /nfs/dbraw/zinc/22/80/17/574228017.db2.gz OCKIHQMQBNMJFZ-KRWDZBQOSA-N 0 3 282.387 2.853 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCN2CCCC2)c2c1c(F)ccc2[O-] ZINC000756355587 574228668 /nfs/dbraw/zinc/22/86/68/574228668.db2.gz PLMVQGLYHLFRIR-WCQYABFASA-N 0 3 278.371 2.765 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccco2)c([O-])c1 ZINC000756379734 574231440 /nfs/dbraw/zinc/23/14/40/574231440.db2.gz AVFFQPNHPVPKHD-SMDDNHRTSA-N 0 3 261.321 2.678 20 10 CFCDHN CCOCC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756418027 574235661 /nfs/dbraw/zinc/23/56/61/574235661.db2.gz NTYFSOQJDDGHCY-KOLCDFICSA-N 0 3 253.317 2.706 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430445 574236752 /nfs/dbraw/zinc/23/67/52/574236752.db2.gz ICHUINDMLOJWCN-VQISRLSMSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(F)cc(F)c1[O-] ZINC000756430445 574236754 /nfs/dbraw/zinc/23/67/54/574236754.db2.gz ICHUINDMLOJWCN-VQISRLSMSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000756459083 574238745 /nfs/dbraw/zinc/23/87/45/574238745.db2.gz WJLUDNAROWTOHJ-NQBHXWOUSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCCC1=O)c1cc(F)ccc1[O-] ZINC000756558316 574247498 /nfs/dbraw/zinc/24/74/98/574247498.db2.gz ZJPIOXZJWMWGFB-GFCCVEGCSA-N 0 3 294.370 2.585 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC2(O)CCCC2)c2c1c(F)ccc2[O-] ZINC000756571737 574248830 /nfs/dbraw/zinc/24/88/30/574248830.db2.gz DQPOUGLLSORYCJ-CMPLNLGQSA-N 0 3 279.355 2.974 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2cc(C)ccc2O)n[nH]1 ZINC000756570431 574248844 /nfs/dbraw/zinc/24/88/44/574248844.db2.gz BRYBXTHVEDOJHI-NSHDSACASA-N 0 3 259.353 2.837 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756605174 574251677 /nfs/dbraw/zinc/25/16/77/574251677.db2.gz RCKOWZLSSYLUDL-CKYFFXLPSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCC[C@H]2C)c1 ZINC000756615686 574252337 /nfs/dbraw/zinc/25/23/37/574252337.db2.gz FNTSEXDWDWOXQH-ZIAGYGMSSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@H]([NH2+]CCN1CC[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000756628455 574253346 /nfs/dbraw/zinc/25/33/46/574253346.db2.gz MHCVQYFDCDPJCL-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)Cc2ccco2)c([O-])c1 ZINC000756661188 574256472 /nfs/dbraw/zinc/25/64/72/574256472.db2.gz PMINSCLLLRBTDY-KBPBESRZSA-N 0 3 289.375 2.795 20 10 CFCDHN C[C@H](Cn1cccn1)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756672781 574256827 /nfs/dbraw/zinc/25/68/27/574256827.db2.gz RFXUPWREKIGIFV-DMDPSCGWSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@H](Cn1cccn1)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756672783 574256946 /nfs/dbraw/zinc/25/69/46/574256946.db2.gz RFXUPWREKIGIFV-LOWVWBTDSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756684511 574257333 /nfs/dbraw/zinc/25/73/33/574257333.db2.gz KJDCBOASZUKWIY-ZYHUDNBSSA-N 0 3 275.327 2.566 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCn2cccn2)c([O-])c1C ZINC000756684732 574257685 /nfs/dbraw/zinc/25/76/85/574257685.db2.gz LSLSSKNPFZIQMW-CYBMUJFWSA-N 0 3 259.353 2.556 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H](CCO)C2CC2)c2c1c(F)ccc2[O-] ZINC000756740142 574259918 /nfs/dbraw/zinc/25/99/18/574259918.db2.gz PXHVFKJLHXZZIY-WQAKAFBOSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1ccc([C@H](C)N[C@@H](CO)CC(F)(F)F)c(O)c1C ZINC000756777154 574262199 /nfs/dbraw/zinc/26/21/99/574262199.db2.gz VZXIMQXQKXMWIW-WDEREUQCSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)CC(F)(F)F)c([O-])c1C ZINC000756777154 574262202 /nfs/dbraw/zinc/26/22/02/574262202.db2.gz VZXIMQXQKXMWIW-WDEREUQCSA-N 0 3 291.313 2.973 20 10 CFCDHN CO[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756786053 574262945 /nfs/dbraw/zinc/26/29/45/574262945.db2.gz IIKVVUGRVCMVMW-UEKVPHQBSA-N 0 3 267.344 2.997 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000756816820 574265196 /nfs/dbraw/zinc/26/51/96/574265196.db2.gz ARRSWYXKGIGVKN-WCABBAIRSA-N 0 3 267.344 2.829 20 10 CFCDHN CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1[O-])C(F)(F)F ZINC000756834735 574266770 /nfs/dbraw/zinc/26/67/70/574266770.db2.gz JGMJEPYVJVTFTR-BXKDBHETSA-N 0 3 277.286 2.929 20 10 CFCDHN CCC[N@H+](C/C=C(/C)C(=O)OC)Cc1ccccc1[O-] ZINC000748813499 574268067 /nfs/dbraw/zinc/26/80/67/574268067.db2.gz SPYPBMVABOKSBQ-LCYFTJDESA-N 0 3 277.364 2.724 20 10 CFCDHN CCC[N@@H+](C/C=C(/C)C(=O)OC)Cc1ccccc1[O-] ZINC000748813499 574268069 /nfs/dbraw/zinc/26/80/69/574268069.db2.gz SPYPBMVABOKSBQ-LCYFTJDESA-N 0 3 277.364 2.724 20 10 CFCDHN O=C(NC1CC[NH+](C2CCCC2)CC1)c1cc([O-])cs1 ZINC000748859720 574271928 /nfs/dbraw/zinc/27/19/28/574271928.db2.gz OJMQJIDGZUWGAJ-UHFFFAOYSA-N 0 3 294.420 2.591 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)Cc2ccncc2)c([O-])c1 ZINC000749295287 574288496 /nfs/dbraw/zinc/28/84/96/574288496.db2.gz LIENCRBCVDGTKQ-ZDUSSCGKSA-N 0 3 286.375 2.907 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+]Cc2cc(C)c(C)cc2[O-])C1(C)C ZINC000753372817 574401753 /nfs/dbraw/zinc/40/17/53/574401753.db2.gz IYZMIQUBUXPXMR-GJZGRUSLSA-N 0 3 263.381 2.912 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000753575671 574405188 /nfs/dbraw/zinc/40/51/88/574405188.db2.gz LSIXUBOOFRBLON-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN CC[C@@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC000891251207 618082066 /nfs/dbraw/zinc/08/20/66/618082066.db2.gz AVAUFYXYTCMNDJ-CJNGLKHVSA-N 0 3 291.439 2.518 20 10 CFCDHN CCc1nn(C)cc1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000168662083 618196872 /nfs/dbraw/zinc/19/68/72/618196872.db2.gz XABCRXKUIPKBFP-LLVKDONJSA-N 0 3 259.353 2.539 20 10 CFCDHN COc1ccc(CNCc2ccccc2F)c(O)c1OC ZINC000892435159 618267911 /nfs/dbraw/zinc/26/79/11/618267911.db2.gz MHBBJRXCXSBJKI-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@H](CO)C2)c1[O-] ZINC000312448482 618281090 /nfs/dbraw/zinc/28/10/90/618281090.db2.gz OCFNUMHJUYHRME-GWCFXTLKSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(C)cc(CN2CCOCC23CCCC3)c1O ZINC000894085603 618308268 /nfs/dbraw/zinc/30/82/68/618308268.db2.gz WQJKVHDPQQHPSY-UHFFFAOYSA-N 0 3 291.391 2.854 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc(F)nc2)cc1 ZINC000188970324 618318765 /nfs/dbraw/zinc/31/87/65/618318765.db2.gz YCDUJFWKKDLFLV-UHFFFAOYSA-N 0 3 259.328 2.577 20 10 CFCDHN Cc1cc(CNCc2ccc(N(C)C)cc2)cnc1F ZINC000892477054 618339298 /nfs/dbraw/zinc/33/92/98/618339298.db2.gz ZOYAMAQIGXYTOZ-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1F ZINC000249530164 618367385 /nfs/dbraw/zinc/36/73/85/618367385.db2.gz AUFMJQIVANLKLK-SUMWQHHRSA-N 0 3 294.414 2.875 20 10 CFCDHN COc1cc(C)cc(CN[C@H](C)c2ccccn2)c1O ZINC000894146440 618397159 /nfs/dbraw/zinc/39/71/59/618397159.db2.gz RBGNLDPIEZDFIN-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OC)cc2[O-])C1 ZINC000894186323 618432899 /nfs/dbraw/zinc/43/28/99/618432899.db2.gz VGCFJVPMBAZGKZ-DZGCQCFKSA-N 0 3 279.380 2.838 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CCOC(C)C ZINC000788269613 618447809 /nfs/dbraw/zinc/44/78/09/618447809.db2.gz BTCMRUVVSIDAAE-INIZCTEOSA-N 0 3 295.423 2.780 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CCOC(C)C ZINC000788269613 618447812 /nfs/dbraw/zinc/44/78/12/618447812.db2.gz BTCMRUVVSIDAAE-INIZCTEOSA-N 0 3 295.423 2.780 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](CO)CCC(C)C ZINC000895391732 618563950 /nfs/dbraw/zinc/56/39/50/618563950.db2.gz DCNBDOWLDWTCMQ-ZDUSSCGKSA-N 0 3 251.370 2.587 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)COc1ccccc1 ZINC000892696708 618716022 /nfs/dbraw/zinc/71/60/22/618716022.db2.gz OYKNJSQOVXZORT-CYBMUJFWSA-N 0 3 287.359 2.958 20 10 CFCDHN CC[C@@H]1CN(Cc2cccc(C)c2O)CCN1CC(F)F ZINC000180543064 618863931 /nfs/dbraw/zinc/86/39/31/618863931.db2.gz SDPBFPWOVNAGKI-CQSZACIVSA-N 0 3 298.377 2.862 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)[C@@H]2C)c1[O-] ZINC000840976501 619204688 /nfs/dbraw/zinc/20/46/88/619204688.db2.gz CKMXLKHFBGKBIJ-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c1[O-] ZINC000840976501 619204690 /nfs/dbraw/zinc/20/46/90/619204690.db2.gz CKMXLKHFBGKBIJ-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000894567138 619420644 /nfs/dbraw/zinc/42/06/44/619420644.db2.gz RTHPKGXDLQTNHG-ZDUSSCGKSA-N 0 3 284.350 2.587 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781984 619465987 /nfs/dbraw/zinc/46/59/87/619465987.db2.gz IHHJEAPZASDMHS-IAQYHMDHSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781984 619465989 /nfs/dbraw/zinc/46/59/89/619465989.db2.gz IHHJEAPZASDMHS-IAQYHMDHSA-N 0 3 296.361 2.587 20 10 CFCDHN COCCC1(C)CN(Cc2cc(C)cc(OC)c2O)C1 ZINC000894980486 619521286 /nfs/dbraw/zinc/52/12/86/619521286.db2.gz QXBRVJNGCDOPHK-UHFFFAOYSA-N 0 3 279.380 2.568 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H](CF)C2)c([O-])c1 ZINC000895572493 619557048 /nfs/dbraw/zinc/55/70/48/619557048.db2.gz FDZZOAKLTXBYII-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H](CF)C2)c([O-])c1 ZINC000895572493 619557051 /nfs/dbraw/zinc/55/70/51/619557051.db2.gz FDZZOAKLTXBYII-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCC3(CCC3)O2)c([O-])c1 ZINC000895677702 619580615 /nfs/dbraw/zinc/58/06/15/619580615.db2.gz QFAKCGAXBCUMRZ-AWEZNQCLSA-N 0 3 261.365 2.892 20 10 CFCDHN COC1CCC(C[N@@H+]2Cc3cccc([O-])c3C2)CC1 ZINC000895784580 619606368 /nfs/dbraw/zinc/60/63/68/619606368.db2.gz JMJYAUJEHOJMFB-UHFFFAOYSA-N 0 3 261.365 2.913 20 10 CFCDHN COC1CCC(C[N@H+]2Cc3cccc([O-])c3C2)CC1 ZINC000895784580 619606370 /nfs/dbraw/zinc/60/63/70/619606370.db2.gz JMJYAUJEHOJMFB-UHFFFAOYSA-N 0 3 261.365 2.913 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CC[C@H](C(F)(F)F)O2)c([O-])c1 ZINC000896284590 619709715 /nfs/dbraw/zinc/70/97/15/619709715.db2.gz XYZPSGYUCICMDH-DGCLKSJQSA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CC[C@@H](C(F)(F)F)O2)c([O-])c1 ZINC000896284594 619709728 /nfs/dbraw/zinc/70/97/28/619709728.db2.gz XYZPSGYUCICMDH-YPMHNXCESA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cc(N(C)C)ccn1 ZINC000896299074 619711991 /nfs/dbraw/zinc/71/19/91/619711991.db2.gz QKMUMQODHOLHRD-UHFFFAOYSA-N 0 3 298.434 2.812 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)c2cccc(F)c2)c([O-])c1 ZINC000896562683 619763239 /nfs/dbraw/zinc/76/32/39/619763239.db2.gz YAAJASFQPKTJSN-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCC3(CCOCC3)O2)c([O-])c1 ZINC000896919444 619888766 /nfs/dbraw/zinc/88/87/66/619888766.db2.gz XGQCEBQPRGDAIF-HNNXBMFYSA-N 0 3 291.391 2.518 20 10 CFCDHN C[C@@H](Cc1cccnc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000897969059 620314950 /nfs/dbraw/zinc/31/49/50/620314950.db2.gz CQKIQBYBFALSJK-NSHDSACASA-N 0 3 260.312 2.647 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2COC[C@H]2C2CC2)cc1F ZINC000898375749 620377447 /nfs/dbraw/zinc/37/74/47/620377447.db2.gz HDVKJLVKAUKRDG-SWLSCSKDSA-N 0 3 296.361 2.545 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[O-])CCN1 ZINC000841062279 620424656 /nfs/dbraw/zinc/42/46/56/620424656.db2.gz VJJYREBVHWKIAG-KCJUWKMLSA-N 0 3 289.206 2.929 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[O-])CC[NH2+]1 ZINC000841062279 620424658 /nfs/dbraw/zinc/42/46/58/620424658.db2.gz VJJYREBVHWKIAG-KCJUWKMLSA-N 0 3 289.206 2.929 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C/C=C/Cl)c1[O-] ZINC000898434413 620464094 /nfs/dbraw/zinc/46/40/94/620464094.db2.gz VHRWQSNGOXKVEV-NSCUHMNNSA-N 0 3 262.136 2.896 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCC[C@H]1C1OCCO1 ZINC000902622926 621137890 /nfs/dbraw/zinc/13/78/90/621137890.db2.gz SBUZFHNPKNLKAG-INIZCTEOSA-N 0 3 299.370 2.883 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCC[C@H]1C1OCCO1 ZINC000902622926 621137891 /nfs/dbraw/zinc/13/78/91/621137891.db2.gz SBUZFHNPKNLKAG-INIZCTEOSA-N 0 3 299.370 2.883 20 10 CFCDHN CC[C@H](CN1CCOCC1)[NH2+][C@H](CC)c1ccccc1[O-] ZINC000903342496 621335570 /nfs/dbraw/zinc/33/55/70/621335570.db2.gz FRMQZNUFGNHSOA-GDBMZVCRSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCOC12CCOCC2)c1cc(F)ccc1[O-] ZINC000903389484 621359894 /nfs/dbraw/zinc/35/98/94/621359894.db2.gz LWYNEDJWTPMWJQ-XHDPSFHLSA-N 0 3 295.354 2.520 20 10 CFCDHN Cc1ncccc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000903417210 621366207 /nfs/dbraw/zinc/36/62/07/621366207.db2.gz BICYBBVIDBCILX-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2COC[C@H]2C2CC2)c([O-])c1 ZINC000903436547 621374234 /nfs/dbraw/zinc/37/42/34/621374234.db2.gz JVESIZGRAGKEQF-CQDKDKBSSA-N 0 3 261.365 2.776 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000903451964 621386952 /nfs/dbraw/zinc/38/69/52/621386952.db2.gz YPDSPPCINJOVCS-XQQFMLRXSA-N 0 3 277.364 2.775 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cc(N)ccn2)cc1 ZINC000903950176 621486790 /nfs/dbraw/zinc/48/67/90/621486790.db2.gz JNTGOFJCRTVRQZ-UHFFFAOYSA-N 0 3 284.407 2.800 20 10 CFCDHN C[C@@H]([NH2+]CCCOCC1CCOCC1)c1ccccc1[O-] ZINC000183524839 625514753 /nfs/dbraw/zinc/51/47/53/625514753.db2.gz RORQKGCXQQPXLR-CQSZACIVSA-N 0 3 293.407 2.876 20 10 CFCDHN Nc1ccc(NC(=O)[C@H](N)C2CCCCCC2)cc1 ZINC000911659887 622531652 /nfs/dbraw/zinc/53/16/52/622531652.db2.gz GQRHGMHCCQVTFK-CQSZACIVSA-N 0 3 261.369 2.505 20 10 CFCDHN C[C@@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1cc([O-])cs1 ZINC000912808437 622778278 /nfs/dbraw/zinc/77/82/78/622778278.db2.gz YRRHPBMDCACRJF-WCQYABFASA-N 0 3 296.436 2.646 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](C)CC(F)F ZINC000842727624 622873888 /nfs/dbraw/zinc/87/38/88/622873888.db2.gz NQRUAOBYGWRUPO-SECBINFHSA-N 0 3 259.296 2.782 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000156685141 622954260 /nfs/dbraw/zinc/95/42/60/622954260.db2.gz BYQVBPUXVAHOTN-OCCSQVGLSA-N 0 3 290.407 2.832 20 10 CFCDHN Oc1ccccc1CN[C@H]1COCc2ccccc21 ZINC000226011894 623053822 /nfs/dbraw/zinc/05/38/22/623053822.db2.gz HDHWFJFTHRATJJ-HNNXBMFYSA-N 0 3 255.317 2.753 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1COCc2ccccc21 ZINC000226011894 623053828 /nfs/dbraw/zinc/05/38/28/623053828.db2.gz HDHWFJFTHRATJJ-HNNXBMFYSA-N 0 3 255.317 2.753 20 10 CFCDHN C[C@](CO)([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000226608762 623083567 /nfs/dbraw/zinc/08/35/67/623083567.db2.gz DEWNUCHLYRNHDQ-MRXNPFEDSA-N 0 3 275.323 2.529 20 10 CFCDHN CC(C)C[C@@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230660097 623291204 /nfs/dbraw/zinc/29/12/04/623291204.db2.gz MJRHFISEIRBXKV-CMPLNLGQSA-N 0 3 255.333 2.589 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1 ZINC000184862288 625657601 /nfs/dbraw/zinc/65/76/01/625657601.db2.gz CEUJYRYEBJRPJW-GFCCVEGCSA-N 0 3 284.359 2.650 20 10 CFCDHN CC[C@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637710 623537526 /nfs/dbraw/zinc/53/75/26/623537526.db2.gz ZGWYEVADXONRMC-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637710 623537529 /nfs/dbraw/zinc/53/75/29/623537529.db2.gz ZGWYEVADXONRMC-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](SC)C2)c([O-])c1 ZINC000824683557 623544974 /nfs/dbraw/zinc/54/49/74/623544974.db2.gz PFXYHBLICVQBNZ-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](SC)C2)c([O-])c1 ZINC000824683557 623544978 /nfs/dbraw/zinc/54/49/78/623544978.db2.gz PFXYHBLICVQBNZ-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(O)c1CN(C)[C@H](CO)c1ccccc1 ZINC000824696295 623547162 /nfs/dbraw/zinc/54/71/62/623547162.db2.gz KKEARIXTXGXOTE-OAHLLOKOSA-N 0 3 287.359 2.566 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](OC)[C@H](C)C2)c1[O-] ZINC000824814518 623569756 /nfs/dbraw/zinc/56/97/56/623569756.db2.gz ATRFUUUPCLZQCK-MFKMUULPSA-N 0 3 299.798 2.911 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](OC)[C@H](C)C2)c1[O-] ZINC000824814518 623569764 /nfs/dbraw/zinc/56/97/64/623569764.db2.gz ATRFUUUPCLZQCK-MFKMUULPSA-N 0 3 299.798 2.911 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]([C@H](CO)C2CC2)C2CC2)c1 ZINC000824847398 623577493 /nfs/dbraw/zinc/57/74/93/623577493.db2.gz YQMSUMLUIMHJPP-WBVHZDCISA-N 0 3 275.392 2.587 20 10 CFCDHN CCOc1ccc(C[NH2+]CCN2CCCC2(C)C)c([O-])c1 ZINC000825326476 623672287 /nfs/dbraw/zinc/67/22/87/623672287.db2.gz MWVNBTLXUIWMOZ-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CN(C)c1ccc(CN2C[C@]3(C)COC[C@]3(C)C2)cc1F ZINC000827018316 623925492 /nfs/dbraw/zinc/92/54/92/623925492.db2.gz USUUHMGPALDCFH-CALCHBBNSA-N 0 3 292.398 2.750 20 10 CFCDHN COc1ccc2c(c1)CCN(Cc1cccc(OC)c1O)C2 ZINC000827305137 623985374 /nfs/dbraw/zinc/98/53/74/623985374.db2.gz NKCFPKHTIIBJON-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN Cc1cncc(CC[NH2+]Cc2cc(Cl)cc(C)c2[O-])n1 ZINC000827383838 623996615 /nfs/dbraw/zinc/99/66/15/623996615.db2.gz KPSWDFGYVOAAPT-UHFFFAOYSA-N 0 3 291.782 2.785 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827699661 624068799 /nfs/dbraw/zinc/06/87/99/624068799.db2.gz KVXVAYSSJYEWNO-NHYWBVRUSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@](C)(CO)C2)c1[O-] ZINC000827699661 624068802 /nfs/dbraw/zinc/06/88/02/624068802.db2.gz KVXVAYSSJYEWNO-NHYWBVRUSA-N 0 3 283.799 2.804 20 10 CFCDHN C[C@@H](O)[C@H]([NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000827855358 624111925 /nfs/dbraw/zinc/11/19/25/624111925.db2.gz BJHMQKXRQSXUET-BZNIZROVSA-N 0 3 275.323 2.743 20 10 CFCDHN CCN(CC)c1ccc(CN(C)C2(CO)CC2)cc1F ZINC000827903081 624124631 /nfs/dbraw/zinc/12/46/31/624124631.db2.gz ARMXYFGGYYYUJJ-UHFFFAOYSA-N 0 3 280.387 2.629 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](CO)Cc1ccccc1)CC2 ZINC000834531316 625703268 /nfs/dbraw/zinc/70/32/68/625703268.db2.gz VUOFQRZLMQHDNB-WBVHZDCISA-N 0 3 297.398 2.820 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccccc1CO)CC2 ZINC000834531098 625703365 /nfs/dbraw/zinc/70/33/65/625703365.db2.gz PDKDMUACCAUUCL-OAHLLOKOSA-N 0 3 269.344 2.662 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])CC1(C(=O)OC)CC1 ZINC000829516345 624450555 /nfs/dbraw/zinc/45/05/55/624450555.db2.gz USNKSAMNCLGYKO-UHFFFAOYSA-N 0 3 291.391 2.948 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])CC1(C(=O)OC)CC1 ZINC000829516345 624450557 /nfs/dbraw/zinc/45/05/57/624450557.db2.gz USNKSAMNCLGYKO-UHFFFAOYSA-N 0 3 291.391 2.948 20 10 CFCDHN C[C@@H]1CCCN(Cc2cc(Cl)ccc2[O-])[C@@H]1C[NH3+] ZINC000070175742 625278622 /nfs/dbraw/zinc/27/86/22/625278622.db2.gz HIZCWAKKDJCLJJ-ZWNOBZJWSA-N 0 3 268.788 2.605 20 10 CFCDHN CC(C)[C@@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185434714 625725791 /nfs/dbraw/zinc/72/57/91/625725791.db2.gz HQBVTSFQHDDIEH-HZMBPMFUSA-N 0 3 255.333 2.589 20 10 CFCDHN CC(C)(C)[S@@](=O)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834588672 625728324 /nfs/dbraw/zinc/72/83/24/625728324.db2.gz DUJJXVSFRKIODB-BUXKBTBVSA-N 0 3 281.421 2.516 20 10 CFCDHN c1csc(SCCCN[C@H]2CCn3ccnc32)n1 ZINC000834593602 625730863 /nfs/dbraw/zinc/73/08/63/625730863.db2.gz KRGODVLNOCRAIO-JTQLQIEISA-N 0 3 280.422 2.556 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000185524187 625737117 /nfs/dbraw/zinc/73/71/17/625737117.db2.gz MVHAPKAVDIKINU-QWHCGFSZSA-N 0 3 297.370 2.625 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@H]2CCc3cccc([O-])c32)n1 ZINC000834675190 625776956 /nfs/dbraw/zinc/77/69/56/625776956.db2.gz DFZYWRYFCFEPTP-AWEZNQCLSA-N 0 3 283.375 2.785 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000834779173 625854060 /nfs/dbraw/zinc/85/40/60/625854060.db2.gz IKNHSDAUWBHVGM-SJORKVTESA-N 0 3 297.398 2.881 20 10 CFCDHN CO[C@@H]1COCC[C@@H]1C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000834880760 625907382 /nfs/dbraw/zinc/90/73/82/625907382.db2.gz QAICMBAZURGWQR-IIAWOOMASA-N 0 3 293.407 2.711 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2cnn(C)c2)c([O-])c1 ZINC000834896843 625913204 /nfs/dbraw/zinc/91/32/04/625913204.db2.gz OJRNGFPMVGPIEJ-CHWSQXEVSA-N 0 3 273.380 2.716 20 10 CFCDHN CC[C@H]([NH2+]CCC1(CO)CC1)c1ccc(C)cc1[O-] ZINC000834898037 625914291 /nfs/dbraw/zinc/91/42/91/625914291.db2.gz YQEQBJVOZNOSKT-AWEZNQCLSA-N 0 3 263.381 2.904 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834906307 625918493 /nfs/dbraw/zinc/91/84/93/625918493.db2.gz OQDCOCAOLAEHRE-LYIQGSDWSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1cnc(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])cn1 ZINC000834908442 625920108 /nfs/dbraw/zinc/92/01/08/625920108.db2.gz JWLIWQVQWLIHFC-NSHDSACASA-N 0 3 275.327 2.523 20 10 CFCDHN C[C@H]([NH2+]CCN1CCCC1(C)C)c1ccccc1[O-] ZINC000834911537 625920258 /nfs/dbraw/zinc/92/02/58/625920258.db2.gz UKJWGIVGFRSBAL-ZDUSSCGKSA-N 0 3 262.397 2.917 20 10 CFCDHN CC(C)[C@H](C[NH2+]Cc1ccccc1[O-])c1ccnn1C ZINC000788075859 625965640 /nfs/dbraw/zinc/96/56/40/625965640.db2.gz KXDWBFAJEKWXJT-AWEZNQCLSA-N 0 3 273.380 2.655 20 10 CFCDHN CC[NH+](CC)CCCNCc1c([O-])cccc1Cl ZINC000083551136 625977156 /nfs/dbraw/zinc/97/71/56/625977156.db2.gz SRXWMXIDPHZGTB-UHFFFAOYSA-N 0 3 270.804 2.867 20 10 CFCDHN O[C@H]1Cc2ccccc2[C@H]1NCc1ccc2c(c1)CCCO2 ZINC000921584665 625991613 /nfs/dbraw/zinc/99/16/13/625991613.db2.gz ISQBUXLSMCVDDB-PKOBYXMFSA-N 0 3 295.382 2.760 20 10 CFCDHN CC[C@H](C[NH2+]Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000922598199 626320120 /nfs/dbraw/zinc/32/01/20/626320120.db2.gz ACTMGHVLGCXADD-GFCCVEGCSA-N 0 3 279.380 2.850 20 10 CFCDHN O[C@@H]1CCc2ccccc2[C@@H]1NCc1ccc2c(c1)CCO2 ZINC000922988486 626439681 /nfs/dbraw/zinc/43/96/81/626439681.db2.gz RUELPBUQTIGXSU-MJGOQNOKSA-N 0 3 295.382 2.760 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H](C)O ZINC000824921331 626480592 /nfs/dbraw/zinc/48/05/92/626480592.db2.gz JENFSBIXYZZYKO-JOYOIKCWSA-N 0 3 257.761 2.603 20 10 CFCDHN CN(Cc1ccc2c(n1)CCC2)Cc1ccccc1O ZINC000838799787 626505685 /nfs/dbraw/zinc/50/56/85/626505685.db2.gz GAWYITJLLBXVTE-UHFFFAOYSA-N 0 3 268.360 2.908 20 10 CFCDHN CCC[N@H+](CCC(=O)N1CCCC1)Cc1ccccc1[O-] ZINC000838858950 626511509 /nfs/dbraw/zinc/51/15/09/626511509.db2.gz DJYUXUFKCQAECE-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN CCC[N@@H+](CCC(=O)N1CCCC1)Cc1ccccc1[O-] ZINC000838858950 626511510 /nfs/dbraw/zinc/51/15/10/626511510.db2.gz DJYUXUFKCQAECE-UHFFFAOYSA-N 0 3 290.407 2.617 20 10 CFCDHN CC1(CO)C[NH+](Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000839145968 626526040 /nfs/dbraw/zinc/52/60/40/626526040.db2.gz XVPKXNUJDPBICN-UHFFFAOYSA-N 0 3 283.371 2.873 20 10 CFCDHN CCOc1cccc(CN2CC3(CC(F)C3)C2)c1O ZINC000839139499 626528354 /nfs/dbraw/zinc/52/83/54/626528354.db2.gz HCESFILNICUKNX-UHFFFAOYSA-N 0 3 265.328 2.725 20 10 CFCDHN CC[C@H](N[C@H](C)c1ccn(C)n1)c1ccccc1O ZINC000839192692 626530977 /nfs/dbraw/zinc/53/09/77/626530977.db2.gz VXOOEICTUYXKQS-YPMHNXCESA-N 0 3 259.353 2.928 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CCO)C2CCOCC2)c1 ZINC000763559875 626998276 /nfs/dbraw/zinc/99/82/76/626998276.db2.gz XQDOPVYXTSMLQI-XJKSGUPXSA-N 0 3 293.407 2.529 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 ZINC000765995246 627169855 /nfs/dbraw/zinc/16/98/55/627169855.db2.gz STKPWJMPARDNQY-LBPRGKRZSA-N 0 3 272.396 2.889 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)[nH]n1 ZINC000765995246 627169857 /nfs/dbraw/zinc/16/98/57/627169857.db2.gz STKPWJMPARDNQY-LBPRGKRZSA-N 0 3 272.396 2.889 20 10 CFCDHN CC(C)[N@@H+]1CCCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000768138124 627320382 /nfs/dbraw/zinc/32/03/82/627320382.db2.gz PCICXYDSQMDNIJ-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN CC(C)[N@H+]1CCCN(Cc2cc(Cl)ccc2[O-])CC1 ZINC000768138124 627320383 /nfs/dbraw/zinc/32/03/83/627320383.db2.gz PCICXYDSQMDNIJ-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN Cc1ccc(C[N@@H+](C)Cc2cc3c(cc2[O-])OC[C@H]3O)cc1 ZINC000768438212 627343315 /nfs/dbraw/zinc/34/33/15/627343315.db2.gz PSPXHEZPMHBBEQ-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1ccc(C[N@H+](C)Cc2cc3c(cc2[O-])OC[C@H]3O)cc1 ZINC000768438212 627343318 /nfs/dbraw/zinc/34/33/18/627343318.db2.gz PSPXHEZPMHBBEQ-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2c([O-])cccc2OC)CCS1 ZINC000769445145 627439362 /nfs/dbraw/zinc/43/93/62/627439362.db2.gz FNPLECOIARZVKI-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2c([O-])cccc2OC)CCS1 ZINC000769445145 627439365 /nfs/dbraw/zinc/43/93/65/627439365.db2.gz FNPLECOIARZVKI-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(CN2CCOCC23CCCC3)c(O)c1 ZINC000769533402 627453005 /nfs/dbraw/zinc/45/30/05/627453005.db2.gz NQOWKNJSNFWCNB-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCS[C@H](C(C)C)C1 ZINC000769547199 627455189 /nfs/dbraw/zinc/45/51/89/627455189.db2.gz BHGHAMYITRTUDO-HNNXBMFYSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCS[C@H](C(C)C)C1 ZINC000769547199 627455193 /nfs/dbraw/zinc/45/51/93/627455193.db2.gz BHGHAMYITRTUDO-HNNXBMFYSA-N 0 3 281.421 2.974 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@H]32)c([O-])c1 ZINC000770285892 627511406 /nfs/dbraw/zinc/51/14/06/627511406.db2.gz LHIIRKAIWIHXNS-GDBMZVCRSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c([O-])c1 ZINC000770285892 627511409 /nfs/dbraw/zinc/51/14/09/627511409.db2.gz LHIIRKAIWIHXNS-GDBMZVCRSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](OCC(C)C)C1 ZINC000770322945 627513279 /nfs/dbraw/zinc/51/32/79/627513279.db2.gz BKHDMNOAIMUYRH-ZDUSSCGKSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000770322945 627513283 /nfs/dbraw/zinc/51/32/83/627513283.db2.gz BKHDMNOAIMUYRH-ZDUSSCGKSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc(CN[C@]2(CO)CCc3ccccc32)cc1C ZINC000771199451 627583572 /nfs/dbraw/zinc/58/35/72/627583572.db2.gz CPNGEXOJIMDRRU-IBGZPJMESA-N 0 3 297.398 2.927 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CCC(O)(CC)CC2)c([O-])c1 ZINC000771874432 627640841 /nfs/dbraw/zinc/64/08/41/627640841.db2.gz JOTVNWMWXNPKKI-UHFFFAOYSA-N 0 3 293.407 2.964 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000771888405 627643428 /nfs/dbraw/zinc/64/34/28/627643428.db2.gz OTDLPCDHRFNKAQ-CZUORRHYSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1cccc(O)c1CN(C)CCOc1ccccc1 ZINC000771926984 627649198 /nfs/dbraw/zinc/64/91/98/627649198.db2.gz ATVCVBHYCCQKNS-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCOc1ccccc1 ZINC000771926984 627649200 /nfs/dbraw/zinc/64/92/00/627649200.db2.gz ATVCVBHYCCQKNS-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCOc1ccccc1 ZINC000771926984 627649203 /nfs/dbraw/zinc/64/92/03/627649203.db2.gz ATVCVBHYCCQKNS-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN CCN(C)c1ccc(CN[C@@H](C)c2cn[nH]c2)cc1 ZINC000773841821 627863566 /nfs/dbraw/zinc/86/35/66/627863566.db2.gz XIJFFVBLTSVRTQ-LBPRGKRZSA-N 0 3 258.369 2.717 20 10 CFCDHN CCN(C)c1ccc(CN[C@H](C)c2cn[nH]c2)cc1 ZINC000773841820 627863807 /nfs/dbraw/zinc/86/38/07/627863807.db2.gz XIJFFVBLTSVRTQ-GFCCVEGCSA-N 0 3 258.369 2.717 20 10 CFCDHN CC(C)N(C)C(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000774480706 627931497 /nfs/dbraw/zinc/93/14/97/627931497.db2.gz CGFLOJJMYYCERE-KGLIPLIRSA-N 0 3 291.439 2.659 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCN(C(=O)OC)C1)c1ccccc1[O-] ZINC000775499815 628032238 /nfs/dbraw/zinc/03/22/38/628032238.db2.gz FDBRICPBQCKEFU-TZMCWYRMSA-N 0 3 292.379 2.664 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@H](CC)c1ccccc1[O-] ZINC000775556382 628037090 /nfs/dbraw/zinc/03/70/90/628037090.db2.gz XRWZQQWRGKOPKQ-IIAWOOMASA-N 0 3 279.380 2.627 20 10 CFCDHN Cc1cccc(CN2CCc3ccc(O)cc3C2)c1O ZINC000775656301 628050610 /nfs/dbraw/zinc/05/06/10/628050610.db2.gz RCHBINDBXBXTDV-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN CCN1C[C@@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000775713981 628058776 /nfs/dbraw/zinc/05/87/76/628058776.db2.gz XZUWOIZMWKVMOE-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN1C[C@@H](C)[N@@H+](Cc2cccc(Cl)c2[O-])C[C@H]1C ZINC000775713981 628058777 /nfs/dbraw/zinc/05/87/77/628058777.db2.gz XZUWOIZMWKVMOE-VXGBXAGGSA-N 0 3 282.815 2.960 20 10 CFCDHN CC(C)[C@@H](C)NC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775833571 628074097 /nfs/dbraw/zinc/07/40/97/628074097.db2.gz DWJMSWYTZRVAOM-KGLIPLIRSA-N 0 3 291.439 2.564 20 10 CFCDHN COc1ccc(C[NH2+]CC2Cc3ccccc3C2)c([O-])c1 ZINC000776175737 628111825 /nfs/dbraw/zinc/11/18/25/628111825.db2.gz YZAPOMUWFVWHPC-UHFFFAOYSA-N 0 3 283.371 2.905 20 10 CFCDHN COCC1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000776251662 628122254 /nfs/dbraw/zinc/12/22/54/628122254.db2.gz REUYJUYSDFFVCY-UHFFFAOYSA-N 0 3 255.745 2.623 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCN2CC[C@H](C)C2)c1[O-] ZINC000777483251 628229613 /nfs/dbraw/zinc/22/96/13/628229613.db2.gz KGHZNHWMDIJLGX-NSHDSACASA-N 0 3 282.815 2.785 20 10 CFCDHN COCC[N@H+](Cc1cc(F)ccc1[O-])C1CCCC1 ZINC000778996968 628343661 /nfs/dbraw/zinc/34/36/61/628343661.db2.gz XWJZXDXEXXKBGC-UHFFFAOYSA-N 0 3 267.344 2.922 20 10 CFCDHN COCC[N@@H+](Cc1cc(F)ccc1[O-])C1CCCC1 ZINC000778996968 628343665 /nfs/dbraw/zinc/34/36/65/628343665.db2.gz XWJZXDXEXXKBGC-UHFFFAOYSA-N 0 3 267.344 2.922 20 10 CFCDHN C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000779000471 628344093 /nfs/dbraw/zinc/34/40/93/628344093.db2.gz XNSAXDSXGHNTDG-AWEZNQCLSA-N 0 3 271.360 2.775 20 10 CFCDHN C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccccc1[O-] ZINC000779000471 628344096 /nfs/dbraw/zinc/34/40/96/628344096.db2.gz XNSAXDSXGHNTDG-AWEZNQCLSA-N 0 3 271.360 2.775 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H](O)c1c(F)cccc1F ZINC000779089242 628351318 /nfs/dbraw/zinc/35/13/18/628351318.db2.gz VWAMYLXVZQWGHV-CQSZACIVSA-N 0 3 297.276 2.633 20 10 CFCDHN Cc1cccc(CNC2(C(=O)Nc3ccccc3)CC2)c1O ZINC000779226901 628361698 /nfs/dbraw/zinc/36/16/98/628361698.db2.gz WWPSPNWTHCIIKJ-UHFFFAOYSA-N 0 3 296.370 2.962 20 10 CFCDHN COc1ccc(CNCc2ccc(N(C)C)cc2C)cn1 ZINC000780527412 628471984 /nfs/dbraw/zinc/47/19/84/628471984.db2.gz OHMRIEUTCAHVHC-UHFFFAOYSA-N 0 3 285.391 2.754 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1cccc(F)c1)c1ccccc1[O-] ZINC000783522199 628716231 /nfs/dbraw/zinc/71/62/31/628716231.db2.gz MLIFUAOXONTMDY-ABAIWWIYSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H](N[C@@H](CO)c1cccc(F)c1)c1ccccc1O ZINC000783522199 628716232 /nfs/dbraw/zinc/71/62/32/628716232.db2.gz MLIFUAOXONTMDY-ABAIWWIYSA-N 0 3 275.323 2.916 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)[C@@H]1C ZINC000787242178 629001638 /nfs/dbraw/zinc/00/16/38/629001638.db2.gz UOABLHMBYPGIGT-OCCSQVGLSA-N 0 3 299.370 2.929 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)[C@@H]1C ZINC000787242178 629001640 /nfs/dbraw/zinc/00/16/40/629001640.db2.gz UOABLHMBYPGIGT-OCCSQVGLSA-N 0 3 299.370 2.929 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCOCC(F)F)c2c1c(F)ccc2[O-] ZINC000788259206 629053870 /nfs/dbraw/zinc/05/38/70/629053870.db2.gz LNTHBFQBKMERQG-WPRPVWTQSA-N 0 3 289.297 2.951 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2cncn2C)c2c1c(F)ccc2[O-] ZINC000788258133 629053924 /nfs/dbraw/zinc/05/39/24/629053924.db2.gz UIABQRXKAXRGRS-GWCFXTLKSA-N 0 3 289.354 2.645 20 10 CFCDHN CCn1cccc(C[NH2+][C@H](C)c2cc(F)ccc2[O-])c1=O ZINC000788604837 629085613 /nfs/dbraw/zinc/08/56/13/629085613.db2.gz MDVVUJAYMNBLTR-LLVKDONJSA-N 0 3 290.338 2.564 20 10 CFCDHN CCn1cccc(CN[C@@H](C)c2ccc(N(C)C)cc2)c1=O ZINC000788603923 629085813 /nfs/dbraw/zinc/08/58/13/629085813.db2.gz GFZBRBSSORZBOC-AWEZNQCLSA-N 0 3 299.418 2.785 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1ccc(OCC)cc1[O-])C(C)C ZINC000788971609 629112418 /nfs/dbraw/zinc/11/24/18/629112418.db2.gz PNNVEKWERIQVOO-HNNXBMFYSA-N 0 3 281.396 2.942 20 10 CFCDHN C[C@@H]1COCCCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000835024711 629320682 /nfs/dbraw/zinc/32/06/82/629320682.db2.gz AARYYMFMMUHBHD-CSPWOOARSA-N 0 3 274.408 2.877 20 10 CFCDHN C[C@H]1COCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835024799 629320733 /nfs/dbraw/zinc/32/07/33/629320733.db2.gz BTPQSTMCJHBLIS-FOSCPCJNSA-N 0 3 274.408 2.734 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CCN(C3CCC3)CC2)cc1 ZINC000835027371 629324704 /nfs/dbraw/zinc/32/47/04/629324704.db2.gz FEDVLNTYPKISBB-PLNGDYQASA-N 0 3 299.462 2.936 20 10 CFCDHN CCn1ccc(CN(C)Cc2cccc(OC)c2O)c1 ZINC000792182285 629406363 /nfs/dbraw/zinc/40/63/63/629406363.db2.gz AIQKFCREIOOZCE-UHFFFAOYSA-N 0 3 274.364 2.854 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](C)N(CC)CC)c([O-])c1 ZINC000793235274 629510275 /nfs/dbraw/zinc/51/02/75/629510275.db2.gz FFQUVWXSJWRRDP-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc3c(c2)ncn3C)c([O-])c1 ZINC000793388050 629535877 /nfs/dbraw/zinc/53/58/77/629535877.db2.gz JLIVFGJOGSFYEM-UHFFFAOYSA-N 0 3 297.358 2.577 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609589 629577913 /nfs/dbraw/zinc/57/79/13/629577913.db2.gz PTRFSPKHZONZDR-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCCC[C@@H]2CCO)c1[O-] ZINC000793609589 629577917 /nfs/dbraw/zinc/57/79/17/629577917.db2.gz PTRFSPKHZONZDR-OAHLLOKOSA-N 0 3 263.381 2.828 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000794809294 629688649 /nfs/dbraw/zinc/68/86/49/629688649.db2.gz FROOEFUELONKGI-OCCSQVGLSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@@H]([NH2+]CC(=O)NC1CCCC1)c1ccc(C)cc1[O-] ZINC000794808734 629688694 /nfs/dbraw/zinc/68/86/94/629688694.db2.gz BVMPMEIAVAOLHL-OAHLLOKOSA-N 0 3 290.407 2.800 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@]1(CCO)CCOC1)c1ccc(C)cc1[O-] ZINC000794811571 629688862 /nfs/dbraw/zinc/68/88/62/629688862.db2.gz RQMVXQMGDBMNJO-NVXWUHKLSA-N 0 3 293.407 2.530 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794812049 629689387 /nfs/dbraw/zinc/68/93/87/629689387.db2.gz BUIRBDQUKADBEL-BFYDXBDKSA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](C)[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000794813906 629689516 /nfs/dbraw/zinc/68/95/16/629689516.db2.gz FZTRJVCSAVUZCY-PTAUBWNISA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000794813566 629689637 /nfs/dbraw/zinc/68/96/37/629689637.db2.gz AYMOZJXCLBODEJ-RRUGBERISA-N 0 3 269.410 2.508 20 10 CFCDHN CC[C@@H]([NH2+]CCCNC(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000794817743 629690582 /nfs/dbraw/zinc/69/05/82/629690582.db2.gz PVLMPYGILOFUTK-OAHLLOKOSA-N 0 3 292.423 2.904 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H](C)N(C)C)c1[O-] ZINC000808690955 631028855 /nfs/dbraw/zinc/02/88/55/631028855.db2.gz HGNDGWPDLFJRMV-WDEREUQCSA-N 0 3 270.804 2.955 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2cncn2C)c1[O-] ZINC000808714078 631033714 /nfs/dbraw/zinc/03/37/14/631033714.db2.gz MBCYWJGYSUUZSV-NSHDSACASA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)[C@H]2O)c([O-])c1 ZINC000840886544 631252406 /nfs/dbraw/zinc/25/24/06/631252406.db2.gz GRFYQKRAYOWRDG-QKCSRTOESA-N 0 3 285.334 2.900 20 10 CFCDHN CC(C)NC(=O)[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000840891357 631253294 /nfs/dbraw/zinc/25/32/94/631253294.db2.gz RCMPCRBWXMMBTG-JBLDHEPKSA-N 0 3 294.370 2.582 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1ccccc1[O-] ZINC000840888068 631253470 /nfs/dbraw/zinc/25/34/70/631253470.db2.gz WQYIHEKQDOHJAJ-NDMJEZRESA-N 0 3 271.307 2.592 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CC[C@H](OC(F)F)C1 ZINC000840943143 631273897 /nfs/dbraw/zinc/27/38/97/631273897.db2.gz FCWOWHREQUEWFL-AWEZNQCLSA-N 0 3 284.350 2.875 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@H](C)O[C@H]2C)c([O-])c1 ZINC000840962645 631285778 /nfs/dbraw/zinc/28/57/78/631285778.db2.gz DXKVGNSZOZLMMG-OBJOEFQTSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)NCc1cc[nH]n1 ZINC000840975716 631291420 /nfs/dbraw/zinc/29/14/20/631291420.db2.gz KXSMRQDCTYNGSR-ZDUSSCGKSA-N 0 3 272.396 2.505 20 10 CFCDHN [NH3+][C@@H](CNCc1cc(Cl)cc(Cl)c1[O-])C1CC1 ZINC000841048029 631320711 /nfs/dbraw/zinc/32/07/11/631320711.db2.gz BCYGBAFCTNESPM-NSHDSACASA-N 0 3 275.179 2.526 20 10 CFCDHN CCc1ccccc1[C@H](N)C[NH2+]Cc1ccccc1[O-] ZINC000841086801 631336310 /nfs/dbraw/zinc/33/63/10/631336310.db2.gz LPSYXBSTAVVZFE-MRXNPFEDSA-N 0 3 270.376 2.744 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2cn[nH]c2)c2c1c(F)ccc2[O-] ZINC000810248500 631350116 /nfs/dbraw/zinc/35/01/16/631350116.db2.gz WVKBSTWRZBLLMX-CABZTGNLSA-N 0 3 275.327 2.635 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(Cl)cc1[O-] ZINC000841752479 631465604 /nfs/dbraw/zinc/46/56/04/631465604.db2.gz AXUXJEHSOGTPKJ-KOLCDFICSA-N 0 3 291.782 2.977 20 10 CFCDHN CC[C@@H](C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1)OC ZINC000842154149 631554839 /nfs/dbraw/zinc/55/48/39/631554839.db2.gz TYMGJGAGMRYARY-JKSUJKDBSA-N 0 3 293.407 2.798 20 10 CFCDHN CC[C@@H](C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1)OC ZINC000842154149 631554842 /nfs/dbraw/zinc/55/48/42/631554842.db2.gz TYMGJGAGMRYARY-JKSUJKDBSA-N 0 3 293.407 2.798 20 10 CFCDHN COc1cccc(O)c1CN1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000811510649 631574448 /nfs/dbraw/zinc/57/44/48/631574448.db2.gz MIUYIJKXSUVWSW-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000811510649 631574456 /nfs/dbraw/zinc/57/44/56/631574456.db2.gz MIUYIJKXSUVWSW-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000811510649 631574462 /nfs/dbraw/zinc/57/44/62/631574462.db2.gz MIUYIJKXSUVWSW-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000842913369 631781555 /nfs/dbraw/zinc/78/15/55/631781555.db2.gz BHABRULHMLBQHS-LOWVWBTDSA-N 0 3 269.360 2.979 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000842913367 631781608 /nfs/dbraw/zinc/78/16/08/631781608.db2.gz BHABRULHMLBQHS-GVXVVHGQSA-N 0 3 269.360 2.979 20 10 CFCDHN [O-]c1c(Cl)cccc1CN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000843118650 631839850 /nfs/dbraw/zinc/83/98/50/631839850.db2.gz KWIPVPIMHIVFDY-HNNXBMFYSA-N 0 3 280.799 2.621 20 10 CFCDHN CCCn1cc(CN[C@@H](C)c2cc(OC)ccc2O)cn1 ZINC000813331724 631904371 /nfs/dbraw/zinc/90/43/71/631904371.db2.gz SJJHDGIWCQVMPJ-LBPRGKRZSA-N 0 3 289.379 2.858 20 10 CFCDHN CC(=O)c1cc(F)cc(CN(C)CC[C@H]([NH3+])C(C)C)c1[O-] ZINC000843354522 631935517 /nfs/dbraw/zinc/93/55/17/631935517.db2.gz KJDRKCXGGXATNK-HNNXBMFYSA-N 0 3 296.386 2.539 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CC2CCOCC2)c1[O-] ZINC000156027610 650040956 /nfs/dbraw/zinc/04/09/56/650040956.db2.gz KJBKJRKPYWGYMT-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CC2CCOCC2)c1[O-] ZINC000156027610 650040957 /nfs/dbraw/zinc/04/09/57/650040957.db2.gz KJBKJRKPYWGYMT-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CN1CC[C@@]2(CC[N@H+](Cc3cc(Cl)cc(F)c3[O-])C2)C1 ZINC000814178068 632024601 /nfs/dbraw/zinc/02/46/01/632024601.db2.gz AQFRBMPTTCCPNH-OAHLLOKOSA-N 0 3 298.789 2.712 20 10 CFCDHN CN1CC[C@@]2(CC[N@@H+](Cc3cc(Cl)cc(F)c3[O-])C2)C1 ZINC000814178068 632024608 /nfs/dbraw/zinc/02/46/08/632024608.db2.gz AQFRBMPTTCCPNH-OAHLLOKOSA-N 0 3 298.789 2.712 20 10 CFCDHN CN1CC[C@]2(CC[N@H+](Cc3cc(Cl)cc(F)c3[O-])C2)C1 ZINC000814178067 632025062 /nfs/dbraw/zinc/02/50/62/632025062.db2.gz AQFRBMPTTCCPNH-HNNXBMFYSA-N 0 3 298.789 2.712 20 10 CFCDHN CN1CC[C@]2(CC[N@@H+](Cc3cc(Cl)cc(F)c3[O-])C2)C1 ZINC000814178067 632025071 /nfs/dbraw/zinc/02/50/71/632025071.db2.gz AQFRBMPTTCCPNH-HNNXBMFYSA-N 0 3 298.789 2.712 20 10 CFCDHN Cc1cc(CN2CCN(C(C)C)CC2)ccc1N(C)C ZINC000815014350 632187343 /nfs/dbraw/zinc/18/73/43/632187343.db2.gz LOSIHEAJNSMRBS-UHFFFAOYSA-N 0 3 275.440 2.587 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000815081761 632198620 /nfs/dbraw/zinc/19/86/20/632198620.db2.gz NRTJNFUNRARYOA-IUODEOHRSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1nocc1CNCCCSc1nccs1 ZINC000815125182 632207681 /nfs/dbraw/zinc/20/76/81/632207681.db2.gz WFDFBYLLRSDFAC-UHFFFAOYSA-N 0 3 269.395 2.712 20 10 CFCDHN CC(=O)N1CCC([NH2+][C@H](C)c2c(C)cc(C)cc2[O-])CC1 ZINC000815554740 632289412 /nfs/dbraw/zinc/28/94/12/632289412.db2.gz HPSWYPKMGZXRLI-CYBMUJFWSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C2CCC(C(N)=O)CC2)c([O-])c1 ZINC000815593802 632294522 /nfs/dbraw/zinc/29/45/22/632294522.db2.gz XSVWAWLACNYEBK-HSBZDZAISA-N 0 3 290.407 2.704 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])c1cc[nH]c(=O)c1 ZINC000815642518 632303717 /nfs/dbraw/zinc/30/37/17/632303717.db2.gz FBZJNNDMAXRGPZ-GHMZBOCLSA-N 0 3 258.321 2.905 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CNc3ccccc3C2)c([O-])c1 ZINC000844904831 632332020 /nfs/dbraw/zinc/33/20/20/632332020.db2.gz CTASQMXLBPFJHB-HNNXBMFYSA-N 0 3 298.386 2.917 20 10 CFCDHN Cn1cc(C[N@H+](C)Cc2ccc3ccccc3c2[O-])cn1 ZINC000816482457 632468234 /nfs/dbraw/zinc/46/82/34/632468234.db2.gz GXJGVDMFWBARGA-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN Cn1cc(C[N@@H+](C)Cc2ccc3ccccc3c2[O-])cn1 ZINC000816482457 632468239 /nfs/dbraw/zinc/46/82/39/632468239.db2.gz GXJGVDMFWBARGA-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN COCC1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CCOCC1 ZINC000816625746 632497200 /nfs/dbraw/zinc/49/72/00/632497200.db2.gz MNWFIQIPGYPWHD-UHFFFAOYSA-N 0 3 299.798 2.639 20 10 CFCDHN COCc1ccc(CN[C@@H](C)c2cc(OC)ccc2O)o1 ZINC000845971228 632607200 /nfs/dbraw/zinc/60/72/00/632607200.db2.gz IQLVSZIYPXUUDJ-NSHDSACASA-N 0 3 291.347 2.991 20 10 CFCDHN COc1cccc([C@H](C)NCc2cccnc2OC)c1O ZINC000846139529 632643884 /nfs/dbraw/zinc/64/38/84/632643884.db2.gz UTPRUUZEOLJVMX-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN COc1cccc([C@H](C)N[C@@H](CO)c2ccccc2)c1O ZINC000846148822 632648052 /nfs/dbraw/zinc/64/80/52/632648052.db2.gz HVTFPLLZVNZHPX-WFASDCNBSA-N 0 3 287.359 2.785 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC2(CO)CCC2)c([O-])c1 ZINC000846211127 632661872 /nfs/dbraw/zinc/66/18/72/632661872.db2.gz TUEREDUJBRRGCH-ZDUSSCGKSA-N 0 3 263.381 2.904 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC2(CO)CCC2)c([O-])c1 ZINC000846211126 632662061 /nfs/dbraw/zinc/66/20/61/632662061.db2.gz TUEREDUJBRRGCH-CYBMUJFWSA-N 0 3 263.381 2.904 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cc(C)nnc2C)c1 ZINC000930216547 632692730 /nfs/dbraw/zinc/69/27/30/632692730.db2.gz JZWRPDRANFVIDF-LBPRGKRZSA-N 0 3 287.363 2.658 20 10 CFCDHN C[C@H]([NH2+]CCCNCc1cccnc1)c1ccccc1[O-] ZINC000817939350 632742663 /nfs/dbraw/zinc/74/26/63/632742663.db2.gz DIEINYUMSGOHQX-AWEZNQCLSA-N 0 3 285.391 2.618 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCNC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940729 632744082 /nfs/dbraw/zinc/74/40/82/632744082.db2.gz KDHCSFPJHHCIIC-ZJUUUORDSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H](N[C@H]1CCC[NH2+]C1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940729 632744086 /nfs/dbraw/zinc/74/40/86/632744086.db2.gz KDHCSFPJHHCIIC-ZJUUUORDSA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@@H](N[C@H]1CC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817944670 632747164 /nfs/dbraw/zinc/74/71/64/632747164.db2.gz JFMCCNANHZWHMX-CMPLNLGQSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCCN1)c1ccc(F)cc1[O-] ZINC000817949836 632750950 /nfs/dbraw/zinc/75/09/50/632750950.db2.gz NSMGGYUEXUMYMQ-OCCSQVGLSA-N 0 3 266.360 2.714 20 10 CFCDHN C[C@@H](NC[C@@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1[O-] ZINC000817953013 632752858 /nfs/dbraw/zinc/75/28/58/632752858.db2.gz KFYAJJHRULYJFM-ZJUUUORDSA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](N)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817965702 632763888 /nfs/dbraw/zinc/76/38/88/632763888.db2.gz UIRDUAOGHXZKTE-OLZOCXBDSA-N 0 3 268.788 2.824 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1cc(Cl)ccc1[O-] ZINC000817977222 632775404 /nfs/dbraw/zinc/77/54/04/632775404.db2.gz FBZHHQNFLNPZEQ-AUTRQRHGSA-N 0 3 256.777 2.822 20 10 CFCDHN CC[C@H]([NH2+]CCCNC1CC1)c1ccc(F)cc1[O-] ZINC000817984094 632781329 /nfs/dbraw/zinc/78/13/29/632781329.db2.gz MWHUQJFYFWEKRW-AWEZNQCLSA-N 0 3 266.360 2.714 20 10 CFCDHN C[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(=O)OC(C)(C)C ZINC000848563343 633290200 /nfs/dbraw/zinc/29/02/00/633290200.db2.gz RTPJLCCAZGBNQQ-YPMHNXCESA-N 0 3 291.391 2.947 20 10 CFCDHN CCc1cccc(CNCc2cccc(F)n2)c1O ZINC000848899392 633388312 /nfs/dbraw/zinc/38/83/12/633388312.db2.gz NLDVELTVPWVMMC-UHFFFAOYSA-N 0 3 260.312 2.779 20 10 CFCDHN CCc1cccc(CN(C)Cc2cccnc2)c1O ZINC000848901034 633389830 /nfs/dbraw/zinc/38/98/30/633389830.db2.gz NIGXDHFPXXRPIS-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CC(C)OC(=O)C[C@@H]([NH2+]Cc1ccccc1[O-])C(C)C ZINC000848926957 633409659 /nfs/dbraw/zinc/40/96/59/633409659.db2.gz LQJMVUQWWKEOFP-CQSZACIVSA-N 0 3 279.380 2.848 20 10 CFCDHN Cc1ccc(O)c(CNc2ccc([C@@H]3CNCCO3)cc2)c1 ZINC000849353080 633627025 /nfs/dbraw/zinc/62/70/25/633627025.db2.gz YEWWPSIWYADSON-SFHVURJKSA-N 0 3 298.386 2.974 20 10 CFCDHN Oc1ccccc1CNc1ccc([C@@H]2CNCCO2)cc1 ZINC000849351864 633627193 /nfs/dbraw/zinc/62/71/93/633627193.db2.gz DGYIXAKBHGKBDT-KRWDZBQOSA-N 0 3 284.359 2.665 20 10 CFCDHN Cn1cc(C[C@H]2CCC[C@H]2[NH2+]Cc2ccccc2[O-])cn1 ZINC000850383975 633970077 /nfs/dbraw/zinc/97/00/77/633970077.db2.gz GLEGMIYMSMQHFW-GDBMZVCRSA-N 0 3 285.391 2.627 20 10 CFCDHN Cc1ccc(O)c(CNCc2c(C(F)(F)F)cnn2C)c1 ZINC000858211048 636156501 /nfs/dbraw/zinc/15/65/01/636156501.db2.gz JAHVHAVSVHCEHT-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cn1ncc(C2CC2)c1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000850535155 634040727 /nfs/dbraw/zinc/04/07/27/634040727.db2.gz SBCVIURSUQGHGD-CQSZACIVSA-N 0 3 283.375 2.780 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)CC2CC2)c([O-])c1 ZINC000850546428 634047132 /nfs/dbraw/zinc/04/71/32/634047132.db2.gz ZQJLGNPEWNDVQN-OCCSQVGLSA-N 0 3 263.381 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](O)C23CCC3)c([O-])c1 ZINC000850548257 634048838 /nfs/dbraw/zinc/04/88/38/634048838.db2.gz ZTNDTSFGNGWDDL-TUKIKUTGSA-N 0 3 261.365 2.655 20 10 CFCDHN Cc1ccc(O)c(CNCc2cn(C)nc2C(F)F)c1 ZINC000858239878 636161311 /nfs/dbraw/zinc/16/13/11/636161311.db2.gz VMQXTFULIYLEHO-UHFFFAOYSA-N 0 3 281.306 2.662 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+]Cc1c([O-])cccc1Cl ZINC000113333630 635554352 /nfs/dbraw/zinc/55/43/52/635554352.db2.gz SZCUHYVPWCDIGL-LLVKDONJSA-N 0 3 270.804 2.866 20 10 CFCDHN CC[C@@H](C)[C@@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135071 636135652 /nfs/dbraw/zinc/13/56/52/636135652.db2.gz LLTROYYQENCGDY-BMIGLBTASA-N 0 3 286.366 2.527 20 10 CFCDHN CC(C)[C@@](C)(CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858166023 636146461 /nfs/dbraw/zinc/14/64/61/636146461.db2.gz WSHBZZAMRVXOJT-OAHLLOKOSA-N 0 3 286.366 2.527 20 10 CFCDHN C/C=C\C[NH2+]Cc1cc(Br)cc(OC)c1[O-] ZINC000858290772 636177567 /nfs/dbraw/zinc/17/75/67/636177567.db2.gz HFSFVCLCNVJLJB-ARJAWSKDSA-N 0 3 286.169 2.829 20 10 CFCDHN COC(=O)C1=CC[C@@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000858475048 636262893 /nfs/dbraw/zinc/26/28/93/636262893.db2.gz XAWWLKYVDZGOQP-DGCLKSJQSA-N 0 3 275.348 2.613 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCCN1CC(F)F)CC2 ZINC000858479237 636264480 /nfs/dbraw/zinc/26/44/80/636264480.db2.gz MGGBDZAROSKWNY-QWHCGFSZSA-N 0 3 296.361 2.699 20 10 CFCDHN CCOC(C)(C)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000159293949 650254262 /nfs/dbraw/zinc/25/42/62/650254262.db2.gz PDRAQHICIXPZOZ-JTQLQIEISA-N 0 3 255.333 2.997 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)[C@H]2CC[C@H](O)CC2)cc1F ZINC000862336868 637323693 /nfs/dbraw/zinc/32/36/93/637323693.db2.gz MSZAMMVXKVVPEB-JOCQHMNTSA-N 0 3 298.377 2.766 20 10 CFCDHN CC[N@H+](CCNC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000862468781 637394390 /nfs/dbraw/zinc/39/43/90/637394390.db2.gz OILNXMNVYLKQGK-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN CC[N@@H+](CCNC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000862468781 637394393 /nfs/dbraw/zinc/39/43/93/637394393.db2.gz OILNXMNVYLKQGK-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473025 637396238 /nfs/dbraw/zinc/39/62/38/637396238.db2.gz ARZSQWWYZFBQIC-NEPJUHHUSA-N 0 3 279.405 2.871 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473025 637396247 /nfs/dbraw/zinc/39/62/47/637396247.db2.gz ARZSQWWYZFBQIC-NEPJUHHUSA-N 0 3 279.405 2.871 20 10 CFCDHN CN(C)c1ccc(C[NH2+]Cc2ccc([O-])c(F)c2)cc1 ZINC000120479038 638249749 /nfs/dbraw/zinc/24/97/49/638249749.db2.gz NEEZLEDAFUDWCJ-UHFFFAOYSA-N 0 3 274.339 2.887 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CCC1)[C@H]1CCCO1 ZINC000865735604 638543639 /nfs/dbraw/zinc/54/36/39/638543639.db2.gz RNUIDCONRNPLQH-HZPDHXFCSA-N 0 3 261.365 2.830 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CC(C)(C)CC[C@H]1O)c1ccccc1[O-] ZINC000866452612 638824816 /nfs/dbraw/zinc/82/48/16/638824816.db2.gz KRCUMMBUBMDLQE-UXIGCNINSA-N 0 3 263.381 2.982 20 10 CFCDHN COc1cccc([C@H](C)NCc2ccnc(F)c2)c1O ZINC000866474878 638827100 /nfs/dbraw/zinc/82/71/00/638827100.db2.gz OXZUAPOBJCDLAB-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866489461 638829952 /nfs/dbraw/zinc/82/99/52/638829952.db2.gz OBUFMYOSWUTKKO-QTKMDUPCSA-N 0 3 265.328 2.583 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])c1ccnn1C ZINC000866612613 638854244 /nfs/dbraw/zinc/85/42/44/638854244.db2.gz ACKVCSJFEHFEHJ-VHSXEESVSA-N 0 3 263.316 2.677 20 10 CFCDHN Cc1ccccc1C[C@@H](CO)[NH2+]Cc1cc(F)ccc1[O-] ZINC000191671767 650516266 /nfs/dbraw/zinc/51/62/66/650516266.db2.gz MGXXSTVCGLIQDP-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H](NCc1ccc(N2CCCC2)cc1)c1ccnn1C ZINC000192661693 650582551 /nfs/dbraw/zinc/58/25/51/650582551.db2.gz ZUTDDJVDMLOUSE-AWEZNQCLSA-N 0 3 284.407 2.871 20 10 CFCDHN COC(OC)[C@H](C)NCc1ccc(N2CCCCC2)cc1 ZINC000079584946 650605961 /nfs/dbraw/zinc/60/59/61/650605961.db2.gz CGRRNHOANSDEFB-AWEZNQCLSA-N 0 3 292.423 2.774 20 10 CFCDHN C[C@H]([NH2+]CCn1ccc(C(F)(F)F)n1)c1ccccc1[O-] ZINC000872111002 641641976 /nfs/dbraw/zinc/64/19/76/641641976.db2.gz WMTSNPKOWHYSMV-JTQLQIEISA-N 0 3 299.296 2.958 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCO[C@@H](C(F)F)CC1 ZINC000872254339 641719515 /nfs/dbraw/zinc/71/95/15/641719515.db2.gz ZXJRZMKBIIHGRT-OAHLLOKOSA-N 0 3 298.377 2.917 20 10 CFCDHN Cc1ccc(O)c(CN2CCN(C)c3ncccc3C2)c1 ZINC000872265322 641726000 /nfs/dbraw/zinc/72/60/00/641726000.db2.gz NYJQLMPTEIMBEL-UHFFFAOYSA-N 0 3 283.375 2.548 20 10 CFCDHN Cc1cc(CN2CCO[C@@H](C(F)F)CC2)ccc1N(C)C ZINC000872273365 641732376 /nfs/dbraw/zinc/73/23/76/641732376.db2.gz ZKHCLTXUULVUJG-OAHLLOKOSA-N 0 3 298.377 2.917 20 10 CFCDHN CCCOc1ccc(CN[C@H](CO)CC(F)F)cc1C ZINC000873114385 642015796 /nfs/dbraw/zinc/01/57/96/642015796.db2.gz DEBRWDOFECGOTE-ZDUSSCGKSA-N 0 3 287.350 2.890 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H](C)c2nccnc2C)c1 ZINC000873189433 642057579 /nfs/dbraw/zinc/05/75/79/642057579.db2.gz PCMYIMMQZWJLQM-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1ccccc1 ZINC000873193646 642058693 /nfs/dbraw/zinc/05/86/93/642058693.db2.gz NGJWJQJIRMOPHS-WBVHZDCISA-N 0 3 271.360 2.994 20 10 CFCDHN Cc1cc(O)c(CN2CCOc3cc(N)ccc3C2)cc1C ZINC000873219816 642072923 /nfs/dbraw/zinc/07/29/23/642072923.db2.gz OQCVSISULIHZFX-UHFFFAOYSA-N 0 3 298.386 2.986 20 10 CFCDHN CC(C)[C@H](C)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000081045626 650720253 /nfs/dbraw/zinc/72/02/53/650720253.db2.gz JYMDLKOHMJLPHH-SNVBAGLBSA-N 0 3 251.326 2.503 20 10 CFCDHN COc1cccc(CNCc2ccccc2F)c1O ZINC000019949999 642237362 /nfs/dbraw/zinc/23/73/62/642237362.db2.gz LVFOHJZTOGUEKA-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1COc2ccccc2O1)c1ccccc1[O-] ZINC000020137841 642305891 /nfs/dbraw/zinc/30/58/91/642305891.db2.gz SDGZRMCCNWAJHV-STQMWFEESA-N 0 3 285.343 2.883 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000876739791 642987967 /nfs/dbraw/zinc/98/79/67/642987967.db2.gz QOZFMJMDDIEKFS-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000876739791 642987969 /nfs/dbraw/zinc/98/79/69/642987969.db2.gz QOZFMJMDDIEKFS-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(CN2CCOC3(CCCC3)C2)c(O)c1 ZINC000876760252 642998316 /nfs/dbraw/zinc/99/83/16/642998316.db2.gz OZROGRWXNJQGRA-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(N(C)CC(F)F)CC1 ZINC000876777103 643006326 /nfs/dbraw/zinc/00/63/26/643006326.db2.gz UWUIOBZANQTZBN-UHFFFAOYSA-N 0 3 298.377 2.862 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCc1nccs1 ZINC000876790516 643010200 /nfs/dbraw/zinc/01/02/00/643010200.db2.gz LKTHSINOSDOUPB-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCc1nccs1 ZINC000876790516 643010208 /nfs/dbraw/zinc/01/02/08/643010208.db2.gz LKTHSINOSDOUPB-UHFFFAOYSA-N 0 3 262.378 2.832 20 10 CFCDHN COc1ccccc1OCC[NH2+]Cc1ccc(C)cc1[O-] ZINC000876881758 643048108 /nfs/dbraw/zinc/04/81/08/643048108.db2.gz ONQYFNXSWWWEHV-UHFFFAOYSA-N 0 3 287.359 2.878 20 10 CFCDHN Cc1nc(CC[NH2+]Cc2c(C)cccc2[O-])cs1 ZINC000876923470 643066440 /nfs/dbraw/zinc/06/64/40/643066440.db2.gz CHSPEVUQAXEKHS-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN C[C@@H](C[NH2+]Cc1ccc(F)c(F)c1[O-])CN1CCCCC1 ZINC000876949315 643076126 /nfs/dbraw/zinc/07/61/26/643076126.db2.gz UZJOOXGHSNBZOF-LBPRGKRZSA-N 0 3 298.377 2.882 20 10 CFCDHN COc1cccc(C)c1C[NH2+]Cc1ccccc1[O-] ZINC000876996542 643098134 /nfs/dbraw/zinc/09/81/34/643098134.db2.gz ZDTYIDJEGZDHAO-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)C2CCCCC2)c([O-])c1 ZINC000877005520 643101777 /nfs/dbraw/zinc/10/17/77/643101777.db2.gz SLNZKQQEEFPBIL-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CC(C)C)CN(C)C)c([O-])c1 ZINC000877018179 643106360 /nfs/dbraw/zinc/10/63/60/643106360.db2.gz ZRBYLGKPVUHTHA-HNNXBMFYSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(CCO)CCCC1 ZINC000877067150 643131271 /nfs/dbraw/zinc/13/12/71/643131271.db2.gz BNMDVFSIZMAPMV-UHFFFAOYSA-N 0 3 263.381 2.733 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CSCCS2)c([O-])c1 ZINC000877083590 643142486 /nfs/dbraw/zinc/14/24/86/643142486.db2.gz AURMNMAAGHMMNH-GFCCVEGCSA-N 0 3 269.435 2.639 20 10 CFCDHN CCC1(O)CCC([NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000877135185 643170622 /nfs/dbraw/zinc/17/06/22/643170622.db2.gz SHXNNSOPEMBJJP-UHFFFAOYSA-N 0 3 263.381 2.874 20 10 CFCDHN Cc1ccc(CN[C@H](CCO)c2ccco2)c(O)c1 ZINC000877400192 643259814 /nfs/dbraw/zinc/25/98/14/643259814.db2.gz VEHTXNDXXWLTQT-CYBMUJFWSA-N 0 3 261.321 2.507 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000877479062 643295549 /nfs/dbraw/zinc/29/55/49/643295549.db2.gz RCEYMTJIZMMSEO-OAHLLOKOSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](C)NC(=O)OC(C)(C)C ZINC000877487260 643302413 /nfs/dbraw/zinc/30/24/13/643302413.db2.gz ROPUMJIFTPSLCA-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000877525918 643329813 /nfs/dbraw/zinc/32/98/13/643329813.db2.gz BTSUVKSZOQAXBA-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@]1(C)CCCO ZINC000877529281 643333098 /nfs/dbraw/zinc/33/30/98/643333098.db2.gz YFALRHDLGPOMLW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@]1(C)CCCO ZINC000877529281 643333102 /nfs/dbraw/zinc/33/31/02/643333102.db2.gz YFALRHDLGPOMLW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN COc1ncc(CN[C@@H](C)c2cc(OC)ccc2O)s1 ZINC000877532047 643334521 /nfs/dbraw/zinc/33/45/21/643334521.db2.gz CBPSGOIKJUZMRJ-VIFPVBQESA-N 0 3 294.376 2.717 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCCSC2)c([O-])c1 ZINC000877532889 643336864 /nfs/dbraw/zinc/33/68/64/643336864.db2.gz KOOIANYBSBHJKZ-GFCCVEGCSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)c([O-])c1 ZINC000877540287 643342625 /nfs/dbraw/zinc/34/26/25/643342625.db2.gz VLAKWTDZTSNZIS-PKOBYXMFSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc(CN2CC[C@H](n3cc(Cl)cn3)C2)c(O)c1 ZINC000877541252 643344288 /nfs/dbraw/zinc/34/42/88/643344288.db2.gz FFQFBAIQGFCJBS-AWEZNQCLSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000877573789 643372032 /nfs/dbraw/zinc/37/20/32/643372032.db2.gz UZYMIRWGFSBYIK-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000877573789 643372036 /nfs/dbraw/zinc/37/20/36/643372036.db2.gz UZYMIRWGFSBYIK-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c([O-])c1 ZINC000877575867 643374540 /nfs/dbraw/zinc/37/45/40/643374540.db2.gz BIXSSFNQPHNHIE-KGLIPLIRSA-N 0 3 261.365 2.557 20 10 CFCDHN Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c([O-])c1 ZINC000877575867 643374541 /nfs/dbraw/zinc/37/45/41/643374541.db2.gz BIXSSFNQPHNHIE-KGLIPLIRSA-N 0 3 261.365 2.557 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605821 643392899 /nfs/dbraw/zinc/39/28/99/643392899.db2.gz JYVRZIWVBYLBCX-FZMZJTMJSA-N 0 3 251.370 2.587 20 10 CFCDHN CCC[C@@H](C)[C@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877609990 643397156 /nfs/dbraw/zinc/39/71/56/643397156.db2.gz GEAVWORPZVAXBJ-OCCSQVGLSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCCc3c2ccc(=O)n3C)c([O-])c1 ZINC000877617679 643403442 /nfs/dbraw/zinc/40/34/42/643403442.db2.gz ZPOVHELGHQFHJE-OAHLLOKOSA-N 0 3 298.386 2.567 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(O)CCC(F)(F)CC1 ZINC000877636812 643421373 /nfs/dbraw/zinc/42/13/73/643421373.db2.gz IXTHFMWINFVHCH-UHFFFAOYSA-N 0 3 285.334 2.731 20 10 CFCDHN CC1(NCc2ccc(OCc3ccccc3)cc2O)COC1 ZINC000877691704 643458264 /nfs/dbraw/zinc/45/82/64/643458264.db2.gz SVUHGRDIXYWUOY-UHFFFAOYSA-N 0 3 299.370 2.850 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H](O)C(F)(F)F)c1[O-] ZINC000877693599 643458970 /nfs/dbraw/zinc/45/89/70/643458970.db2.gz LTBKYXQZJPSPIS-CPCISQLKSA-N 0 3 297.704 2.755 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCC23CCOCC3)c([O-])c1 ZINC000877729112 643489803 /nfs/dbraw/zinc/48/98/03/643489803.db2.gz XQFAMIMMLQRXAP-HNNXBMFYSA-N 0 3 275.392 2.997 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877736348 643495655 /nfs/dbraw/zinc/49/56/55/643495655.db2.gz WASIYRFIGNWHEX-KBPBESRZSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877736348 643495659 /nfs/dbraw/zinc/49/56/59/643495659.db2.gz WASIYRFIGNWHEX-KBPBESRZSA-N 0 3 263.406 2.886 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877739576 643505397 /nfs/dbraw/zinc/50/53/97/643505397.db2.gz OJYWMKYUUAODLO-VXGBXAGGSA-N 0 3 279.405 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877739576 643505401 /nfs/dbraw/zinc/50/54/01/643505401.db2.gz OJYWMKYUUAODLO-VXGBXAGGSA-N 0 3 279.405 2.586 20 10 CFCDHN C[N@@H+]1CC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000877744371 643524012 /nfs/dbraw/zinc/52/40/12/643524012.db2.gz RZMMZRHVNVUNAT-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000877744371 643524019 /nfs/dbraw/zinc/52/40/19/643524019.db2.gz RZMMZRHVNVUNAT-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CCc1ncc(C[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000877758199 643538146 /nfs/dbraw/zinc/53/81/46/643538146.db2.gz MMKYGFIIMLYTRZ-NSHDSACASA-N 0 3 257.337 2.595 20 10 CFCDHN COc1cncc(C[NH2+][C@@H](C)c2ccccc2[O-])c1C ZINC000877758339 643539172 /nfs/dbraw/zinc/53/91/72/643539172.db2.gz UAUVVXJOMMULQV-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN C[C@H](NCc1cc(C(F)(F)F)n[nH]1)c1ccccc1O ZINC000877758281 643539237 /nfs/dbraw/zinc/53/92/37/643539237.db2.gz QWIPFBQUSHOWRK-QMMMGPOBSA-N 0 3 285.269 2.985 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(C(F)(F)F)n[nH]1)c1ccccc1[O-] ZINC000877758281 643539244 /nfs/dbraw/zinc/53/92/44/643539244.db2.gz QWIPFBQUSHOWRK-QMMMGPOBSA-N 0 3 285.269 2.985 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](C(C)(C)O)C2)c([O-])c1 ZINC000877795223 643561482 /nfs/dbraw/zinc/56/14/82/643561482.db2.gz CILXODOMMGNNMM-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](C(C)(C)O)C2)c([O-])c1 ZINC000877795223 643561488 /nfs/dbraw/zinc/56/14/88/643561488.db2.gz CILXODOMMGNNMM-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN CC(C)(O)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877796577 643563510 /nfs/dbraw/zinc/56/35/10/643563510.db2.gz JHWMJUBXVCWODC-LBPRGKRZSA-N 0 3 267.344 2.514 20 10 CFCDHN CC(C)(O)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877796577 643563520 /nfs/dbraw/zinc/56/35/20/643563520.db2.gz JHWMJUBXVCWODC-LBPRGKRZSA-N 0 3 267.344 2.514 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](C(C)(C)O)C2)c([O-])c1 ZINC000877797177 643564094 /nfs/dbraw/zinc/56/40/94/643564094.db2.gz PSHFDLYOYCXKGT-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](C(C)(C)O)C2)c([O-])c1 ZINC000877797177 643564104 /nfs/dbraw/zinc/56/41/04/643564104.db2.gz PSHFDLYOYCXKGT-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)NC1CCCCCC1)c1ccccc1[O-] ZINC000879648088 644361496 /nfs/dbraw/zinc/36/14/96/644361496.db2.gz YCQXQFKKXADKPI-CYBMUJFWSA-N 0 3 290.407 2.882 20 10 CFCDHN CC(C)C[C@@H](C)N(C)C(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651200 644364416 /nfs/dbraw/zinc/36/44/16/644364416.db2.gz MILSQKFANFJUQZ-KGLIPLIRSA-N 0 3 292.423 2.936 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)N1CCC(C)CC1 ZINC000879653503 644366110 /nfs/dbraw/zinc/36/61/10/644366110.db2.gz QQILMRMDMSKPOD-UONOGXRCSA-N 0 3 290.407 2.690 20 10 CFCDHN Cc1nccn1CCCC[N@@H+](C)Cc1ccccc1[O-] ZINC000128393604 644681839 /nfs/dbraw/zinc/68/18/39/644681839.db2.gz UNUSFUOUHYVPET-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN Cc1nccn1CCCC[N@H+](C)Cc1ccccc1[O-] ZINC000128393604 644681843 /nfs/dbraw/zinc/68/18/43/644681843.db2.gz UNUSFUOUHYVPET-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN CC(C)N(C)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618108 650960337 /nfs/dbraw/zinc/96/03/37/650960337.db2.gz VVDVDBWVJCPQOP-LLVKDONJSA-N 0 3 254.349 2.522 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH+]1CCN(C2CC2)CC1 ZINC000129093726 645053210 /nfs/dbraw/zinc/05/32/10/645053210.db2.gz KVPNYBWSNTZNLI-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@@H]1c1cccnc1)OCO2 ZINC000024758593 645091271 /nfs/dbraw/zinc/09/12/71/645091271.db2.gz HVGGPNNJHVAQOK-CQSZACIVSA-N 0 3 298.342 2.853 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(C)CC(F)(F)C1 ZINC000883250376 645698480 /nfs/dbraw/zinc/69/84/80/645698480.db2.gz SLIPEJXABDMJJN-UHFFFAOYSA-N 0 3 271.307 2.926 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCN1CC)c1ccc(C)cc1[O-] ZINC000883354771 645759368 /nfs/dbraw/zinc/75/93/68/645759368.db2.gz BTOZLGAMTWVKIV-UKRRQHHQSA-N 0 3 262.397 2.836 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCC3(COC3)CC1)CC2 ZINC000883382904 645782800 /nfs/dbraw/zinc/78/28/00/645782800.db2.gz PMRSOLUFQPCDJA-CQSZACIVSA-N 0 3 273.376 2.928 20 10 CFCDHN CN(C)c1ccc(CN(C)C[C@@H]2CCCCO2)cc1F ZINC000131908875 645849416 /nfs/dbraw/zinc/84/94/16/645849416.db2.gz ITLZEASVQFYZAC-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN C[C@H](NCCCSc1nccs1)c1cnccn1 ZINC000132221114 645896387 /nfs/dbraw/zinc/89/63/87/645896387.db2.gz ONQNNYDIISFKOU-JTQLQIEISA-N 0 3 280.422 2.766 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504302 647021878 /nfs/dbraw/zinc/02/18/78/647021878.db2.gz ZSSZFXGRVKZPLO-UBHSHLNASA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504302 647021882 /nfs/dbraw/zinc/02/18/82/647021882.db2.gz ZSSZFXGRVKZPLO-UBHSHLNASA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504302 647021887 /nfs/dbraw/zinc/02/18/87/647021887.db2.gz ZSSZFXGRVKZPLO-UBHSHLNASA-N 0 3 278.371 2.809 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1ccccc1[O-])c1cnn(C)c1 ZINC000886520374 647027031 /nfs/dbraw/zinc/02/70/31/647027031.db2.gz CONPQAWDEIRXSH-HNNXBMFYSA-N 0 3 259.353 2.613 20 10 CFCDHN COc1cc([C@@H](C)NCCCSc2nccs2)on1 ZINC000925103404 648105717 /nfs/dbraw/zinc/10/57/17/648105717.db2.gz QIQVPSVGSQBUTR-SECBINFHSA-N 0 3 299.421 2.973 20 10 CFCDHN [O-]c1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1CNOC1 ZINC000925869688 648350044 /nfs/dbraw/zinc/35/00/44/648350044.db2.gz OUXMQYBPSJFZDV-RDJZCZTQSA-N 0 3 298.386 2.559 20 10 CFCDHN CC[C@H]([NH2+]CC1CC2(C1)OCCO2)c1ccccc1[O-] ZINC000927000764 648678425 /nfs/dbraw/zinc/67/84/25/648678425.db2.gz JMNQSUWXTGZFBO-AWEZNQCLSA-N 0 3 277.364 2.586 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC2CCOCC2)c([O-])c1 ZINC000927078124 648700736 /nfs/dbraw/zinc/70/07/36/648700736.db2.gz FKQGWEVQEQQAJA-ZDUSSCGKSA-N 0 3 279.380 2.547 20 10 CFCDHN COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H](C)C1 ZINC000933170916 649677376 /nfs/dbraw/zinc/67/73/76/649677376.db2.gz XIJXNQVSEMKAQS-UKRRQHHQSA-N 0 3 290.407 2.526 20 10 CFCDHN CC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000119866544 651301351 /nfs/dbraw/zinc/30/13/51/651301351.db2.gz FEXSWMIHXXCZAT-MELADBBJSA-N 0 3 291.439 2.706 20 10 CFCDHN CC1(C)OCC[C@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000693070700 770216226 /nfs/dbraw/zinc/21/62/26/770216226.db2.gz IIEOUQWRCVMBGG-QWHCGFSZSA-N 0 3 261.365 2.784 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@H]2COCC[C@H]2C1 ZINC000723660887 770642833 /nfs/dbraw/zinc/64/28/33/770642833.db2.gz RAHKURLKUZVHTI-AEGPPILISA-N 0 3 261.365 2.687 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CC1)[C@@H]1CCCOC1 ZINC000723977261 770730819 /nfs/dbraw/zinc/73/08/19/770730819.db2.gz KIKUWHSLYRWQQK-GDBMZVCRSA-N 0 3 261.365 2.687 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccns2)c1 ZINC000404377403 773227219 /nfs/dbraw/zinc/22/72/19/773227219.db2.gz KGKUOJPCIQEPML-SECBINFHSA-N 0 3 264.350 2.708 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CCO)C1CCCC1)c1ccccc1[O-] ZINC000725105315 775273081 /nfs/dbraw/zinc/27/30/81/775273081.db2.gz UBIIWDIHWQUVSN-DOMZBBRYSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](CCO)C2CCCC2)c1 ZINC000725102542 775273724 /nfs/dbraw/zinc/27/37/24/775273724.db2.gz CWJKKPZZRXSICC-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H]3OCC[C@@H]3C2)c1[O-] ZINC000724814578 775360131 /nfs/dbraw/zinc/36/01/31/775360131.db2.gz ROUHLDMEZNCYLV-ZWNOBZJWSA-N 0 3 297.782 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H]3OCC[C@@H]3C2)c1[O-] ZINC000724814578 775360141 /nfs/dbraw/zinc/36/01/41/775360141.db2.gz ROUHLDMEZNCYLV-ZWNOBZJWSA-N 0 3 297.782 2.665 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C[C@H](C)O1 ZINC000694800641 775579077 /nfs/dbraw/zinc/57/90/77/775579077.db2.gz MSCMZBDKGPDBHT-XCCSTKFXSA-N 0 3 261.365 2.925 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001140948663 775687317 /nfs/dbraw/zinc/68/73/17/775687317.db2.gz UDMNJKZXJDSBHZ-ZBFHGGJFSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001140948663 775687320 /nfs/dbraw/zinc/68/73/20/775687320.db2.gz UDMNJKZXJDSBHZ-ZBFHGGJFSA-N 0 3 261.365 2.702 20 10 CFCDHN CC(=O)N1CC[C@H]([N@@H+](Cc2ccc(C)cc2[O-])C(C)C)C1 ZINC001140957649 775710910 /nfs/dbraw/zinc/71/09/10/775710910.db2.gz HDSIOSMTAISMFA-INIZCTEOSA-N 0 3 290.407 2.532 20 10 CFCDHN CC(=O)N1CC[C@H]([N@H+](Cc2ccc(C)cc2[O-])C(C)C)C1 ZINC001140957649 775710919 /nfs/dbraw/zinc/71/09/19/775710919.db2.gz HDSIOSMTAISMFA-INIZCTEOSA-N 0 3 290.407 2.532 20 10 CFCDHN C[C@H]1CN(Cc2ccc(N)cc2)CCN1Cc1ccccc1 ZINC000396480655 775931456 /nfs/dbraw/zinc/93/14/56/775931456.db2.gz LIMVUJJDFKUSCT-INIZCTEOSA-N 0 3 295.430 2.975 20 10 CFCDHN Cc1cc(C)c(CNCc2ccc3c(c2)CCO3)cn1 ZINC000396997233 775977979 /nfs/dbraw/zinc/97/79/79/775977979.db2.gz XTNIFKHPRJMRTO-UHFFFAOYSA-N 0 3 268.360 2.923 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccccn1 ZINC000692769294 776152593 /nfs/dbraw/zinc/15/25/93/776152593.db2.gz PLRXILGASKGQGN-NSHDSACASA-N 0 3 260.312 2.820 20 10 CFCDHN C[N@H+](Cc1c[nH]c2cnccc12)Cc1ccccc1[O-] ZINC001231519765 777250154 /nfs/dbraw/zinc/25/01/54/777250154.db2.gz JILHDPYVNCPXCD-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1c[nH]c2cnccc12)Cc1ccccc1[O-] ZINC001231519765 777250162 /nfs/dbraw/zinc/25/01/62/777250162.db2.gz JILHDPYVNCPXCD-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH+]1CC2(C1)CCOC2 ZINC001231587508 777268388 /nfs/dbraw/zinc/26/83/88/777268388.db2.gz DMYKSESKDWFWIR-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H](F)C[C@@H](CO)C1 ZINC001231587361 777268643 /nfs/dbraw/zinc/26/86/43/777268643.db2.gz ACTACVPMPOARDA-TZMCWYRMSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H](F)C[C@@H](CO)C1 ZINC001231587361 777268649 /nfs/dbraw/zinc/26/86/49/777268649.db2.gz ACTACVPMPOARDA-TZMCWYRMSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCOC2(CC2)C1 ZINC001231590024 777269745 /nfs/dbraw/zinc/26/97/45/777269745.db2.gz YXNNBFCGCDMUKF-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCOC2(CC2)C1 ZINC001231590024 777269751 /nfs/dbraw/zinc/26/97/51/777269751.db2.gz YXNNBFCGCDMUKF-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN CC(=O)[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231590957 777271743 /nfs/dbraw/zinc/27/17/43/777271743.db2.gz ROUNNBJRXSXXKM-AWEZNQCLSA-N 0 3 269.344 2.956 20 10 CFCDHN CC(=O)[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231590957 777271751 /nfs/dbraw/zinc/27/17/51/777271751.db2.gz ROUNNBJRXSXXKM-AWEZNQCLSA-N 0 3 269.344 2.956 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC2(CCO2)CC1 ZINC001231855421 777352609 /nfs/dbraw/zinc/35/26/09/777352609.db2.gz SRDHGAAGTAMZNZ-UHFFFAOYSA-N 0 3 290.407 2.516 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C2CCN(C)CC2)cc1Cl ZINC001231869453 777359423 /nfs/dbraw/zinc/35/94/23/777359423.db2.gz RLZWNGQSTFOQOT-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C2CCN(C)CC2)cc1Cl ZINC001231869453 777359428 /nfs/dbraw/zinc/35/94/28/777359428.db2.gz RLZWNGQSTFOQOT-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN CC[N@H+](CCN(C)C)Cc1ccc2ccccc2c1[O-] ZINC001231878780 777363402 /nfs/dbraw/zinc/36/34/02/777363402.db2.gz SXVSBFVRVQVJJC-UHFFFAOYSA-N 0 3 272.392 2.929 20 10 CFCDHN CC[N@@H+](CCN(C)C)Cc1ccc2ccccc2c1[O-] ZINC001231878780 777363404 /nfs/dbraw/zinc/36/34/04/777363404.db2.gz SXVSBFVRVQVJJC-UHFFFAOYSA-N 0 3 272.392 2.929 20 10 CFCDHN CN(Cc1cc2ncccc2[nH]1)Cc1ccccc1O ZINC001232066251 777428863 /nfs/dbraw/zinc/42/88/63/777428863.db2.gz SBSTVMPJTUDBOV-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@H+](Cc1cc2ncccc2[nH]1)Cc1ccccc1[O-] ZINC001232066251 777428867 /nfs/dbraw/zinc/42/88/67/777428867.db2.gz SBSTVMPJTUDBOV-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1cc2ncccc2[nH]1)Cc1ccccc1[O-] ZINC001232066251 777428872 /nfs/dbraw/zinc/42/88/72/777428872.db2.gz SBSTVMPJTUDBOV-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN CN(C)c1ccc(C[N@@H+]2CCc3cccc([O-])c3C2)c(O)c1 ZINC001232840680 777690727 /nfs/dbraw/zinc/69/07/27/777690727.db2.gz GQEGWHQHIWXRBO-UHFFFAOYSA-N 0 3 298.386 2.722 20 10 CFCDHN CN(C)c1ccc(C[N@H+]2CCc3cccc([O-])c3C2)c(O)c1 ZINC001232840680 777690729 /nfs/dbraw/zinc/69/07/29/777690729.db2.gz GQEGWHQHIWXRBO-UHFFFAOYSA-N 0 3 298.386 2.722 20 10 CFCDHN COc1cc(Cl)cc(CN2CCCC3(COC3)C2)c1O ZINC001233287708 777870872 /nfs/dbraw/zinc/87/08/72/777870872.db2.gz DHNLTINEUKXQKJ-UHFFFAOYSA-N 0 3 297.782 2.667 20 10 CFCDHN C[C@@H]1CN(Cc2cccc(C(F)(F)F)c2[O-])CC[N@@H+]1C ZINC001233418369 777942547 /nfs/dbraw/zinc/94/25/47/777942547.db2.gz DJERPLNJKMPHOZ-SNVBAGLBSA-N 0 3 288.313 2.547 20 10 CFCDHN C[C@@H]1CN(Cc2cccc(C(F)(F)F)c2[O-])CC[N@H+]1C ZINC001233418369 777942549 /nfs/dbraw/zinc/94/25/49/777942549.db2.gz DJERPLNJKMPHOZ-SNVBAGLBSA-N 0 3 288.313 2.547 20 10 CFCDHN CCN1CCN(c2ccc(OC3CCC3)cc2)CC1 ZINC001234657967 778279543 /nfs/dbraw/zinc/27/95/43/778279543.db2.gz OKCNCIJLNCYUGO-UHFFFAOYSA-N 0 3 260.381 2.760 20 10 CFCDHN CCN1CCN(c2ccc(OCC[C@@H](C)OC)cc2)CC1 ZINC001234658303 778279669 /nfs/dbraw/zinc/27/96/69/778279669.db2.gz ZPFXTYHPDWLWPA-OAHLLOKOSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CCCC[C@]12CC[NH2+]C2 ZINC001235122442 778391032 /nfs/dbraw/zinc/39/10/32/778391032.db2.gz UTIHUYHXZHJJFO-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN CC[N@H+](CCN1CCCCC1)Cc1cc(F)c(F)cc1[O-] ZINC001142527485 778402505 /nfs/dbraw/zinc/40/25/05/778402505.db2.gz WNZKPQYYUBJFIL-UHFFFAOYSA-N 0 3 298.377 2.978 20 10 CFCDHN CC[N@@H+](CCN1CCCCC1)Cc1cc(F)c(F)cc1[O-] ZINC001142527485 778402509 /nfs/dbraw/zinc/40/25/09/778402509.db2.gz WNZKPQYYUBJFIL-UHFFFAOYSA-N 0 3 298.377 2.978 20 10 CFCDHN CC(C)[C@@H]1CNCC[N@@H+]1Cc1ccc2ccccc2c1[O-] ZINC001235458912 778497580 /nfs/dbraw/zinc/49/75/80/778497580.db2.gz UXHUGZKDAPIGKK-KRWDZBQOSA-N 0 3 284.403 2.975 20 10 CFCDHN CC(C)[C@@H]1CNCC[N@H+]1Cc1ccc2ccccc2c1[O-] ZINC001235458912 778497584 /nfs/dbraw/zinc/49/75/84/778497584.db2.gz UXHUGZKDAPIGKK-KRWDZBQOSA-N 0 3 284.403 2.975 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](F)[C@@H](O)C2)c([O-])c1 ZINC001235674961 778533134 /nfs/dbraw/zinc/53/31/34/778533134.db2.gz JTTJYTPPLQNCGZ-HIFRSBDPSA-N 0 3 281.371 2.594 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@@H](O)C2)c([O-])c1 ZINC001235674961 778533138 /nfs/dbraw/zinc/53/31/38/778533138.db2.gz JTTJYTPPLQNCGZ-HIFRSBDPSA-N 0 3 281.371 2.594 20 10 CFCDHN C[N@H+](Cc1ccc(C(C)(C)C)cc1[O-])[C@H]1CCOC1 ZINC001235680243 778534302 /nfs/dbraw/zinc/53/43/02/778534302.db2.gz KJGWLLFMVHMWTH-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN C[N@@H+](Cc1ccc(C(C)(C)C)cc1[O-])[C@H]1CCOC1 ZINC001235680243 778534305 /nfs/dbraw/zinc/53/43/05/778534305.db2.gz KJGWLLFMVHMWTH-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]([NH3+])CC[C@@H]2C)cc1Cl ZINC001235905568 778603692 /nfs/dbraw/zinc/60/36/92/778603692.db2.gz MQMANCKRHVVIEM-CMPLNLGQSA-N 0 3 268.788 2.666 20 10 CFCDHN CC(C)CN(Cc1cc(F)c(F)cc1[O-])[C@@H]1CCC[NH2+]C1 ZINC001236477769 778843569 /nfs/dbraw/zinc/84/35/69/778843569.db2.gz LWRCVPNHECNZFX-CYBMUJFWSA-N 0 3 298.377 2.880 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(CCOC3)CC2)c([O-])c1 ZINC001236783594 778934777 /nfs/dbraw/zinc/93/47/77/778934777.db2.gz MRHLRXVKRNYCKF-UHFFFAOYSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(CN(C)Cc2cccnc2)c(O)c1 ZINC001236783380 778934860 /nfs/dbraw/zinc/93/48/60/778934860.db2.gz LACXMZIFDZYBPU-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236785628 778935738 /nfs/dbraw/zinc/93/57/38/778935738.db2.gz LLAOAKHIGROFES-QGZVFWFLSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([O-])c1 ZINC001236785628 778935742 /nfs/dbraw/zinc/93/57/42/778935742.db2.gz LLAOAKHIGROFES-QGZVFWFLSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(CC(=O)OC)CC2)c([O-])c1 ZINC001236786822 778937291 /nfs/dbraw/zinc/93/72/91/778937291.db2.gz PRLALDGUKCAOPY-UHFFFAOYSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)CC(C)(C)O)c([O-])c1 ZINC001236792989 778938919 /nfs/dbraw/zinc/93/89/19/778938919.db2.gz UWIFFUZDCQDIJL-UHFFFAOYSA-N 0 3 251.370 2.547 20 10 CFCDHN CCc1ccc(C[N@H+](CC)CC(C)(C)O)c([O-])c1 ZINC001236792989 778938924 /nfs/dbraw/zinc/93/89/24/778938924.db2.gz UWIFFUZDCQDIJL-UHFFFAOYSA-N 0 3 251.370 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](CCC(=O)OC)C2)c([O-])c1 ZINC001236795079 778940625 /nfs/dbraw/zinc/94/06/25/778940625.db2.gz QUDRYAMUFRHRDN-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](CCC(=O)OC)C2)c([O-])c1 ZINC001236795079 778940632 /nfs/dbraw/zinc/94/06/32/778940632.db2.gz QUDRYAMUFRHRDN-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CN(Cc1cc(Cl)c(Cl)cc1[O-])[C@@H]1CC[N@H+](C)C1 ZINC001236795153 778941586 /nfs/dbraw/zinc/94/15/86/778941586.db2.gz BBYBFMDQOLTYQY-SNVBAGLBSA-N 0 3 289.206 2.835 20 10 CFCDHN CN(Cc1cc(Cl)c(Cl)cc1[O-])[C@@H]1CC[N@@H+](C)C1 ZINC001236795153 778941591 /nfs/dbraw/zinc/94/15/91/778941591.db2.gz BBYBFMDQOLTYQY-SNVBAGLBSA-N 0 3 289.206 2.835 20 10 CFCDHN COc1cc(C)c(C[NH+]2C[C@H]3CCC[C@@H]3C2)c([O-])c1 ZINC001236818255 778951723 /nfs/dbraw/zinc/95/17/23/778951723.db2.gz JVCZTHZVDWITRG-CHWSQXEVSA-N 0 3 261.365 2.941 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236825729 778954947 /nfs/dbraw/zinc/95/49/47/778954947.db2.gz FAYXLGDUBFSFBK-OAHLLOKOSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236825729 778954953 /nfs/dbraw/zinc/95/49/53/778954953.db2.gz FAYXLGDUBFSFBK-OAHLLOKOSA-N 0 3 299.370 2.930 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@H]1CO ZINC001236826464 778955358 /nfs/dbraw/zinc/95/53/58/778955358.db2.gz KFQLXLAAYZTGSJ-HNNXBMFYSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@H]1CO ZINC001236826464 778955359 /nfs/dbraw/zinc/95/53/59/778955359.db2.gz KFQLXLAAYZTGSJ-HNNXBMFYSA-N 0 3 257.333 2.502 20 10 CFCDHN C[N@H+](Cc1cc2ccccc2cc1[O-])[C@@H]1CCOC1 ZINC001236839288 778961998 /nfs/dbraw/zinc/96/19/98/778961998.db2.gz FJUWDGOIWIRQNT-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN C[N@@H+](Cc1cc2ccccc2cc1[O-])[C@@H]1CCOC1 ZINC001236839288 778962000 /nfs/dbraw/zinc/96/20/00/778962000.db2.gz FJUWDGOIWIRQNT-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN Clc1cc(N2CCOCC2)ccc1CN1CCCC1 ZINC001236930265 778982886 /nfs/dbraw/zinc/98/28/86/778982886.db2.gz ZAIJCTDFPFHLCI-UHFFFAOYSA-N 0 3 280.799 2.772 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@]3(CCO3)C2)c([O-])c1 ZINC001237044835 778997199 /nfs/dbraw/zinc/99/71/99/778997199.db2.gz VBUILSVQCDMRFL-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@]3(CCO3)C2)c([O-])c1 ZINC001237044835 778997202 /nfs/dbraw/zinc/99/72/02/778997202.db2.gz VBUILSVQCDMRFL-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CC(C3COC3)C2)c([O-])c1 ZINC001237045377 778997248 /nfs/dbraw/zinc/99/72/48/778997248.db2.gz JPUUCPXVVQCMCG-UHFFFAOYSA-N 0 3 261.365 2.594 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC001237044601 778997582 /nfs/dbraw/zinc/99/75/82/778997582.db2.gz QBPDGRVILPQHKC-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC001237044601 778997586 /nfs/dbraw/zinc/99/75/86/778997586.db2.gz QBPDGRVILPQHKC-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@@H](CO)C2)c([O-])c1 ZINC001237048454 778998375 /nfs/dbraw/zinc/99/83/75/778998375.db2.gz RXAWNWWNXYUBBX-CYBMUJFWSA-N 0 3 263.381 2.720 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@@H](CO)C2)c([O-])c1 ZINC001237048454 778998381 /nfs/dbraw/zinc/99/83/81/778998381.db2.gz RXAWNWWNXYUBBX-CYBMUJFWSA-N 0 3 263.381 2.720 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001237049474 778999785 /nfs/dbraw/zinc/99/97/85/778999785.db2.gz GLOSNRDHGIEQOH-DYVFJYSZSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001237049474 778999789 /nfs/dbraw/zinc/99/97/89/778999789.db2.gz GLOSNRDHGIEQOH-DYVFJYSZSA-N 0 3 291.391 2.792 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CCC3(CC2)OCCO3)c([O-])c1 ZINC001237052382 779000233 /nfs/dbraw/zinc/00/02/33/779000233.db2.gz WATJDIBVKWIMBY-UHFFFAOYSA-N 0 3 291.391 2.855 20 10 CFCDHN C[C@@H]1CC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237054243 779002518 /nfs/dbraw/zinc/00/25/18/779002518.db2.gz XOVBWVNEOGOZFM-SECBINFHSA-N 0 3 275.270 2.928 20 10 CFCDHN C[C@@H]1CC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237054243 779002522 /nfs/dbraw/zinc/00/25/22/779002522.db2.gz XOVBWVNEOGOZFM-SECBINFHSA-N 0 3 275.270 2.928 20 10 CFCDHN Oc1ccc(F)c(Cl)c1CN1CC2(C1)CCOCC2 ZINC001237124487 779019492 /nfs/dbraw/zinc/01/94/92/779019492.db2.gz MILXLOKBJJFIAI-UHFFFAOYSA-N 0 3 285.746 2.797 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2CCCO[C@@H]2C1 ZINC001237484363 779118232 /nfs/dbraw/zinc/11/82/32/779118232.db2.gz CWTLAHFADOWTMK-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2CCCO[C@@H]2C1 ZINC001237484363 779118235 /nfs/dbraw/zinc/11/82/35/779118235.db2.gz CWTLAHFADOWTMK-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(n2cccn2)CC1 ZINC001237491161 779119568 /nfs/dbraw/zinc/11/95/68/779119568.db2.gz HXAHVERPCSMYKV-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN CN(C)CCC[N@H+](C)Cc1cc(F)cc(Cl)c1[O-] ZINC001237809574 779185453 /nfs/dbraw/zinc/18/54/53/779185453.db2.gz IIWZTAZVVVURMF-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CN(C)CCC[N@@H+](C)Cc1cc(F)cc(Cl)c1[O-] ZINC001237809574 779185459 /nfs/dbraw/zinc/18/54/59/779185459.db2.gz IIWZTAZVVVURMF-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN CC(=O)c1cc(F)cc(CN2CC[C@@H]3C[C@@H]3C2)c1O ZINC000699248770 779228395 /nfs/dbraw/zinc/22/83/95/779228395.db2.gz XGGXOHOUGQCCDH-GHMZBOCLSA-N 0 3 263.312 2.576 20 10 CFCDHN CCC[N@H+](CCOC)Cc1cc(F)cc(C)c1[O-] ZINC001238056313 779241040 /nfs/dbraw/zinc/24/10/40/779241040.db2.gz GTFVNFMFARVEHO-UHFFFAOYSA-N 0 3 255.333 2.698 20 10 CFCDHN CCC[N@@H+](CCOC)Cc1cc(F)cc(C)c1[O-] ZINC001238056313 779241044 /nfs/dbraw/zinc/24/10/44/779241044.db2.gz GTFVNFMFARVEHO-UHFFFAOYSA-N 0 3 255.333 2.698 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)CCc2ccccn2)c1[O-] ZINC001238056325 779241130 /nfs/dbraw/zinc/24/11/30/779241130.db2.gz GZIQHTJNFGTNPD-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)CCc2ccccn2)c1[O-] ZINC001238056325 779241135 /nfs/dbraw/zinc/24/11/35/779241135.db2.gz GZIQHTJNFGTNPD-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c1[O-] ZINC001238067309 779243684 /nfs/dbraw/zinc/24/36/84/779243684.db2.gz NTVBBVAIRSAGJT-AWEZNQCLSA-N 0 3 295.354 2.567 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)[C@H]2CCC3(C2)OCCO3)c1[O-] ZINC001238067309 779243689 /nfs/dbraw/zinc/24/36/89/779243689.db2.gz NTVBBVAIRSAGJT-AWEZNQCLSA-N 0 3 295.354 2.567 20 10 CFCDHN Cc1noc([C@H]2CC[N@H+](Cc3cc(F)cc(C)c3[O-])C2)n1 ZINC001238070841 779246930 /nfs/dbraw/zinc/24/69/30/779246930.db2.gz PYBZSFVDDDIVEX-NSHDSACASA-N 0 3 291.326 2.521 20 10 CFCDHN Cc1noc([C@H]2CC[N@@H+](Cc3cc(F)cc(C)c3[O-])C2)n1 ZINC001238070841 779246934 /nfs/dbraw/zinc/24/69/34/779246934.db2.gz PYBZSFVDDDIVEX-NSHDSACASA-N 0 3 291.326 2.521 20 10 CFCDHN CO[C@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238071518 779247023 /nfs/dbraw/zinc/24/70/23/779247023.db2.gz YTLIHYRQQIGTHO-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN CO[C@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238071518 779247026 /nfs/dbraw/zinc/24/70/26/779247026.db2.gz YTLIHYRQQIGTHO-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236213687 779502355 /nfs/dbraw/zinc/50/23/55/779502355.db2.gz AVPKNTHIBARGDD-STQMWFEESA-N 0 3 268.788 2.747 20 10 CFCDHN CO[C@@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238071521 779739524 /nfs/dbraw/zinc/73/95/24/779739524.db2.gz YTLIHYRQQIGTHO-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN CO[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238071521 779739529 /nfs/dbraw/zinc/73/95/29/779739529.db2.gz YTLIHYRQQIGTHO-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001203550303 780006723 /nfs/dbraw/zinc/00/67/23/780006723.db2.gz QTUXTLGVGARQHU-PWSUYJOCSA-N 0 3 253.292 2.869 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001203550303 780006728 /nfs/dbraw/zinc/00/67/28/780006728.db2.gz QTUXTLGVGARQHU-PWSUYJOCSA-N 0 3 253.292 2.869 20 10 CFCDHN Cc1cccc(CN2CCO[C@H](C(C)(C)C)C2)c1O ZINC000709000551 781286410 /nfs/dbraw/zinc/28/64/10/781286410.db2.gz OFMCHHNPSDTUAB-AWEZNQCLSA-N 0 3 263.381 2.948 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2ccns2)c1[O-] ZINC000709866992 781320715 /nfs/dbraw/zinc/32/07/15/781320715.db2.gz BQVUEMDGYIGSRY-UHFFFAOYSA-N 0 3 298.795 2.843 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1COC3(CCC3)C1)CC2 ZINC000711104170 781357541 /nfs/dbraw/zinc/35/75/41/781357541.db2.gz FOZUNGCKOCCSJM-CHWSQXEVSA-N 0 3 259.349 2.681 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1COC3(CCC3)C1)CC2 ZINC000711104175 781358058 /nfs/dbraw/zinc/35/80/58/781358058.db2.gz FOZUNGCKOCCSJM-STQMWFEESA-N 0 3 259.349 2.681 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)CCCCO)c([O-])c1 ZINC000295003873 199295438 /nfs/dbraw/zinc/29/54/38/199295438.db2.gz IUGWBPUCSNQFNO-ZDUSSCGKSA-N 0 3 281.396 2.822 20 10 CFCDHN CCOCc1cc(CNC[C@@H](OC)C(C)C)ccc1OC ZINC000072924476 346948580 /nfs/dbraw/zinc/94/85/80/346948580.db2.gz DUCXOFQVZLZCBM-QGZVFWFLSA-N 0 3 295.423 2.992 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](O)Cc2cccc(F)c2)c1[O-] ZINC000295088219 199339073 /nfs/dbraw/zinc/33/90/73/199339073.db2.gz IZSNNFPUCHVMRV-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@H](CO)c2ccccc2)c1 ZINC000295137146 199366239 /nfs/dbraw/zinc/36/62/39/199366239.db2.gz YXPHQISNLFZRRF-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@H](CO)c2ccccc2)c1 ZINC000295137146 199366241 /nfs/dbraw/zinc/36/62/41/199366241.db2.gz YXPHQISNLFZRRF-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc(O)c(CN(C)[C@H](CO)c2ccccc2)c1 ZINC000295137146 199366242 /nfs/dbraw/zinc/36/62/42/199366242.db2.gz YXPHQISNLFZRRF-MRXNPFEDSA-N 0 3 271.360 2.866 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1[O-] ZINC000092073097 347609043 /nfs/dbraw/zinc/60/90/43/347609043.db2.gz RUNNUDQVTTZVIK-CYBMUJFWSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1[O-] ZINC000092073097 347609048 /nfs/dbraw/zinc/60/90/48/347609048.db2.gz RUNNUDQVTTZVIK-CYBMUJFWSA-N 0 3 287.363 2.504 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)CCO)c([O-])c1 ZINC000297296200 200139066 /nfs/dbraw/zinc/13/90/66/200139066.db2.gz MBUAEMDTWHKCPI-YPMHNXCESA-N 0 3 251.370 2.760 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297553553 200226175 /nfs/dbraw/zinc/22/61/75/200226175.db2.gz FUNXTQFTSOTDAY-ZFWWWQNUSA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000297583637 200233481 /nfs/dbraw/zinc/23/34/81/200233481.db2.gz HGCVTJJUYHEIJH-CRAIPNDOSA-N 0 3 283.371 2.877 20 10 CFCDHN C[C@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCC[C@@H]1O ZINC000297640483 200250147 /nfs/dbraw/zinc/25/01/47/200250147.db2.gz JSYTXFIDOGDWNE-UKPHBRMFSA-N 0 3 275.392 2.910 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(O)CCCCC1)CC2 ZINC000297704231 200264944 /nfs/dbraw/zinc/26/49/44/200264944.db2.gz MKXRSTHDMCOIBK-ZDUSSCGKSA-N 0 3 261.365 2.664 20 10 CFCDHN O=C(c1cccc2c1CCNC2)N1CCCc2ccccc21 ZINC000317753194 541224078 /nfs/dbraw/zinc/22/40/78/541224078.db2.gz PWWQIXPJOKGZJW-UHFFFAOYSA-N 0 3 292.382 2.925 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2ccc(F)cc2)c1 ZINC000020087398 372227315 /nfs/dbraw/zinc/22/73/15/372227315.db2.gz HIGMEHMBRLTMMH-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN Oc1cc2c(cc1CN[C@H]1CCOc3ccccc31)OCO2 ZINC000063255977 373801082 /nfs/dbraw/zinc/80/10/82/373801082.db2.gz ZFLCKXOOZHYCKJ-ZDUSSCGKSA-N 0 3 299.326 2.734 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000092326150 375102262 /nfs/dbraw/zinc/10/22/62/375102262.db2.gz IZYCETLDIOZHQY-JTQLQIEISA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@H+](Cc3cc(C)ccc3[O-])C2)n1 ZINC000091833161 375063526 /nfs/dbraw/zinc/06/35/26/375063526.db2.gz QHDOCBNYMXSPLI-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@@H+](Cc3cc(C)ccc3[O-])C2)n1 ZINC000091833161 375063530 /nfs/dbraw/zinc/06/35/30/375063530.db2.gz QHDOCBNYMXSPLI-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)cc1C ZINC000093479730 375250059 /nfs/dbraw/zinc/25/00/59/375250059.db2.gz ZRNLIVYKQMXEMW-VMZNBEPHSA-N 0 3 275.392 2.602 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)cc1C ZINC000093479730 375250066 /nfs/dbraw/zinc/25/00/66/375250066.db2.gz ZRNLIVYKQMXEMW-VMZNBEPHSA-N 0 3 275.392 2.602 20 10 CFCDHN CCOc1cccc(CN(C)CCOCC2CC2)c1O ZINC000093818549 375314440 /nfs/dbraw/zinc/31/44/40/375314440.db2.gz IFRVWWFKTAZEIQ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CN(C)c1ccc(CN(C)CCc2nccs2)cc1 ZINC000093843695 375320771 /nfs/dbraw/zinc/32/07/71/375320771.db2.gz WUWWVLNDNJUCFT-UHFFFAOYSA-N 0 3 275.421 2.884 20 10 CFCDHN C[C@@H]([NH2+]CC1(N(C)C)CCC1)c1cc(F)ccc1[O-] ZINC000097927840 375587558 /nfs/dbraw/zinc/58/75/58/375587558.db2.gz AIEFEYYLFNQWMM-LLVKDONJSA-N 0 3 266.360 2.666 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCN(C)C(=O)OC(C)(C)C)c1 ZINC000113333454 376011087 /nfs/dbraw/zinc/01/10/87/376011087.db2.gz LPTXQIKJKROHQD-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN CCC(C)(CC)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000116359051 376183114 /nfs/dbraw/zinc/18/31/14/376183114.db2.gz GOSMZFPGFDJIDU-UHFFFAOYSA-N 0 3 251.326 2.789 20 10 CFCDHN COCCCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000117881483 376263895 /nfs/dbraw/zinc/26/38/95/376263895.db2.gz HUYZJPCRRNOEQU-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN COCCCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000117881483 376263902 /nfs/dbraw/zinc/26/39/02/376263902.db2.gz HUYZJPCRRNOEQU-INIZCTEOSA-N 0 3 293.407 2.800 20 10 CFCDHN Cc1ccc(O)c(CN2CCC[C@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741368 376973728 /nfs/dbraw/zinc/97/37/28/376973728.db2.gz HVIQYEKFCBPQSK-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741368 376973738 /nfs/dbraw/zinc/97/37/38/376973738.db2.gz HVIQYEKFCBPQSK-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)c1 ZINC000123741368 376973745 /nfs/dbraw/zinc/97/37/45/376973745.db2.gz HVIQYEKFCBPQSK-AAEUAGOBSA-N 0 3 289.297 2.588 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)[C@@H]1CCCCNC1=O ZINC000123867502 376990937 /nfs/dbraw/zinc/99/09/37/376990937.db2.gz NUMKHLOCOGYPFP-MRXNPFEDSA-N 0 3 298.386 2.646 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)[C@@H]1CCCCNC1=O ZINC000123867502 376990939 /nfs/dbraw/zinc/99/09/39/376990939.db2.gz NUMKHLOCOGYPFP-MRXNPFEDSA-N 0 3 298.386 2.646 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C)CN2CCCCC2)c1[O-] ZINC000124698585 377077560 /nfs/dbraw/zinc/07/75/60/377077560.db2.gz DKRUKAKEIMHRIM-CQSZACIVSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H]2CSCCS2)c1 ZINC000125212289 377129504 /nfs/dbraw/zinc/12/95/04/377129504.db2.gz QQSWKAYWHJULTK-GFCCVEGCSA-N 0 3 269.435 2.639 20 10 CFCDHN [O-]c1ccccc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000132476292 377844034 /nfs/dbraw/zinc/84/40/34/377844034.db2.gz BCZDYIZVYVVHTR-UHFFFAOYSA-N 0 3 274.408 2.843 20 10 CFCDHN CCC(CC)[N@H+](CCOC)Cc1cc2c(cc1[O-])OCO2 ZINC000133493990 377934215 /nfs/dbraw/zinc/93/42/15/377934215.db2.gz UGWWDVPUDWIKOK-UHFFFAOYSA-N 0 3 295.379 2.758 20 10 CFCDHN CCC(CC)[N@@H+](CCOC)Cc1cc2c(cc1[O-])OCO2 ZINC000133493990 377934216 /nfs/dbraw/zinc/93/42/16/377934216.db2.gz UGWWDVPUDWIKOK-UHFFFAOYSA-N 0 3 295.379 2.758 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@H]([NH+]2CCCC2)C1 ZINC000133942792 377969892 /nfs/dbraw/zinc/96/98/92/377969892.db2.gz GRHPIBPFEKUBOK-CQSZACIVSA-N 0 3 280.799 2.716 20 10 CFCDHN CC(C)(C)n1cc(C[NH2+]Cc2ccccc2[O-])cn1 ZINC000134236260 377995498 /nfs/dbraw/zinc/99/54/98/377995498.db2.gz BONUVQXDTFZQJH-UHFFFAOYSA-N 0 3 259.353 2.634 20 10 CFCDHN COc1cccc(C[NH2+]CC(C)(C)SC)c1[O-] ZINC000135385611 378126435 /nfs/dbraw/zinc/12/64/35/378126435.db2.gz IKQGMGKHXGLFRY-UHFFFAOYSA-N 0 3 255.383 2.632 20 10 CFCDHN CN(C)C[C@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000153147545 378476544 /nfs/dbraw/zinc/47/65/44/378476544.db2.gz DXOUAJNQSYEYFB-CQSZACIVSA-N 0 3 284.403 2.929 20 10 CFCDHN CN(C)C[C@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000153147545 378476545 /nfs/dbraw/zinc/47/65/45/378476545.db2.gz DXOUAJNQSYEYFB-CQSZACIVSA-N 0 3 284.403 2.929 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000153997727 378531364 /nfs/dbraw/zinc/53/13/64/378531364.db2.gz JQLHITXRPWBGHX-YVEFUNNKSA-N 0 3 287.359 2.785 20 10 CFCDHN COc1cccc(CN(C)CCOc2ccccc2)c1O ZINC000154733889 378591284 /nfs/dbraw/zinc/59/12/84/378591284.db2.gz KQMYMUNNZNDTCU-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN CN(Cc1ccc(-n2ccnc2)nc1)Cc1ccccc1O ZINC000177153946 380309918 /nfs/dbraw/zinc/30/99/18/380309918.db2.gz QWIDZDAHLWWJEH-UHFFFAOYSA-N 0 3 294.358 2.605 20 10 CFCDHN CNC(=O)c1ccc(CN(C)Cc2cccc(C)c2O)cc1 ZINC000179614314 380564297 /nfs/dbraw/zinc/56/42/97/380564297.db2.gz WZDHSBRNVWBRMQ-UHFFFAOYSA-N 0 3 298.386 2.692 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000179667852 380570593 /nfs/dbraw/zinc/57/05/93/380570593.db2.gz BLYNNRYOBZFGNT-STQMWFEESA-N 0 3 273.380 2.884 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1[O-] ZINC000179667643 380570883 /nfs/dbraw/zinc/57/08/83/380570883.db2.gz DEGVEIGQHPAANP-PBWFPOADSA-N 0 3 281.783 2.842 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1[O-] ZINC000179667643 380570885 /nfs/dbraw/zinc/57/08/85/380570885.db2.gz DEGVEIGQHPAANP-PBWFPOADSA-N 0 3 281.783 2.842 20 10 CFCDHN COC[C@@H](C)[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179788697 380580428 /nfs/dbraw/zinc/58/04/28/380580428.db2.gz MZHCIBAJNYGGDP-SNVBAGLBSA-N 0 3 257.761 2.821 20 10 CFCDHN COC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179788697 380580434 /nfs/dbraw/zinc/58/04/34/380580434.db2.gz MZHCIBAJNYGGDP-SNVBAGLBSA-N 0 3 257.761 2.821 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCSC(F)(F)F)c1 ZINC000179786965 380580682 /nfs/dbraw/zinc/58/06/82/380580682.db2.gz VEIHDMCQSDCOEP-UHFFFAOYSA-N 0 3 281.299 2.743 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)N(C)C)c1ccc(C)cc1[O-] ZINC000280282289 522627888 /nfs/dbraw/zinc/62/78/88/522627888.db2.gz YQDGHXXAJZLJMS-JSGCOSHPSA-N 0 3 250.386 2.691 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[N@H+](C)Cc1cc(F)ccc1[O-] ZINC000180245838 380637747 /nfs/dbraw/zinc/63/77/47/380637747.db2.gz UAHVFYASEXOMKJ-CQSZACIVSA-N 0 3 289.354 2.774 20 10 CFCDHN Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1cc(F)ccc1[O-] ZINC000180245838 380637753 /nfs/dbraw/zinc/63/77/53/380637753.db2.gz UAHVFYASEXOMKJ-CQSZACIVSA-N 0 3 289.354 2.774 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@@H]1n1ccnc1 ZINC000180271791 380642431 /nfs/dbraw/zinc/64/24/31/380642431.db2.gz GRBNEPKIYCUAFB-WFASDCNBSA-N 0 3 289.354 2.811 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@@H]1n1ccnc1 ZINC000180271791 380642434 /nfs/dbraw/zinc/64/24/34/380642434.db2.gz GRBNEPKIYCUAFB-WFASDCNBSA-N 0 3 289.354 2.811 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@@H](C(C)C)C2)c1 ZINC000180668960 380688226 /nfs/dbraw/zinc/68/82/26/380688226.db2.gz QDLUQZZOBXVUNI-OAHLLOKOSA-N 0 3 281.421 2.974 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@@H](C(C)C)C2)c1 ZINC000180668960 380688229 /nfs/dbraw/zinc/68/82/29/380688229.db2.gz QDLUQZZOBXVUNI-OAHLLOKOSA-N 0 3 281.421 2.974 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cccc(OCC)c1[O-] ZINC000288516426 381013313 /nfs/dbraw/zinc/01/33/13/381013313.db2.gz JDGJBWHJASXMKH-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN Cc1ccncc1CCC[NH2+]Cc1ccccc1[O-] ZINC000289219864 381028634 /nfs/dbraw/zinc/02/86/34/381028634.db2.gz JGKDDBHLSNWUAU-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)c1 ZINC000289270399 381029398 /nfs/dbraw/zinc/02/93/98/381029398.db2.gz GHWWIJRGMQDUOM-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c1 ZINC000289270399 381029403 /nfs/dbraw/zinc/02/94/03/381029403.db2.gz GHWWIJRGMQDUOM-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CC2CCC2)[C@H](C)CO)c1 ZINC000289344980 381031043 /nfs/dbraw/zinc/03/10/43/381031043.db2.gz IIWHWVXYCIYEDK-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CC2CCC2)[C@H](C)CO)c1 ZINC000289344980 381031047 /nfs/dbraw/zinc/03/10/47/381031047.db2.gz IIWHWVXYCIYEDK-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@H](CC(C)(C)O)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000295854085 381118210 /nfs/dbraw/zinc/11/82/10/381118210.db2.gz BDIYZBFGIGULMZ-NXEZZACHSA-N 0 3 255.333 2.731 20 10 CFCDHN CN(C)CC(C)(C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295933674 381166566 /nfs/dbraw/zinc/16/65/66/381166566.db2.gz KNORESVRSQRWHF-ZDUSSCGKSA-N 0 3 262.397 2.557 20 10 CFCDHN C[C@H]([NH2+]CCCN1C[C@H](C)O[C@@H](C)C1)c1ccccc1[O-] ZINC000183394588 381267741 /nfs/dbraw/zinc/26/77/41/381267741.db2.gz FSYYUFAKCVNTIN-KKUMJFAQSA-N 0 3 292.423 2.542 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000296048442 381230262 /nfs/dbraw/zinc/23/02/62/381230262.db2.gz QZJJXYBEWJYJAI-AWEZNQCLSA-N 0 3 254.333 2.873 20 10 CFCDHN C[C@@H]([NH2+]CC[S@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000183517701 381282210 /nfs/dbraw/zinc/28/22/10/381282210.db2.gz YEESKXJUEDLBCP-ZMZPIMSZSA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000183545185 381285301 /nfs/dbraw/zinc/28/53/01/381285301.db2.gz YRIDLRWYZFPGKW-UKRRQHHQSA-N 0 3 271.360 2.819 20 10 CFCDHN C[C@H]([NH2+]CCCNc1ccccn1)c1ccccc1[O-] ZINC000183546520 381285867 /nfs/dbraw/zinc/28/58/67/381285867.db2.gz YWILPMFFENPWIA-ZDUSSCGKSA-N 0 3 271.364 2.940 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@@H](C)C[S@](C)=O)cc1 ZINC000184290198 381397854 /nfs/dbraw/zinc/39/78/54/381397854.db2.gz HHEWJZLWTMGKGN-JMERFSKESA-N 0 3 282.453 2.560 20 10 CFCDHN CC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H](O)C(F)F ZINC000296561774 381450550 /nfs/dbraw/zinc/45/05/50/381450550.db2.gz SHYGNLIAYOYYDG-LEWSCRJBSA-N 0 3 286.366 2.808 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCN(c3ccccn3)CC2)c1 ZINC000184806908 381480068 /nfs/dbraw/zinc/48/00/68/381480068.db2.gz UYWHCHBVOGRCGG-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCN(c3ccccn3)CC2)c1 ZINC000184806908 381480076 /nfs/dbraw/zinc/48/00/76/381480076.db2.gz UYWHCHBVOGRCGG-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296634878 381482386 /nfs/dbraw/zinc/48/23/86/381482386.db2.gz BPQOUEJUTGRXLU-OCCSQVGLSA-N 0 3 262.397 2.698 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC([C@H](C)O)CC2)c1O ZINC000184687387 381461231 /nfs/dbraw/zinc/46/12/31/381461231.db2.gz UWSUQVQICDCROX-JTQLQIEISA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCCC3(CC3)C2)cc1OC ZINC000184868717 381490900 /nfs/dbraw/zinc/49/09/00/381490900.db2.gz GAEBXSZAIKZDQL-UHFFFAOYSA-N 0 3 277.364 2.785 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCCC3(CC3)C2)cc1OC ZINC000184868717 381490906 /nfs/dbraw/zinc/49/09/06/381490906.db2.gz GAEBXSZAIKZDQL-UHFFFAOYSA-N 0 3 277.364 2.785 20 10 CFCDHN COc1cc(O)c(CN2CCCC3(CC3)C2)cc1OC ZINC000184868717 381490910 /nfs/dbraw/zinc/49/09/10/381490910.db2.gz GAEBXSZAIKZDQL-UHFFFAOYSA-N 0 3 277.364 2.785 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@H](O)C(F)F ZINC000296654783 381491362 /nfs/dbraw/zinc/49/13/62/381491362.db2.gz ZFPNUXJSJFYLRU-GAFUQQFSSA-N 0 3 273.323 2.756 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](O)CC(C)(C)C)c1 ZINC000185482047 381646264 /nfs/dbraw/zinc/64/62/64/381646264.db2.gz XRTRTSLBXBZTOT-RYUDHWBXSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)OC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185540662 381662122 /nfs/dbraw/zinc/66/21/22/381662122.db2.gz BZVYPFUJHNZRPO-JTQLQIEISA-N 0 3 283.343 2.914 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H](c2ccncn2)C1 ZINC000359897678 381665639 /nfs/dbraw/zinc/66/56/39/381665639.db2.gz KRDWTMWPMBPFGJ-ZDUSSCGKSA-N 0 3 269.348 2.562 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000359897678 381665643 /nfs/dbraw/zinc/66/56/43/381665643.db2.gz KRDWTMWPMBPFGJ-ZDUSSCGKSA-N 0 3 269.348 2.562 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909366 381672105 /nfs/dbraw/zinc/67/21/05/381672105.db2.gz YXXNKVGQUCWZQB-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909366 381672110 /nfs/dbraw/zinc/67/21/10/381672110.db2.gz YXXNKVGQUCWZQB-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909366 381672116 /nfs/dbraw/zinc/67/21/16/381672116.db2.gz YXXNKVGQUCWZQB-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@H]2C1 ZINC000359909366 381672123 /nfs/dbraw/zinc/67/21/23/381672123.db2.gz YXXNKVGQUCWZQB-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C13CCC(CC1)C3)OCO2 ZINC000371752297 381693796 /nfs/dbraw/zinc/69/37/96/381693796.db2.gz GLWKMDJQCPCBCS-UHFFFAOYSA-N 0 3 261.321 2.543 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000185672738 381700095 /nfs/dbraw/zinc/70/00/95/381700095.db2.gz SZWNYUYLTWINGZ-NTZNESFSSA-N 0 3 278.371 2.807 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)C2CCOCC2)c1 ZINC000185782561 381731785 /nfs/dbraw/zinc/73/17/85/381731785.db2.gz MWPHNMRQSITRFD-VXGBXAGGSA-N 0 3 279.380 2.867 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c([O-])c1 ZINC000186115512 381826716 /nfs/dbraw/zinc/82/67/16/381826716.db2.gz VMTVZZIRJSAWII-AAEUAGOBSA-N 0 3 271.364 2.632 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)Cc2cc(C)n[nH]2)c1 ZINC000186130833 381829640 /nfs/dbraw/zinc/82/96/40/381829640.db2.gz RNCSSNCAFZBBHR-PWSUYJOCSA-N 0 3 289.379 2.714 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)C[C@H](C)O)c1 ZINC000186075203 381817724 /nfs/dbraw/zinc/81/77/24/381817724.db2.gz XGJHCKMTARAZAD-RYUDHWBXSA-N 0 3 281.396 2.849 20 10 CFCDHN CC[C@@H](CO)NCc1ccc(N(CC)CC)c(F)c1 ZINC000186527588 381938135 /nfs/dbraw/zinc/93/81/35/381938135.db2.gz VVJUACZITBWWSW-ZDUSSCGKSA-N 0 3 268.376 2.532 20 10 CFCDHN Cc1ncc2c(n1)CC[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C2 ZINC000374713860 382052682 /nfs/dbraw/zinc/05/26/82/382052682.db2.gz WYSVRYAQTKFEIY-FZMZJTMJSA-N 0 3 283.375 2.699 20 10 CFCDHN Cc1ncc2c(n1)CC[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C2 ZINC000374713864 382053190 /nfs/dbraw/zinc/05/31/90/382053190.db2.gz WYSVRYAQTKFEIY-SMDDNHRTSA-N 0 3 283.375 2.699 20 10 CFCDHN CN1CCc2cc(CNCc3ccc4c[nH]nc4c3)ccc21 ZINC000373523762 382018345 /nfs/dbraw/zinc/01/83/45/382018345.db2.gz YIEIZIZTIVRDQP-UHFFFAOYSA-N 0 3 292.386 2.845 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@]3(CCCCO3)C2)c1[O-] ZINC000376029674 382117489 /nfs/dbraw/zinc/11/74/89/382117489.db2.gz PKUDYPRBSZJTIN-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@]3(CCCCO3)C2)c1[O-] ZINC000376029674 382117494 /nfs/dbraw/zinc/11/74/94/382117494.db2.gz PKUDYPRBSZJTIN-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1cc(CN2CC[C@@H](n3cccn3)C2)ccc1N(C)C ZINC000293564580 382176709 /nfs/dbraw/zinc/17/67/09/382176709.db2.gz MMESPFQVSCVXOX-MRXNPFEDSA-N 0 3 284.407 2.705 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](CO)C2CCCCC2)c1[O-] ZINC000293550066 382169498 /nfs/dbraw/zinc/16/94/98/382169498.db2.gz DVDVDLOFQRDTSX-INIZCTEOSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](O)C23CCCC3)cc1C ZINC000293796878 382283438 /nfs/dbraw/zinc/28/34/38/382283438.db2.gz CYJVYTVTQDBWTQ-MRXNPFEDSA-N 0 3 275.392 2.888 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](O)C23CCCC3)cc1C ZINC000293796878 382283442 /nfs/dbraw/zinc/28/34/42/382283442.db2.gz CYJVYTVTQDBWTQ-MRXNPFEDSA-N 0 3 275.392 2.888 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])C2 ZINC000363854645 382250169 /nfs/dbraw/zinc/25/01/69/382250169.db2.gz MLHJXMVRKLOKQX-KBPBESRZSA-N 0 3 285.391 2.871 20 10 CFCDHN CCC[C@@H](C[NH2+][C@@H](C)c1cc(OC)ccc1[O-])OC ZINC000293749243 382263116 /nfs/dbraw/zinc/26/31/16/382263116.db2.gz TWPNDWVLZJAUGO-AAEUAGOBSA-N 0 3 267.369 2.867 20 10 CFCDHN COc1ccc(N2CCCN(Cc3ccccn3)CC2)cc1 ZINC000377439386 382270505 /nfs/dbraw/zinc/27/05/05/382270505.db2.gz DZSVFGUAKHEURF-UHFFFAOYSA-N 0 3 297.402 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CC[C@@H](O)C2)c1[O-] ZINC000187982680 382315101 /nfs/dbraw/zinc/31/51/01/382315101.db2.gz RLNDOCHHNXJNRL-GXFFZTMASA-N 0 3 269.772 2.605 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1 ZINC000293889304 382322815 /nfs/dbraw/zinc/32/28/15/382322815.db2.gz VUONIHCQYUPFFY-CYBMUJFWSA-N 0 3 298.386 2.959 20 10 CFCDHN CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccccc1[O-] ZINC000188036908 382330861 /nfs/dbraw/zinc/33/08/61/382330861.db2.gz RPHRQCVVOIWWAA-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccccc1[O-] ZINC000188036908 382330866 /nfs/dbraw/zinc/33/08/66/382330866.db2.gz RPHRQCVVOIWWAA-MRXNPFEDSA-N 0 3 263.381 2.765 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000377755927 382337165 /nfs/dbraw/zinc/33/71/65/382337165.db2.gz MBIAXMHPXJATKN-KOLCDFICSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1cc(Cl)ccc1[O-] ZINC000377755927 382337168 /nfs/dbraw/zinc/33/71/68/382337168.db2.gz MBIAXMHPXJATKN-KOLCDFICSA-N 0 3 291.782 2.977 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCN2CCOC2=O)c([O-])c1 ZINC000293920920 382337526 /nfs/dbraw/zinc/33/75/26/382337526.db2.gz XIOWSGNJZVDKQG-CYBMUJFWSA-N 0 3 292.379 2.502 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](O)C23CCCC3)c1 ZINC000293998767 382372941 /nfs/dbraw/zinc/37/29/41/382372941.db2.gz SOQCWMXYTLZEEO-MRXNPFEDSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](O)C23CCCC3)c1 ZINC000293998767 382372944 /nfs/dbraw/zinc/37/29/44/382372944.db2.gz SOQCWMXYTLZEEO-MRXNPFEDSA-N 0 3 291.391 2.670 20 10 CFCDHN CCOc1cccc(CN2CCC[C@@H]2CF)c1O ZINC000294122625 382425114 /nfs/dbraw/zinc/42/51/14/382425114.db2.gz UATGHAKTNGPJHE-GFCCVEGCSA-N 0 3 253.317 2.725 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cccc(C)c1[O-])OC ZINC000294141310 382431869 /nfs/dbraw/zinc/43/18/69/382431869.db2.gz GKSGZLPVLSHCFL-BXUZGUMPSA-N 0 3 251.370 2.851 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H](OC)CC2)c1 ZINC000378640045 382498975 /nfs/dbraw/zinc/49/89/75/382498975.db2.gz WBIHZJKJSXSSTH-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H](OC)CC2)c1 ZINC000378640045 382498980 /nfs/dbraw/zinc/49/89/80/382498980.db2.gz WBIHZJKJSXSSTH-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1cc(C)ccc1[O-])OC ZINC000294298424 382499964 /nfs/dbraw/zinc/49/99/64/382499964.db2.gz UUNMBFVFTFMAFL-DOMZBBRYSA-N 0 3 251.370 2.851 20 10 CFCDHN CC[C@H](COCC(F)(F)F)[NH2+]Cc1ccccc1[O-] ZINC000295123999 382577220 /nfs/dbraw/zinc/57/72/20/382577220.db2.gz NRXNQXADWMGRQA-LLVKDONJSA-N 0 3 277.286 2.839 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](OC)C(C)(C)C2)c1 ZINC000295056970 382570032 /nfs/dbraw/zinc/57/00/32/382570032.db2.gz PZPDSATXWGZALO-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](OC)C(C)(C)C2)c1 ZINC000295056970 382570036 /nfs/dbraw/zinc/57/00/36/382570036.db2.gz PZPDSATXWGZALO-HNNXBMFYSA-N 0 3 279.380 2.648 20 10 CFCDHN CCn1cc([C@H](C)NCc2cc(C)ccc2O)cn1 ZINC000294872237 382535233 /nfs/dbraw/zinc/53/52/33/382535233.db2.gz PIRZSIJXCRKXQS-LBPRGKRZSA-N 0 3 259.353 2.768 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c1 ZINC000228615526 382848192 /nfs/dbraw/zinc/84/81/92/382848192.db2.gz JCEHAGNKGJBIBC-SOZUMNATSA-N 0 3 269.410 2.508 20 10 CFCDHN C[C@@H]1C[C@@H](N[C@@H]2CC[NH2+]C23CCC3)c2c1c(F)ccc2[O-] ZINC000530215984 383768705 /nfs/dbraw/zinc/76/87/05/383768705.db2.gz LKAQJOGNPKZXSG-MPKXVKKWSA-N 0 3 290.382 2.954 20 10 CFCDHN CCOCc1cc(CNCc2ccn(C)c2)ccc1OC ZINC000267035584 384284113 /nfs/dbraw/zinc/28/41/13/384284113.db2.gz BSFXMMCWLKMLST-UHFFFAOYSA-N 0 3 288.391 2.860 20 10 CFCDHN CC1CCC(O)(C[N@H+](C)Cc2ccccc2[O-])CC1 ZINC000269656202 384823760 /nfs/dbraw/zinc/82/37/60/384823760.db2.gz RXZRYYDZPVKCBC-UHFFFAOYSA-N 0 3 263.381 2.765 20 10 CFCDHN CC1CCC(O)(C[N@@H+](C)Cc2ccccc2[O-])CC1 ZINC000269656202 384823767 /nfs/dbraw/zinc/82/37/67/384823767.db2.gz RXZRYYDZPVKCBC-UHFFFAOYSA-N 0 3 263.381 2.765 20 10 CFCDHN CC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCCO1 ZINC000281255599 385187049 /nfs/dbraw/zinc/18/70/49/385187049.db2.gz MWSCTMAGBFIBSN-AWEZNQCLSA-N 0 3 280.387 2.893 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2CCC(F)(F)C2)c1[O-] ZINC000281823940 385204867 /nfs/dbraw/zinc/20/48/67/385204867.db2.gz WRLGXQDTOFECLK-SNVBAGLBSA-N 0 3 271.307 2.926 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC(c3ncc[nH]3)CC2)c1 ZINC000271718553 385388587 /nfs/dbraw/zinc/38/85/87/385388587.db2.gz JHDSSRCSZMLTCD-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOC[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000271205329 385376632 /nfs/dbraw/zinc/37/66/32/385376632.db2.gz ZLULTMFLLUUOKB-CQSZACIVSA-N 0 3 280.387 2.750 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@H](CCO)c1ccccc1 ZINC000271468480 385384029 /nfs/dbraw/zinc/38/40/29/385384029.db2.gz YMPNPMBREVAQIV-MRXNPFEDSA-N 0 3 271.360 2.948 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@H](CCO)c1ccccc1 ZINC000271468480 385384033 /nfs/dbraw/zinc/38/40/33/385384033.db2.gz YMPNPMBREVAQIV-MRXNPFEDSA-N 0 3 271.360 2.948 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N(C)C1CCCCC1)c1ccccc1[O-] ZINC000271684061 385387788 /nfs/dbraw/zinc/38/77/88/385387788.db2.gz PZYXTPPDMDDMIJ-CYBMUJFWSA-N 0 3 290.407 2.834 20 10 CFCDHN CCN(CC)c1ccc(CNCC2([S@@](C)=O)CC2)cc1 ZINC000282489196 385325575 /nfs/dbraw/zinc/32/55/75/385325575.db2.gz VXLSBAKKOWKUQQ-HXUWFJFHSA-N 0 3 294.464 2.534 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)C2)c1[O-] ZINC000271799119 385392664 /nfs/dbraw/zinc/39/26/64/385392664.db2.gz KXUXFSXJGMHUGI-NSHDSACASA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)C2)c1[O-] ZINC000271799119 385392669 /nfs/dbraw/zinc/39/26/69/385392669.db2.gz KXUXFSXJGMHUGI-NSHDSACASA-N 0 3 269.772 2.558 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2([C@@H](C)CCO)CCC2)c1 ZINC000271791421 385392954 /nfs/dbraw/zinc/39/29/54/385392954.db2.gz GVXJZNKFPULOIJ-ZDUSSCGKSA-N 0 3 293.407 2.679 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CSC2(C)C)cc1 ZINC000282823509 385395864 /nfs/dbraw/zinc/39/58/64/385395864.db2.gz NKTHACPHIRNYQG-CYBMUJFWSA-N 0 3 250.411 2.736 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2CSC2(C)C)c1[O-] ZINC000282843909 385399028 /nfs/dbraw/zinc/39/90/28/385399028.db2.gz PBAYKNXEESTSNY-GFCCVEGCSA-N 0 3 267.394 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C(CC)(CC)CCO)c1 ZINC000282941529 385413136 /nfs/dbraw/zinc/41/31/36/385413136.db2.gz ITQAGBBFSYPLHQ-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN COC1CCC([N@H+](C)Cc2cc(F)ccc2[O-])CC1 ZINC000272340954 385514462 /nfs/dbraw/zinc/51/44/62/385514462.db2.gz YRPCBHSKWZXAIW-UHFFFAOYSA-N 0 3 267.344 2.921 20 10 CFCDHN COC1CCC([N@@H+](C)Cc2cc(F)ccc2[O-])CC1 ZINC000272340954 385514466 /nfs/dbraw/zinc/51/44/66/385514466.db2.gz YRPCBHSKWZXAIW-UHFFFAOYSA-N 0 3 267.344 2.921 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)CCO)c([O-])c1 ZINC000283693778 385489827 /nfs/dbraw/zinc/48/98/27/385489827.db2.gz ANKANFZMCWUAME-ZWNOBZJWSA-N 0 3 251.370 2.678 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1cccc(C)c1[O-] ZINC000272415180 385531661 /nfs/dbraw/zinc/53/16/61/385531661.db2.gz MFKPNZHLZSROPF-WMLDXEAASA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1cc(CN[C@H](C)c2ccc(N(C)C)cc2)n(C)n1 ZINC000284213760 385546446 /nfs/dbraw/zinc/54/64/46/385546446.db2.gz GYYONRSBLOZZSN-CYBMUJFWSA-N 0 3 272.396 2.645 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284299850 385547654 /nfs/dbraw/zinc/54/76/54/385547654.db2.gz BORBAIMIUCYXFG-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284299850 385547656 /nfs/dbraw/zinc/54/76/56/385547656.db2.gz BORBAIMIUCYXFG-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000272394945 385526701 /nfs/dbraw/zinc/52/67/01/385526701.db2.gz HXXIPKABSMAEBD-HUUCEWRRSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000272394945 385526703 /nfs/dbraw/zinc/52/67/03/385526703.db2.gz HXXIPKABSMAEBD-HUUCEWRRSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c([O-])c1 ZINC000284909968 385551030 /nfs/dbraw/zinc/55/10/30/385551030.db2.gz COMYUSGYRWANKI-MELADBBJSA-N 0 3 261.365 2.597 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000285320337 385553950 /nfs/dbraw/zinc/55/39/50/385553950.db2.gz WXGNAFFLJHMCFM-LSDHHAIUSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1[O-] ZINC000285320337 385553954 /nfs/dbraw/zinc/55/39/54/385553954.db2.gz WXGNAFFLJHMCFM-LSDHHAIUSA-N 0 3 261.365 2.844 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccc(F)cc1[O-] ZINC000285680874 385557025 /nfs/dbraw/zinc/55/70/25/385557025.db2.gz NWDFHXHJQDDOIZ-WFASDCNBSA-N 0 3 280.387 2.914 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccc(F)cc1[O-] ZINC000285680872 385557097 /nfs/dbraw/zinc/55/70/97/385557097.db2.gz NWDFHXHJQDDOIZ-SWLSCSKDSA-N 0 3 280.387 2.914 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)c1[O-] ZINC000272653193 385582704 /nfs/dbraw/zinc/58/27/04/385582704.db2.gz QEVPLZKOJLQLGR-ZFWWWQNUSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c1[O-] ZINC000272653193 385582707 /nfs/dbraw/zinc/58/27/07/385582707.db2.gz QEVPLZKOJLQLGR-ZFWWWQNUSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H]2CCCc3c[nH]nc32)c1 ZINC000273343652 385677561 /nfs/dbraw/zinc/67/75/61/385677561.db2.gz ACJWRETWIDWYTQ-QMTHXVAHSA-N 0 3 287.363 2.852 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN2C)c([O-])c1C ZINC000273376974 385679026 /nfs/dbraw/zinc/67/90/26/385679026.db2.gz HJCSXUPHHCRGKK-UONOGXRCSA-N 0 3 262.397 2.754 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@]1(C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000273397972 385680687 /nfs/dbraw/zinc/68/06/87/385680687.db2.gz FUHCDDOJSCYLEQ-CJNGLKHVSA-N 0 3 295.354 2.743 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cnn(C)c2)c([O-])c1C ZINC000273386957 385680793 /nfs/dbraw/zinc/68/07/93/385680793.db2.gz JSJBSVLMKWMXET-CYBMUJFWSA-N 0 3 273.380 2.636 20 10 CFCDHN CC(C)[N@H+](C)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442975 385682808 /nfs/dbraw/zinc/68/28/08/385682808.db2.gz ZEKCQHMSPFEQOA-GFCCVEGCSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)[N@@H+](C)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442975 385682813 /nfs/dbraw/zinc/68/28/13/385682813.db2.gz ZEKCQHMSPFEQOA-GFCCVEGCSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)N(C)CCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273442975 385682817 /nfs/dbraw/zinc/68/28/17/385682817.db2.gz ZEKCQHMSPFEQOA-GFCCVEGCSA-N 0 3 295.383 2.681 20 10 CFCDHN CC(C)[C@H](O)C1(C[NH2+][C@H](C)c2cc(F)ccc2[O-])CC1 ZINC000273535762 385685817 /nfs/dbraw/zinc/68/58/17/385685817.db2.gz XGRIQJAVPWJKRW-ABAIWWIYSA-N 0 3 281.371 2.979 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCO[C@H]2CCOC2)c([O-])c1C ZINC000273563891 385688244 /nfs/dbraw/zinc/68/82/44/385688244.db2.gz IZBYYPOYZUQWEI-GJZGRUSLSA-N 0 3 293.407 2.855 20 10 CFCDHN CCC1(O)CCN(Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000273686425 385694135 /nfs/dbraw/zinc/69/41/35/385694135.db2.gz AOKHFIQBLPUOPS-UHFFFAOYSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000287033151 385766886 /nfs/dbraw/zinc/76/68/86/385766886.db2.gz LYAGHXFMJSKHRZ-JSGCOSHPSA-N 0 3 250.386 2.691 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccc(O)cc1)CC2 ZINC000295969480 285384736 /nfs/dbraw/zinc/38/47/36/285384736.db2.gz MNNRENVNBYOXKH-HNNXBMFYSA-N 0 3 269.344 2.917 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCN(C3CCC3)CC1)CC2 ZINC000297885757 285397598 /nfs/dbraw/zinc/39/75/98/285397598.db2.gz VHSKIPLKAIRKDA-MRXNPFEDSA-N 0 3 286.419 2.986 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccccc1O)CC2 ZINC000297516817 285396744 /nfs/dbraw/zinc/39/67/44/285396744.db2.gz CWRIYNXVYQYTKQ-AWEZNQCLSA-N 0 3 269.344 2.917 20 10 CFCDHN Cc1ncc([C@@H](C)NCc2ccc3c(c2)CCN3C)c(C)n1 ZINC000372418875 393448610 /nfs/dbraw/zinc/44/86/10/393448610.db2.gz ZFKONHBKOHWOJR-GFCCVEGCSA-N 0 3 296.418 2.937 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374095438 393482795 /nfs/dbraw/zinc/48/27/95/393482795.db2.gz SPINTTGEUUOGSR-ZIAGYGMSSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374095438 393482799 /nfs/dbraw/zinc/48/27/99/393482799.db2.gz SPINTTGEUUOGSR-ZIAGYGMSSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000374256317 393491480 /nfs/dbraw/zinc/49/14/80/393491480.db2.gz VGMFNYGWAOILLG-CABCVRRESA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000374256317 393491483 /nfs/dbraw/zinc/49/14/83/393491483.db2.gz VGMFNYGWAOILLG-CABCVRRESA-N 0 3 291.391 2.934 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CC2CCC2)[C@H](C)CO)c1 ZINC000289310045 394216961 /nfs/dbraw/zinc/21/69/61/394216961.db2.gz DPVRUYNYJQIRCZ-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CC2CCC2)[C@H](C)CO)c1 ZINC000289310045 394216967 /nfs/dbraw/zinc/21/69/67/394216967.db2.gz DPVRUYNYJQIRCZ-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)C(C)C ZINC000292546679 394275446 /nfs/dbraw/zinc/27/54/46/394275446.db2.gz GWBFODBHOZZMIB-OAHLLOKOSA-N 0 3 251.370 2.621 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)C(C)C ZINC000292546679 394275447 /nfs/dbraw/zinc/27/54/47/394275447.db2.gz GWBFODBHOZZMIB-OAHLLOKOSA-N 0 3 251.370 2.621 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)[C@@H](C)O1 ZINC000295233688 394297982 /nfs/dbraw/zinc/29/79/82/394297982.db2.gz SECDSDFCNCIMQU-JTNHKYCSSA-N 0 3 266.360 2.547 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)c1ccccc1[O-])[C@H](O)C(F)F ZINC000295131856 286923637 /nfs/dbraw/zinc/92/36/37/286923637.db2.gz YDBVQLQAQDOMQQ-LOWVWBTDSA-N 0 3 273.323 2.838 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000185653740 287036292 /nfs/dbraw/zinc/03/62/92/287036292.db2.gz CWFYVPFQJJGCJT-TZMCWYRMSA-N 0 3 289.350 2.958 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000020123080 171004111 /nfs/dbraw/zinc/00/41/11/171004111.db2.gz VETMYTUMWFTHGJ-HNNXBMFYSA-N 0 3 286.375 2.912 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1 ZINC000020125997 171009734 /nfs/dbraw/zinc/00/97/34/171009734.db2.gz XBRDHQNTZJZZOD-GFCCVEGCSA-N 0 3 250.386 2.691 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1[O-] ZINC000020146055 171032063 /nfs/dbraw/zinc/03/20/63/171032063.db2.gz OJSYUBMIZDZEDQ-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN Cc1c([C@@H](C)NCc2ccc(N(C)C)cc2)cnn1C ZINC000020351424 171156404 /nfs/dbraw/zinc/15/64/04/171156404.db2.gz MDWSTASHDDJZIL-GFCCVEGCSA-N 0 3 272.396 2.645 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccccc1[O-] ZINC000035601323 172289962 /nfs/dbraw/zinc/28/99/62/172289962.db2.gz SQUHBMZFXDKRAO-BLLLJJGKSA-N 0 3 257.333 2.776 20 10 CFCDHN O=C(c1cccc2c1CCNC2)N1CCc2c1cccc2F ZINC000662791272 414610652 /nfs/dbraw/zinc/61/06/52/414610652.db2.gz IRZDLIFKGIEJSW-UHFFFAOYSA-N 0 3 296.345 2.674 20 10 CFCDHN Cc1cccc2c1N(C(=O)c1cccc3c1CCNC3)CC2 ZINC000662793218 414610668 /nfs/dbraw/zinc/61/06/68/414610668.db2.gz GEVVMTJIRWEEEM-UHFFFAOYSA-N 0 3 292.382 2.844 20 10 CFCDHN Cc1c([C@@H](C)NCc2ccc3c(c2)CCO3)cnn1C ZINC000037363597 260095165 /nfs/dbraw/zinc/09/51/65/260095165.db2.gz ASPGFWOJENXNFL-LLVKDONJSA-N 0 3 271.364 2.514 20 10 CFCDHN Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccccc1[O-] ZINC000368588995 262108593 /nfs/dbraw/zinc/10/85/93/262108593.db2.gz HHABYVDSFCBTOX-HNNXBMFYSA-N 0 3 271.364 2.771 20 10 CFCDHN Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccccc1[O-] ZINC000368588995 262108595 /nfs/dbraw/zinc/10/85/95/262108595.db2.gz HHABYVDSFCBTOX-HNNXBMFYSA-N 0 3 271.364 2.771 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc2n1CCCC2)c1cc(F)ccc1[O-] ZINC000367438657 262116928 /nfs/dbraw/zinc/11/69/28/262116928.db2.gz ONEULIFFMLYKDD-NSHDSACASA-N 0 3 289.354 2.915 20 10 CFCDHN Cn1nccc1[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000368401955 267170351 /nfs/dbraw/zinc/17/03/51/267170351.db2.gz HRCULAAPJDQFRK-ZDUSSCGKSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000368401955 267170353 /nfs/dbraw/zinc/17/03/53/267170353.db2.gz HRCULAAPJDQFRK-ZDUSSCGKSA-N 0 3 271.364 2.505 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368658225 267195163 /nfs/dbraw/zinc/19/51/63/267195163.db2.gz HORYFEKZCNJUHM-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000368658225 267195167 /nfs/dbraw/zinc/19/51/67/267195167.db2.gz HORYFEKZCNJUHM-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@H]([C@H]2CCCO2)C1 ZINC000369888657 267274466 /nfs/dbraw/zinc/27/44/66/267274466.db2.gz OVOQEWUTMXDHAZ-DJIMGWMZSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@H]([C@H]2CCCO2)C1 ZINC000369888657 267274468 /nfs/dbraw/zinc/27/44/68/267274468.db2.gz OVOQEWUTMXDHAZ-DJIMGWMZSA-N 0 3 291.391 2.723 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCO[C@]2(CCOC2)C1)c1cc(F)ccc1[O-] ZINC000369902179 267275228 /nfs/dbraw/zinc/27/52/28/267275228.db2.gz KXURYFUSLXLOOE-NORZTCDRSA-N 0 3 295.354 2.520 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2CCN(C)[C@H]2C1 ZINC000369930738 267277116 /nfs/dbraw/zinc/27/71/16/267277116.db2.gz OOYBWGVBOWVQER-BMFZPTHFSA-N 0 3 274.408 2.869 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H]2CCN(C)[C@H]2C1 ZINC000369930738 267277119 /nfs/dbraw/zinc/27/71/19/267277119.db2.gz OOYBWGVBOWVQER-BMFZPTHFSA-N 0 3 274.408 2.869 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC23CCOCC3)cc1C ZINC000370079657 267289609 /nfs/dbraw/zinc/28/96/09/267289609.db2.gz AFOTXOIEUMOVGY-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC23CCOCC3)cc1C ZINC000370079657 267289610 /nfs/dbraw/zinc/28/96/10/267289610.db2.gz AFOTXOIEUMOVGY-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2Cn2cccn2)c1 ZINC000371371106 267395457 /nfs/dbraw/zinc/39/54/57/267395457.db2.gz ADACLQBMWPMYKL-INIZCTEOSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@H]2Cn2cccn2)c1 ZINC000371371106 267395461 /nfs/dbraw/zinc/39/54/61/267395461.db2.gz ADACLQBMWPMYKL-INIZCTEOSA-N 0 3 285.391 2.952 20 10 CFCDHN CN(C)c1cccnc1CN[C@H]1CCc2cccc(O)c21 ZINC000297486687 276889802 /nfs/dbraw/zinc/88/98/02/276889802.db2.gz ZRXQBBWNHRAXIT-ZDUSSCGKSA-N 0 3 283.375 2.630 20 10 CFCDHN COc1cccc(CN2CCN(C)c3ccccc3C2)c1O ZINC000271162656 278010664 /nfs/dbraw/zinc/01/06/64/278010664.db2.gz QTVQMHGMVSVJTD-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCO)C(C)C)c1ccccc1[O-] ZINC000156059634 288063343 /nfs/dbraw/zinc/06/33/43/288063343.db2.gz VEWWRDQRLBTAHQ-KBPBESRZSA-N 0 3 251.370 2.840 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1COC3(CCCC3)O1)CC2 ZINC000296936266 280454513 /nfs/dbraw/zinc/45/45/13/280454513.db2.gz QDOPNADMNWFZJE-UONOGXRCSA-N 0 3 289.375 2.655 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCN2CCC[C@H]2C1 ZINC000251295845 281025337 /nfs/dbraw/zinc/02/53/37/281025337.db2.gz SKQFNTHLHKWLDC-DZGCQCFKSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCN2CCC[C@H]2C1 ZINC000251295845 281025338 /nfs/dbraw/zinc/02/53/38/281025338.db2.gz SKQFNTHLHKWLDC-DZGCQCFKSA-N 0 3 260.381 2.623 20 10 CFCDHN COc1ccc(O)c(CN2CCS[C@@H](C)[C@H]2C)c1 ZINC000180311468 295166349 /nfs/dbraw/zinc/16/63/49/295166349.db2.gz JPJANEHGGDQLAO-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c1 ZINC000180311468 295166352 /nfs/dbraw/zinc/16/63/52/295166352.db2.gz JPJANEHGGDQLAO-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCS[C@@H](C)[C@H]2C)c1 ZINC000180311468 295166354 /nfs/dbraw/zinc/16/63/54/295166354.db2.gz JPJANEHGGDQLAO-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CC[C@@H]3C[C@@H]3C1)OCO2 ZINC000403347023 327117422 /nfs/dbraw/zinc/11/74/22/327117422.db2.gz HKPIBKHWBIFAOA-UTUOFQBUSA-N 0 3 275.348 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](CO)C(C)(C)C)c1[O-] ZINC000278789687 327195309 /nfs/dbraw/zinc/19/53/09/327195309.db2.gz WNEXOUWAKVAIIG-LBPRGKRZSA-N 0 3 287.787 2.551 20 10 CFCDHN Cc1ccc(O)c(CNC[C@H](n2cccn2)C(F)(F)F)c1 ZINC000527745107 330280402 /nfs/dbraw/zinc/28/04/02/330280402.db2.gz RGHSNVXAJMHMIU-ZDUSSCGKSA-N 0 3 299.296 2.790 20 10 CFCDHN Cc1ncccc1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000527983583 330298442 /nfs/dbraw/zinc/29/84/42/330298442.db2.gz AVSWUCDRKYZDBN-CQSZACIVSA-N 0 3 254.333 2.873 20 10 CFCDHN CC[C@@H]([NH2+]CC12CC(C1)CO2)c1ccc(C)cc1[O-] ZINC000527985058 330298552 /nfs/dbraw/zinc/29/85/52/330298552.db2.gz XHZZPVLOEIGAOF-CXOJTPOUSA-N 0 3 261.365 2.920 20 10 CFCDHN COc1ccc(CC[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000527985620 330298708 /nfs/dbraw/zinc/29/87/08/330298708.db2.gz FEUDFJNHDVCGFU-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc(CC[NH2+][C@@H](C)c2cc(C)ccc2[O-])cn1 ZINC000527989909 330299133 /nfs/dbraw/zinc/29/91/33/330299133.db2.gz HXKNVDWWDNVROB-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN O=C1Nc2ccccc2C[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000527999701 330299716 /nfs/dbraw/zinc/29/97/16/330299716.db2.gz ONMFLIUJWGSUTM-LSDHHAIUSA-N 0 3 294.354 2.533 20 10 CFCDHN O=C1Nc2ccccc2C[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000527999699 330299729 /nfs/dbraw/zinc/29/97/29/330299729.db2.gz ONMFLIUJWGSUTM-HUUCEWRRSA-N 0 3 294.354 2.533 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1ccccc1[O-] ZINC000528001954 330300120 /nfs/dbraw/zinc/30/01/20/330300120.db2.gz QIERBHSXNHEJDQ-ZBFHGGJFSA-N 0 3 296.370 2.996 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1cc(F)ccc1[O-] ZINC000528004646 330300343 /nfs/dbraw/zinc/30/03/43/330300343.db2.gz RGKOULNDKLYDHC-DMZJWBPISA-N 0 3 267.344 2.994 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1cc(F)ccc1[O-] ZINC000528004644 330300403 /nfs/dbraw/zinc/30/04/03/330300403.db2.gz RGKOULNDKLYDHC-AOVQSLKQSA-N 0 3 267.344 2.994 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000528008955 330303713 /nfs/dbraw/zinc/30/37/13/330303713.db2.gz ULHZMZNGUZFTPN-XYOMKSJCSA-N 0 3 261.365 2.781 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000529667911 333504762 /nfs/dbraw/zinc/50/47/62/333504762.db2.gz BNCCZKFKUDNPPE-HNNXBMFYSA-N 0 3 278.371 2.638 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(C)ccc1[O-] ZINC000278570805 520958132 /nfs/dbraw/zinc/95/81/32/520958132.db2.gz BZJFZPXXJYGFAW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(C)ccc1[O-] ZINC000278570805 520958141 /nfs/dbraw/zinc/95/81/41/520958141.db2.gz BZJFZPXXJYGFAW-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cccc(C)c1[O-])OC ZINC000292700965 521442019 /nfs/dbraw/zinc/44/20/19/521442019.db2.gz CGXFQOGUHOMHSK-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN CN(C)c1ccc(CNC2CC(F)(F)C2)cc1F ZINC000277743311 522205698 /nfs/dbraw/zinc/20/56/98/522205698.db2.gz VPIACPGTRBNEDN-UHFFFAOYSA-N 0 3 258.287 2.779 20 10 CFCDHN CC(=O)NCCC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263737488 519659813 /nfs/dbraw/zinc/65/98/13/519659813.db2.gz ZJHKDFKUUHGAAL-UHFFFAOYSA-N 0 3 298.386 2.675 20 10 CFCDHN CC(C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])N1CCCC1 ZINC000226584347 519816023 /nfs/dbraw/zinc/81/60/23/519816023.db2.gz VJCJRWHVAMOHJD-HNNXBMFYSA-N 0 3 280.387 2.741 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cc(C)ccc1[O-])C(C)C ZINC000188868577 520087787 /nfs/dbraw/zinc/08/77/87/520087787.db2.gz PQEANOWNIYVYKB-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)[C@H]2C[C@@H](OC)C2)c([O-])c1 ZINC000289518906 520344641 /nfs/dbraw/zinc/34/46/41/520344641.db2.gz PFJXHTNEGUZPBF-OTVXOJSOSA-N 0 3 279.380 2.790 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c([O-])c1 ZINC000289518906 520344646 /nfs/dbraw/zinc/34/46/46/520344646.db2.gz PFJXHTNEGUZPBF-OTVXOJSOSA-N 0 3 279.380 2.790 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC000314483714 520348876 /nfs/dbraw/zinc/34/88/76/520348876.db2.gz CKBCTOOHNOMYKW-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC000314483714 520348886 /nfs/dbraw/zinc/34/88/86/520348886.db2.gz CKBCTOOHNOMYKW-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@@]2(O)CCC[C@H]2C)c([O-])c1 ZINC000293237982 520366722 /nfs/dbraw/zinc/36/67/22/520366722.db2.gz ZQMYEOGNQYTAII-DYVFJYSZSA-N 0 3 293.407 2.822 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+]Cc2cccc(OC)c2[O-])C12CCC2 ZINC000266191224 520576913 /nfs/dbraw/zinc/57/69/13/520576913.db2.gz YQEHFRQSFVYWMC-GJZGRUSLSA-N 0 3 291.391 2.838 20 10 CFCDHN CCCCOCC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000040506394 520783258 /nfs/dbraw/zinc/78/32/58/520783258.db2.gz HQDQTCURIDWGPJ-LBPRGKRZSA-N 0 3 267.369 2.868 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230661867 520939209 /nfs/dbraw/zinc/93/92/09/520939209.db2.gz UKGBOBJDEFEKAO-IINYFYTJSA-N 0 3 255.333 2.733 20 10 CFCDHN CCC[C@@]1(CO)CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000290180332 520965085 /nfs/dbraw/zinc/96/50/85/520965085.db2.gz NQDULDRWBYZZIO-QGZVFWFLSA-N 0 3 294.414 2.876 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1cc(OCC)ccc1[O-])OC ZINC000295206110 521100902 /nfs/dbraw/zinc/10/09/02/521100902.db2.gz ZKRAVJHJVTWSKT-CQSZACIVSA-N 0 3 267.369 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@]2(CC)CO)c1 ZINC000191958339 521144201 /nfs/dbraw/zinc/14/42/01/521144201.db2.gz PKSCGJAGAMBEHX-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@]2(CC)CO)c1 ZINC000191958339 521144210 /nfs/dbraw/zinc/14/42/10/521144210.db2.gz PKSCGJAGAMBEHX-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCC2(OC)CCC2)c1 ZINC000292855380 521152016 /nfs/dbraw/zinc/15/20/16/521152016.db2.gz CBXJMDKPCFKINQ-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@]2(CC)CO)c1[O-] ZINC000191957726 521339810 /nfs/dbraw/zinc/33/98/10/521339810.db2.gz MZSHPIMBLPDEJH-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@]2(CC)CO)c1[O-] ZINC000191957726 521339815 /nfs/dbraw/zinc/33/98/15/521339815.db2.gz MZSHPIMBLPDEJH-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@](C)(OC)C2)c1[O-] ZINC000230300084 521340836 /nfs/dbraw/zinc/34/08/36/521340836.db2.gz DTPCUPWBYKSUJP-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@](C)(OC)C2)c1[O-] ZINC000230300084 521340843 /nfs/dbraw/zinc/34/08/43/521340843.db2.gz DTPCUPWBYKSUJP-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCC(CC)(CO)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000229209566 521453410 /nfs/dbraw/zinc/45/34/10/521453410.db2.gz FMFGAUGUNOZMOC-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN CCCN(CC(=O)NC1CCCC1)Cc1ccccc1O ZINC000263906828 521549882 /nfs/dbraw/zinc/54/98/82/521549882.db2.gz HJRBXQIMLKSURE-UHFFFAOYSA-N 0 3 290.407 2.663 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cc(OC)c(OC)cc1[O-] ZINC000290270813 521669353 /nfs/dbraw/zinc/66/93/53/521669353.db2.gz XVNFFACNDXAVFK-UHFFFAOYSA-N 0 3 297.395 2.562 20 10 CFCDHN CCC[N@H+](CCc1cnn(C)c1)Cc1ccccc1[O-] ZINC000265834946 521674594 /nfs/dbraw/zinc/67/45/94/521674594.db2.gz LWWDABKHVHMXNW-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN CCC[N@@H+](CCc1cnn(C)c1)Cc1ccccc1[O-] ZINC000265834946 521674596 /nfs/dbraw/zinc/67/45/96/521674596.db2.gz LWWDABKHVHMXNW-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN C[NH+](C)CCN(Cc1ccco1)Cc1cc(F)ccc1[O-] ZINC000289394941 521753494 /nfs/dbraw/zinc/75/34/94/521753494.db2.gz FPHSSIWMSWKURZ-UHFFFAOYSA-N 0 3 292.354 2.688 20 10 CFCDHN CC[C@H](CSC)[N@H+](C)Cc1cc(OC)ccc1[O-] ZINC000290609439 522269102 /nfs/dbraw/zinc/26/91/02/522269102.db2.gz WJIFKWHUODAWRP-GFCCVEGCSA-N 0 3 269.410 2.974 20 10 CFCDHN CC[C@H](CSC)[N@@H+](C)Cc1cc(OC)ccc1[O-] ZINC000290609439 522269110 /nfs/dbraw/zinc/26/91/10/522269110.db2.gz WJIFKWHUODAWRP-GFCCVEGCSA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@]23CCOC3)c1O ZINC000312644113 522535060 /nfs/dbraw/zinc/53/50/60/522535060.db2.gz DPYNFERODUNENP-OAHLLOKOSA-N 0 3 297.782 2.809 20 10 CFCDHN CC[C@H]([NH2+]CC1(CO)CCOCC1)c1ccc(C)cc1[O-] ZINC000280249622 522573088 /nfs/dbraw/zinc/57/30/88/522573088.db2.gz WOEJPNWFUHNUCC-HNNXBMFYSA-N 0 3 293.407 2.530 20 10 CFCDHN CC[C@H]([NH2+]CCCCCO)c1ccc(C)cc1[O-] ZINC000280295707 522581707 /nfs/dbraw/zinc/58/17/07/522581707.db2.gz ZMWOKXFNIFHASH-AWEZNQCLSA-N 0 3 251.370 2.904 20 10 CFCDHN CC[C@H]([NH2+]CC[S@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000155872833 522599487 /nfs/dbraw/zinc/59/94/87/522599487.db2.gz IEYBTBZQRHPJAL-ORAYPTAESA-N 0 3 283.437 2.980 20 10 CFCDHN CC[C@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000155872601 522600917 /nfs/dbraw/zinc/60/09/17/522600917.db2.gz IEYBTBZQRHPJAL-DJJJIMSYSA-N 0 3 283.437 2.980 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)C(F)(F)F)c1ccc(C)cc1[O-] ZINC000280121773 522609974 /nfs/dbraw/zinc/60/99/74/522609974.db2.gz OHGLBYFQMNRZKK-CMPLNLGQSA-N 0 3 277.286 2.665 20 10 CFCDHN CC[C@H]([NH2+]C[C@@](C)(O)CC)c1ccc(C)cc1[O-] ZINC000280124057 522622396 /nfs/dbraw/zinc/62/23/96/522622396.db2.gz OMUKKBGDEBBYRM-ZFWWWQNUSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+]Cc1c[nH]nc1C)c1ccc(C)cc1[O-] ZINC000280050408 522638267 /nfs/dbraw/zinc/63/82/67/522638267.db2.gz JOXKXKGMPJUANP-AWEZNQCLSA-N 0 3 259.353 2.973 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000280069860 522708532 /nfs/dbraw/zinc/70/85/32/522708532.db2.gz KYWCSVVZEUCGOV-ZOBUZTSGSA-N 0 3 293.407 2.935 20 10 CFCDHN COC(=O)C(C)(C)CCNCc1ccc(OC)c(C)c1 ZINC000281009983 522772610 /nfs/dbraw/zinc/77/26/10/522772610.db2.gz WQHKSIJHOWTMNU-UHFFFAOYSA-N 0 3 279.380 2.683 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCC(C)(F)F)cc1OC ZINC000295989424 522776332 /nfs/dbraw/zinc/77/63/32/522776332.db2.gz KDTXCAQVKAEMCV-UHFFFAOYSA-N 0 3 275.295 2.544 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@H](C)O)c1ccc(C)cc1[O-] ZINC000280077155 522831504 /nfs/dbraw/zinc/83/15/04/522831504.db2.gz LLSRAAARNYZKHF-GXTWGEPZSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]CCn1ccnc1C)c1ccc(C)cc1[O-] ZINC000279981364 522845025 /nfs/dbraw/zinc/84/50/25/522845025.db2.gz DQIPCHISOQWOCU-OAHLLOKOSA-N 0 3 273.380 2.946 20 10 CFCDHN CC[C@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[O-])C1 ZINC000160385995 523164783 /nfs/dbraw/zinc/16/47/83/523164783.db2.gz VDEAAFDCQLJFIN-NSHDSACASA-N 0 3 265.353 2.641 20 10 CFCDHN CC[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[O-])C1 ZINC000160385995 523164795 /nfs/dbraw/zinc/16/47/95/523164795.db2.gz VDEAAFDCQLJFIN-NSHDSACASA-N 0 3 265.353 2.641 20 10 CFCDHN CN1CCC[C@@]2(CC[N@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538751 523838709 /nfs/dbraw/zinc/83/87/09/523838709.db2.gz CPOOZYYGZJVVEF-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN CN1CCC[C@@]2(CC[N@@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538751 523838716 /nfs/dbraw/zinc/83/87/16/523838716.db2.gz CPOOZYYGZJVVEF-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@@H+]1CCC[C@@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538751 523838718 /nfs/dbraw/zinc/83/87/18/523838718.db2.gz CPOOZYYGZJVVEF-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@H+]1CCC[C@@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000293538751 523838721 /nfs/dbraw/zinc/83/87/21/523838721.db2.gz CPOOZYYGZJVVEF-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)N(C)C)c([O-])c1 ZINC000293937672 524329160 /nfs/dbraw/zinc/32/91/60/524329160.db2.gz YIZAQBKFSCGLHH-CYBMUJFWSA-N 0 3 264.413 3.000 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c1[O-] ZINC000245850608 524406535 /nfs/dbraw/zinc/40/65/35/524406535.db2.gz MHBURWIVCZGLOK-BBRMVZONSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c1[O-] ZINC000245850608 524406540 /nfs/dbraw/zinc/40/65/40/524406540.db2.gz MHBURWIVCZGLOK-BBRMVZONSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc(CN2C[C@@H](C)O[C@H](C3CC3)C2)c1O ZINC000280307615 524406566 /nfs/dbraw/zinc/40/65/66/524406566.db2.gz BSSWBSKTNMZTSV-DOMZBBRYSA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H]2CSCCS2)c1[O-] ZINC000164752509 524432304 /nfs/dbraw/zinc/43/23/04/524432304.db2.gz QYHDFFVXXCNTMG-LBPRGKRZSA-N 0 3 269.435 2.639 20 10 CFCDHN Cc1cccc(CNCc2cccc3c2OCO3)c1O ZINC000158118356 524436469 /nfs/dbraw/zinc/43/64/69/524436469.db2.gz LSAOHMCGKZZKEW-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCOC3(CCC3)C2)c1[O-] ZINC000271809461 524440738 /nfs/dbraw/zinc/44/07/38/524440738.db2.gz KQSQYEPYMSICOH-AWEZNQCLSA-N 0 3 261.365 2.892 20 10 CFCDHN COc1ccccc1CNCc1cccc(OC)c1O ZINC000019903190 524487479 /nfs/dbraw/zinc/48/74/79/524487479.db2.gz FRINGVGPNIZUTP-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H](CSC)C2)c1 ZINC000292697805 524742440 /nfs/dbraw/zinc/74/24/40/524742440.db2.gz BZCYTQZOPBRTCF-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H](CSC)C2)c1 ZINC000292697805 524742448 /nfs/dbraw/zinc/74/24/48/524742448.db2.gz BZCYTQZOPBRTCF-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2COc3ccccc32)c1 ZINC000070528443 524756893 /nfs/dbraw/zinc/75/68/93/524756893.db2.gz KXIOYSRIUWAYPC-AWEZNQCLSA-N 0 3 271.316 2.624 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2(O)CCCCC2)c1 ZINC000087017796 524760100 /nfs/dbraw/zinc/76/01/00/524760100.db2.gz BVRMUEHIWTUYKE-GFCCVEGCSA-N 0 3 279.380 2.747 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](C)c2cn(C)nc2C)c1 ZINC000185349605 524765218 /nfs/dbraw/zinc/76/52/18/524765218.db2.gz SQURAQQAFLNQLX-MNOVXSKESA-N 0 3 289.379 2.855 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CSC)c1 ZINC000168785777 524771742 /nfs/dbraw/zinc/77/17/42/524771742.db2.gz XTRLDKQSOQICEE-UWVGGRQHSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CSCCS2)c1 ZINC000168818927 524771989 /nfs/dbraw/zinc/77/19/89/524771989.db2.gz QSXLNBKRCJAJMY-JQWIXIFHSA-N 0 3 299.461 2.900 20 10 CFCDHN COc1ccncc1CNCc1cc(C)c(C)cc1O ZINC000292700699 524857413 /nfs/dbraw/zinc/85/74/13/524857413.db2.gz OBNZXFXUESJCLT-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](n3cccn3)C2)c1[O-] ZINC000291170383 524865519 /nfs/dbraw/zinc/86/55/19/524865519.db2.gz DNLNIRZFDFPGNK-AWEZNQCLSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](n3cccn3)C2)c1[O-] ZINC000291170383 524865528 /nfs/dbraw/zinc/86/55/28/524865528.db2.gz DNLNIRZFDFPGNK-AWEZNQCLSA-N 0 3 291.782 2.998 20 10 CFCDHN COc1ncccc1CN[C@@H](C)c1cc(F)ccc1O ZINC000094617603 525061576 /nfs/dbraw/zinc/06/15/76/525061576.db2.gz YJRXXFHOTMTNPG-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290411500 525343020 /nfs/dbraw/zinc/34/30/20/525343020.db2.gz KBSAOJFXSQLZGW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290411500 525343024 /nfs/dbraw/zinc/34/30/24/525343024.db2.gz KBSAOJFXSQLZGW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)CC(C)C)c1 ZINC000040775403 525363151 /nfs/dbraw/zinc/36/31/51/525363151.db2.gz CNZIMUCKHCNKOU-OLZOCXBDSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCN3CCCC[C@@H]23)c1 ZINC000217698263 525364511 /nfs/dbraw/zinc/36/45/11/525364511.db2.gz MAUUJODTONCJNA-BPUTZDHNSA-N 0 3 274.408 2.978 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCc2nccn2C1)c1cc(F)ccc1[O-] ZINC000278891682 525421484 /nfs/dbraw/zinc/42/14/84/525421484.db2.gz DSTWOEPAUNGVIF-NWDGAFQWSA-N 0 3 289.354 2.641 20 10 CFCDHN C[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1ccccc1[O-] ZINC000278684828 525421765 /nfs/dbraw/zinc/42/17/65/525421765.db2.gz GNPPHNIVPXFADA-CYBMUJFWSA-N 0 3 275.392 2.986 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1ccccc1[O-] ZINC000272916040 525424060 /nfs/dbraw/zinc/42/40/60/525424060.db2.gz XKNQTHRQQHXAKC-STQMWFEESA-N 0 3 277.364 2.729 20 10 CFCDHN C[C@H](NCc1ccc(N2CCCC2)cc1)c1cn[nH]c1 ZINC000229883121 525445866 /nfs/dbraw/zinc/44/58/66/525445866.db2.gz OVVXUYMOCWNLQH-ZDUSSCGKSA-N 0 3 270.380 2.861 20 10 CFCDHN C[C@H](NCc1ccn(C)c1)c1ccc(N2CCOCC2)cc1 ZINC000158436291 525468989 /nfs/dbraw/zinc/46/89/89/525468989.db2.gz KEERFPLBEICJIN-HNNXBMFYSA-N 0 3 299.418 2.713 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)C1CCCC1 ZINC000070305612 525517060 /nfs/dbraw/zinc/51/70/60/525517060.db2.gz ISKOQSVGLKELGU-SNVBAGLBSA-N 0 3 263.337 2.789 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000168801591 525525176 /nfs/dbraw/zinc/52/51/76/525525176.db2.gz GANQILYAQULYFL-GARJFASQSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCN(c2ncccn2)C1)c1ccccc1[O-] ZINC000192815442 525555951 /nfs/dbraw/zinc/55/59/51/525555951.db2.gz YSYXNZDGMWGVJK-UONOGXRCSA-N 0 3 298.390 2.502 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000248526212 525592014 /nfs/dbraw/zinc/59/20/14/525592014.db2.gz UWJTVBDWXBNCNB-FOOGCRFISA-N 0 3 279.355 2.995 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H]1CCOC1 ZINC000168801790 525603294 /nfs/dbraw/zinc/60/32/94/525603294.db2.gz GANQILYAQULYFL-OUAUKWLOSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@@H](N[C@@H]1CCCc2c[nH]nc21)c1ccccc1O ZINC000272846855 525641063 /nfs/dbraw/zinc/64/10/63/525641063.db2.gz KJQLNZQIMVKFNT-ZWNOBZJWSA-N 0 3 257.337 2.844 20 10 CFCDHN CSC[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000291809390 525650453 /nfs/dbraw/zinc/65/04/53/525650453.db2.gz CSMXIOAQWVIVLQ-LLVKDONJSA-N 0 3 295.404 2.696 20 10 CFCDHN CSC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000291809390 525650458 /nfs/dbraw/zinc/65/04/58/525650458.db2.gz CSMXIOAQWVIVLQ-LLVKDONJSA-N 0 3 295.404 2.696 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CC=CCC2)c([O-])c1 ZINC000281005853 525724136 /nfs/dbraw/zinc/72/41/36/525724136.db2.gz NVKNTABGTBQPRA-CQSZACIVSA-N 0 3 260.381 2.613 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)C2CCCC2)c([O-])c1 ZINC000290203131 525740774 /nfs/dbraw/zinc/74/07/74/525740774.db2.gz PHOBFRDVEGMQIQ-DOMZBBRYSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc(CC[NH2+]Cc2cccc(OC)c2[O-])c1 ZINC000227437851 525901786 /nfs/dbraw/zinc/90/17/86/525901786.db2.gz JCSKTNSYKMEAGA-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC[C@H](C)CO)c([O-])c1 ZINC000230669777 525919153 /nfs/dbraw/zinc/91/91/53/525919153.db2.gz MJYXNSFTGGOCRW-STQMWFEESA-N 0 3 251.370 2.760 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@H](C)[C@H](OC)C23CCC3)c1[O-] ZINC000365024310 526034073 /nfs/dbraw/zinc/03/40/73/526034073.db2.gz WWFNPVGCKKMUSB-XZJROXQQSA-N 0 3 291.391 2.694 20 10 CFCDHN Cc1cnn([C@H]2CC[N@H+](Cc3cccc(C)c3[O-])C2)c1 ZINC000290960400 526269538 /nfs/dbraw/zinc/26/95/38/526269538.db2.gz RKZMKAWMWSHPDK-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@H]2CC[N@@H+](Cc3cccc(C)c3[O-])C2)c1 ZINC000290960400 526269539 /nfs/dbraw/zinc/26/95/39/526269539.db2.gz RKZMKAWMWSHPDK-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1nnc(CC[NH2+]Cc2cc(Cl)cc(C)c2[O-])s1 ZINC000291516676 526329022 /nfs/dbraw/zinc/32/90/22/526329022.db2.gz ITXYUNXIYBHUPZ-UHFFFAOYSA-N 0 3 297.811 2.846 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@H]1CC=CCC1)OCO2 ZINC000045629329 526336874 /nfs/dbraw/zinc/33/68/74/526336874.db2.gz QKJXGFVYHOASLO-NSHDSACASA-N 0 3 261.321 2.567 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC2(C1)CCOCC2 ZINC000272464290 526348368 /nfs/dbraw/zinc/34/83/68/526348368.db2.gz RBXWVNVKYFPMSY-UHFFFAOYSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC2(C1)CCOCC2 ZINC000272464290 526348372 /nfs/dbraw/zinc/34/83/72/526348372.db2.gz RBXWVNVKYFPMSY-UHFFFAOYSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000289407025 526349260 /nfs/dbraw/zinc/34/92/60/526349260.db2.gz HIDCABBBHLFUCF-MRXNPFEDSA-N 0 3 275.323 2.745 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 ZINC000290570228 526351772 /nfs/dbraw/zinc/35/17/72/526351772.db2.gz TUJFVQKFLVTITL-HYVNUMGLSA-N 0 3 269.319 2.959 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000278357576 526371202 /nfs/dbraw/zinc/37/12/02/526371202.db2.gz JHZUJZWSIOKRND-WCQYABFASA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000278357576 526371207 /nfs/dbraw/zinc/37/12/07/526371207.db2.gz JHZUJZWSIOKRND-WCQYABFASA-N 0 3 289.297 2.527 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](OC)C(C)C)c([O-])c1 ZINC000744448348 574075249 /nfs/dbraw/zinc/07/52/49/574075249.db2.gz IIYDTSGWXSUUOO-HNNXBMFYSA-N 0 3 267.369 2.552 20 10 CFCDHN COc1cc(C)cc(CN(C)C[C@H]2CCCCO2)c1O ZINC000754723348 574116316 /nfs/dbraw/zinc/11/63/16/574116316.db2.gz QKGDIEUFXWCYOR-CQSZACIVSA-N 0 3 279.380 2.710 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000738548212 574172750 /nfs/dbraw/zinc/17/27/50/574172750.db2.gz JZTRSZXYHIPCIH-GFCCVEGCSA-N 0 3 294.420 2.544 20 10 CFCDHN CC(=O)N1CCC([NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])CC1 ZINC000756363234 574229993 /nfs/dbraw/zinc/22/99/93/574229993.db2.gz PIPFYUPVDKXOOU-ZDUSSCGKSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c1 ZINC000756431306 574236599 /nfs/dbraw/zinc/23/65/99/574236599.db2.gz BWZAHRLOAKEAPU-DOMZBBRYSA-N 0 3 262.397 2.691 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C2CCOCC2)c2c1c(F)ccc2[O-] ZINC000756432213 574236702 /nfs/dbraw/zinc/23/67/02/574236702.db2.gz IKFQJIBHJFOXQH-CABZTGNLSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C1CC1)N(C)C)c1cc(F)ccc1[O-] ZINC000756433958 574236799 /nfs/dbraw/zinc/23/67/99/574236799.db2.gz ROUPDHJHWGTGFB-QMTHXVAHSA-N 0 3 266.360 2.522 20 10 CFCDHN CCN(CC)C(=O)CN[C@@H](C)c1ccc(C)c(C)c1O ZINC000756460193 574238777 /nfs/dbraw/zinc/23/87/77/574238777.db2.gz YSCBVYSWAOOXDZ-ZDUSSCGKSA-N 0 3 278.396 2.528 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccccc2CO)c1 ZINC000756459587 574238808 /nfs/dbraw/zinc/23/88/08/574238808.db2.gz PQSJSQMKIZXECB-GFCCVEGCSA-N 0 3 287.359 2.744 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756462957 574239394 /nfs/dbraw/zinc/23/93/94/574239394.db2.gz ZMSRAISRFVMBCK-ZDUSSCGKSA-N 0 3 278.396 2.576 20 10 CFCDHN COC(=O)N1CCC[C@H]([NH2+][C@@H](C)c2cc(C)ccc2[O-])C1 ZINC000756528674 574243549 /nfs/dbraw/zinc/24/35/49/574243549.db2.gz OPGNVCHIFMKJDX-STQMWFEESA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(C)C1)c1cc2c(cc1[O-])CCCC2 ZINC000756536315 574244165 /nfs/dbraw/zinc/24/41/65/574244165.db2.gz UWHPCZKWGPFUFL-IUODEOHRSA-N 0 3 274.408 2.626 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@@H]2CCOC2)c([O-])c1C ZINC000756564182 574248389 /nfs/dbraw/zinc/24/83/89/574248389.db2.gz QYDFKDCCGCRDGI-LSDHHAIUSA-N 0 3 293.407 2.713 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756603631 574251970 /nfs/dbraw/zinc/25/19/70/574251970.db2.gz JESAZDZQPOHDHH-NHCYSSNCSA-N 0 3 299.411 2.783 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CC[C@@H](C)C2)c([O-])c1 ZINC000756626221 574253107 /nfs/dbraw/zinc/25/31/07/574253107.db2.gz AXLCEGMEWGLSPP-KGLIPLIRSA-N 0 3 262.397 2.693 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756643978 574254399 /nfs/dbraw/zinc/25/43/99/574254399.db2.gz WVTCMZLCISKZBQ-ADEWGFFLSA-N 0 3 267.344 2.686 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](CO)Cc2ccco2)c1 ZINC000756659735 574256481 /nfs/dbraw/zinc/25/64/81/574256481.db2.gz FNRIUEOFABUZLH-ZIAGYGMSSA-N 0 3 289.375 2.795 20 10 CFCDHN Cc1noc(CCC[NH2+][C@H](C)c2cc(F)ccc2[O-])n1 ZINC000756687925 574257503 /nfs/dbraw/zinc/25/75/03/574257503.db2.gz WPYMFAWXURAJJS-SECBINFHSA-N 0 3 279.315 2.506 20 10 CFCDHN Cc1n[nH]cc1C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756736678 574260151 /nfs/dbraw/zinc/26/01/51/574260151.db2.gz CCNMBCUXJFKVJR-PRHODGIISA-N 0 3 275.327 2.901 20 10 CFCDHN Cc1c(C[NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)cnn1C ZINC000756774521 574261512 /nfs/dbraw/zinc/26/15/12/574261512.db2.gz DKAJWTPEYBTHGO-ZANVPECISA-N 0 3 289.354 2.911 20 10 CFCDHN CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756786049 574262742 /nfs/dbraw/zinc/26/27/42/574262742.db2.gz IIKVVUGRVCMVMW-FIXISWKDSA-N 0 3 267.344 2.997 20 10 CFCDHN CO[C@@H](CN[C@H](C)c1cc(C)ccc1O)C(F)(F)F ZINC000756834606 574266555 /nfs/dbraw/zinc/26/65/55/574266555.db2.gz HNYYMCWAFIADTL-SKDRFNHKSA-N 0 3 277.286 2.929 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](C)c1ccncc1 ZINC000749296035 574288501 /nfs/dbraw/zinc/28/85/01/574288501.db2.gz MMJCQKANLWPMSR-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)Cc2ccncc2)c1 ZINC000749300272 574289002 /nfs/dbraw/zinc/28/90/02/574289002.db2.gz XZMUHFIHGRWHBF-CYBMUJFWSA-N 0 3 256.349 2.816 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](C)CN2CCCCC2)cc1C ZINC000742366816 574324533 /nfs/dbraw/zinc/32/45/33/574324533.db2.gz UPTOFFKIVXXRNY-HNNXBMFYSA-N 0 3 276.424 2.973 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCc1ccccc1 ZINC000725841353 574324618 /nfs/dbraw/zinc/32/46/18/574324618.db2.gz BLVHBTJZMRDDPI-UHFFFAOYSA-N 0 3 257.333 2.733 20 10 CFCDHN CO[C@@H]1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000751939178 574385343 /nfs/dbraw/zinc/38/53/43/574385343.db2.gz JEVXWWCIUPCFFR-CYBMUJFWSA-N 0 3 279.380 2.616 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@H]2CCCCS2)cc1OC ZINC000753567766 574404744 /nfs/dbraw/zinc/40/47/44/574404744.db2.gz APXGRUTXDGPGSK-GFCCVEGCSA-N 0 3 297.420 2.785 20 10 CFCDHN COCC[C@H](Cc1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000753571745 574404952 /nfs/dbraw/zinc/40/49/52/574404952.db2.gz ZHFQCRYZFIBFQI-CQSZACIVSA-N 0 3 293.338 2.862 20 10 CFCDHN COc1ccc(C[N@H+](C)C2CCCC2)c([O-])c1OC ZINC000891537518 617654377 /nfs/dbraw/zinc/65/43/77/617654377.db2.gz UKEFXWHVXCMHTN-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1ccc(C[N@@H+](C)C2CCCC2)c([O-])c1OC ZINC000891537518 617654380 /nfs/dbraw/zinc/65/43/80/617654380.db2.gz UKEFXWHVXCMHTN-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN CCc1nn(C)cc1CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000091741878 618178934 /nfs/dbraw/zinc/17/89/34/618178934.db2.gz JJMSUJMIKRZHGQ-ZDUSSCGKSA-N 0 3 286.423 2.899 20 10 CFCDHN COc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c([O-])c1OC ZINC000891449187 618214040 /nfs/dbraw/zinc/21/40/40/618214040.db2.gz NUFXXLVVPHQMQU-TXEJJXNPSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([O-])c1OC ZINC000891449187 618214042 /nfs/dbraw/zinc/21/40/42/618214042.db2.gz NUFXXLVVPHQMQU-TXEJJXNPSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CC[C@H]2C)c1[O-] ZINC000310286530 618276834 /nfs/dbraw/zinc/27/68/34/618276834.db2.gz MKPJLQRBLRQSFW-KCJUWKMLSA-N 0 3 255.745 2.942 20 10 CFCDHN CN(C)c1ccc(CNCc2cn(C)nc2C2CC2)cc1 ZINC000892476088 618337117 /nfs/dbraw/zinc/33/71/17/618337117.db2.gz QCTSMMRMWQTGKA-UHFFFAOYSA-N 0 3 284.407 2.653 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCCN2C)c1ccnnc1 ZINC000924871453 618348375 /nfs/dbraw/zinc/34/83/75/618348375.db2.gz NINPSUCKPPGQRT-ZDUSSCGKSA-N 0 3 282.391 2.710 20 10 CFCDHN CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OC)cc2[O-])C1 ZINC000894186326 618432470 /nfs/dbraw/zinc/43/24/70/618432470.db2.gz VGCFJVPMBAZGKZ-HIFRSBDPSA-N 0 3 279.380 2.838 20 10 CFCDHN CCO[C@H]1CCC[C@H]([NH2+]Cc2ccc(OC)cc2[O-])C1 ZINC000894186332 618432569 /nfs/dbraw/zinc/43/25/69/618432569.db2.gz VGCFJVPMBAZGKZ-ZFWWWQNUSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc(F)c(C)c2)c([O-])c1 ZINC000894184745 618432932 /nfs/dbraw/zinc/43/29/32/618432932.db2.gz FLQCOAWOEBEMQY-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN CO[C@H](C[NH2+]Cc1c(C)cccc1[O-])CC(C)C ZINC000877593223 618441734 /nfs/dbraw/zinc/44/17/34/618441734.db2.gz QMNWBGZTJPMLPI-ZDUSSCGKSA-N 0 3 251.370 2.851 20 10 CFCDHN CC[C@@H](C)C[C@@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877605869 618443274 /nfs/dbraw/zinc/44/32/74/618443274.db2.gz KLPVHYILDKYWNS-YPMHNXCESA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]([NH+](C)C)C2)c(Cl)c1 ZINC000840915996 618467917 /nfs/dbraw/zinc/46/79/17/618467917.db2.gz OAXPHAFQKBPNSM-LBPRGKRZSA-N 0 3 282.815 2.880 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@@H]2CC(C)=NO2)cc1 ZINC000895311812 618527095 /nfs/dbraw/zinc/52/70/95/618527095.db2.gz RQLHFGXFSRESGY-INIZCTEOSA-N 0 3 275.396 2.787 20 10 CFCDHN COC1(C(F)(F)F)CC[NH+](Cc2ccccc2[O-])CC1 ZINC000841888242 618552755 /nfs/dbraw/zinc/55/27/55/618552755.db2.gz GGSKXFZDQNARDD-UHFFFAOYSA-N 0 3 289.297 2.936 20 10 CFCDHN CC[C@@H]([NH2+]CCCS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000840888192 618700368 /nfs/dbraw/zinc/70/03/68/618700368.db2.gz CNGCIBFWGOGFKU-CQSZACIVSA-N 0 3 299.436 2.566 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(=O)NC(C)(C)C)c([O-])c1 ZINC000228334809 618893467 /nfs/dbraw/zinc/89/34/67/618893467.db2.gz SCRAKUJOBTZEAU-LBPRGKRZSA-N 0 3 278.396 2.656 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000183400169 618905859 /nfs/dbraw/zinc/90/58/59/618905859.db2.gz WTTDLKUUSHEOLD-LLVKDONJSA-N 0 3 273.380 2.636 20 10 CFCDHN COc1cccc(CN[C@H]2CCc3cccnc32)c1O ZINC000894763830 619462324 /nfs/dbraw/zinc/46/23/24/619462324.db2.gz BJNZSHJFIONMMC-ZDUSSCGKSA-N 0 3 270.332 2.573 20 10 CFCDHN COC(=O)[C@H](C[NH2+]Cc1ccc(C)cc1[O-])CC(C)C ZINC000894791594 619465056 /nfs/dbraw/zinc/46/50/56/619465056.db2.gz UPEJILMABMPEQZ-AWEZNQCLSA-N 0 3 279.380 2.626 20 10 CFCDHN CCC1(C)CN(Cc2ccc(OC)c(OC)c2O)C1 ZINC000894838527 619479323 /nfs/dbraw/zinc/47/93/23/619479323.db2.gz ASTIENIRQNIRJB-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](CF)C1 ZINC000895545380 619552615 /nfs/dbraw/zinc/55/26/15/619552615.db2.gz CYIIJYJRSRIDRR-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](CF)C1 ZINC000895545380 619552619 /nfs/dbraw/zinc/55/26/19/619552619.db2.gz CYIIJYJRSRIDRR-NSHDSACASA-N 0 3 253.317 2.582 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(F)CC2)c([O-])c1 ZINC000895551510 619553356 /nfs/dbraw/zinc/55/33/56/619553356.db2.gz XZAPMKGANBDUQU-UHFFFAOYSA-N 0 3 253.317 2.725 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCN(Cc2ccc(C)cc2O)C1 ZINC000895573771 619557480 /nfs/dbraw/zinc/55/74/80/619557480.db2.gz MGBYRVKZAMKCNK-CYBMUJFWSA-N 0 3 289.297 2.854 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CC(CC2CCOCC2)C1 ZINC000895615250 619568390 /nfs/dbraw/zinc/56/83/90/619568390.db2.gz KEPYNIIRUSWLRE-UHFFFAOYSA-N 0 3 279.355 2.780 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1CCC2(COC2)CC1 ZINC000895695456 619587345 /nfs/dbraw/zinc/58/73/45/619587345.db2.gz WVVDEERQLVQBQJ-UHFFFAOYSA-N 0 3 265.328 2.580 20 10 CFCDHN C[C@H]([NH2+]Cc1cnn(C)c1C1CC1)c1ccccc1[O-] ZINC000895852590 619623426 /nfs/dbraw/zinc/62/34/26/619623426.db2.gz XFGWFFMGCCYEFG-NSHDSACASA-N 0 3 271.364 2.854 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1c2ccccc2CC[C@H]1O ZINC000897342128 620004190 /nfs/dbraw/zinc/00/41/90/620004190.db2.gz RTYIMERLELTMCD-SJORKVTESA-N 0 3 287.334 2.669 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H]1CCCC[C@@H]1O ZINC000897537430 620222141 /nfs/dbraw/zinc/22/21/41/620222141.db2.gz XVASQAYOFHBCLI-ZFWWWQNUSA-N 0 3 263.381 2.731 20 10 CFCDHN COc1cccc(CN[C@H](C)c2cncs2)c1O ZINC000897934524 620304242 /nfs/dbraw/zinc/30/42/42/620304242.db2.gz KWVMFIAPKPYROT-SECBINFHSA-N 0 3 264.350 2.708 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)Cc2cccnc2)c([O-])c1 ZINC000897970215 620305699 /nfs/dbraw/zinc/30/56/99/620305699.db2.gz QRDUTWOITYIXGI-ZDUSSCGKSA-N 0 3 286.375 2.907 20 10 CFCDHN CCO[C@]12CCC[C@@]1([NH2+]Cc1ccccc1[O-])CCO2 ZINC000897978763 620317736 /nfs/dbraw/zinc/31/77/36/620317736.db2.gz RLDOKQJQSVVMGB-CVEARBPZSA-N 0 3 277.364 2.558 20 10 CFCDHN c1cc(CNCc2ccc3c(c2)CCCO3)cc2nonc12 ZINC000897990302 620319248 /nfs/dbraw/zinc/31/92/48/620319248.db2.gz PGIJDXJTIZHBGX-UHFFFAOYSA-N 0 3 295.342 2.838 20 10 CFCDHN CC1(C)CCC[C@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000898048082 620321246 /nfs/dbraw/zinc/32/12/46/620321246.db2.gz FGRYPEZYTVCNEN-CYBMUJFWSA-N 0 3 267.344 2.969 20 10 CFCDHN COC(=O)C[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000898300047 620367975 /nfs/dbraw/zinc/36/79/75/620367975.db2.gz GKYNHVGMONLUFO-INIZCTEOSA-N 0 3 299.370 2.656 20 10 CFCDHN CCC[C@H](O)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000927019962 620440148 /nfs/dbraw/zinc/44/01/48/620440148.db2.gz VBYUDJREOXYRBW-PWSUYJOCSA-N 0 3 255.333 2.733 20 10 CFCDHN Cc1ccc(C[N@@H+]2C[C@@H]3CSC[C@]3(C)C2)c([O-])c1 ZINC000898420548 620462088 /nfs/dbraw/zinc/46/20/88/620462088.db2.gz WKYCJFIODYWFJA-HIFRSBDPSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2C[C@@H]3CSC[C@]3(C)C2)c([O-])c1 ZINC000898420548 620462090 /nfs/dbraw/zinc/46/20/90/620462090.db2.gz WKYCJFIODYWFJA-HIFRSBDPSA-N 0 3 263.406 2.886 20 10 CFCDHN C[C@H](N[C@@H]1C[NH2+]CC1(C)C)c1cc(Cl)ccc1[O-] ZINC000902450790 621091431 /nfs/dbraw/zinc/09/14/31/621091431.db2.gz UKEYVLKADNNRDP-TVQRCGJNSA-N 0 3 268.788 2.694 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000903265861 621306176 /nfs/dbraw/zinc/30/61/76/621306176.db2.gz PSDWOQVIJFQCLH-PKPZWWHKSA-N 0 3 265.328 2.749 20 10 CFCDHN C[C@H]1CC2(CC([NH2+][C@@H]3CCc4cccc([O-])c43)C2)CO1 ZINC000903277886 621310892 /nfs/dbraw/zinc/31/08/92/621310892.db2.gz ANNDIFUNJDFIBW-AJQURBJUSA-N 0 3 273.376 2.927 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@H](C)c2cc(F)ccc2[O-])CCOC1 ZINC000903357524 621347682 /nfs/dbraw/zinc/34/76/82/621347682.db2.gz MZOAQUSSIBWEDK-MLGOLLRUSA-N 0 3 297.370 2.766 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCN(CC)C1=O)c1ccc(C)cc1[O-] ZINC000903387786 621359137 /nfs/dbraw/zinc/35/91/37/621359137.db2.gz JBJSTNVSYWUFBO-HUUCEWRRSA-N 0 3 290.407 2.752 20 10 CFCDHN CC(C)N(Cc1ccc(N(C)C)cc1)Cc1ccc(N)nn1 ZINC000904308425 621570512 /nfs/dbraw/zinc/57/05/12/621570512.db2.gz PUXDKTRHUDCBHN-UHFFFAOYSA-N 0 3 299.422 2.535 20 10 CFCDHN N[C@@H]1c2ccccc2C[C@H]1[NH2+]Cc1c([O-])cccc1Cl ZINC000904462274 621596945 /nfs/dbraw/zinc/59/69/45/621596945.db2.gz SRMCQHSUCCBMCP-GDBMZVCRSA-N 0 3 288.778 2.760 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1ccccc1[O-] ZINC000183494308 625508211 /nfs/dbraw/zinc/50/82/11/625508211.db2.gz QFFVISWMPMFSLB-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccsc1)c1ccccc1[O-] ZINC000183523837 625513877 /nfs/dbraw/zinc/51/38/77/625513877.db2.gz FJHRDAFHYMLSOF-IINYFYTJSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccsc1)c1ccccc1[O-] ZINC000183523856 625514035 /nfs/dbraw/zinc/51/40/35/625514035.db2.gz FJHRDAFHYMLSOF-QMTHXVAHSA-N 0 3 263.362 2.838 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1ccc(C)cc1[O-] ZINC000876564998 622911110 /nfs/dbraw/zinc/91/11/10/622911110.db2.gz QQEGIKQWJJABLF-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1ccc(C)cc1[O-] ZINC000876564998 622911113 /nfs/dbraw/zinc/91/11/13/622911113.db2.gz QQEGIKQWJJABLF-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000227685754 623116737 /nfs/dbraw/zinc/11/67/37/623116737.db2.gz YGWQRTSFWBYXOT-NWDGAFQWSA-N 0 3 294.395 2.956 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2C[C@@H](OC)C2(C)C)c1[O-] ZINC000230935098 623309967 /nfs/dbraw/zinc/30/99/67/623309967.db2.gz RQIPPNRSHKCMCK-QWHCGFSZSA-N 0 3 299.798 2.957 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1ccc(OCC)cc1[O-])OC ZINC000824543617 623521050 /nfs/dbraw/zinc/52/10/50/623521050.db2.gz MEGIAVIBWDQAAT-CQSZACIVSA-N 0 3 267.369 2.696 20 10 CFCDHN CC[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637713 623537257 /nfs/dbraw/zinc/53/72/57/623537257.db2.gz ZGWYEVADXONRMC-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Cl)cc(OC)c1[O-] ZINC000824637713 623537262 /nfs/dbraw/zinc/53/72/62/623537262.db2.gz ZGWYEVADXONRMC-ZWNOBZJWSA-N 0 3 299.798 2.647 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000184941045 625663801 /nfs/dbraw/zinc/66/38/01/625663801.db2.gz HDEBNDVLSJZKGO-JTQLQIEISA-N 0 3 291.370 2.775 20 10 CFCDHN CO[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104068 623631076 /nfs/dbraw/zinc/63/10/76/623631076.db2.gz LYXMHSSYMXRVOF-HUUCEWRRSA-N 0 3 261.365 2.782 20 10 CFCDHN CO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104068 623631085 /nfs/dbraw/zinc/63/10/85/623631085.db2.gz LYXMHSSYMXRVOF-HUUCEWRRSA-N 0 3 261.365 2.782 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)c2cnn(CC)c2)c([O-])c1 ZINC000825129701 623635977 /nfs/dbraw/zinc/63/59/77/623635977.db2.gz AZYDDSHIMJLBHY-LBPRGKRZSA-N 0 3 289.379 2.858 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000825321864 623670697 /nfs/dbraw/zinc/67/06/97/623670697.db2.gz PMQQBEUXHIUUQV-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000825321864 623670703 /nfs/dbraw/zinc/67/07/03/623670703.db2.gz PMQQBEUXHIUUQV-LBPRGKRZSA-N 0 3 267.344 2.780 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2cccc(OC)c2[O-])CC1 ZINC000825321860 623670959 /nfs/dbraw/zinc/67/09/59/623670959.db2.gz PLGLQJPPWIVKTR-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2cccc(OC)c2[O-])CC1 ZINC000825321860 623670962 /nfs/dbraw/zinc/67/09/62/623670962.db2.gz PLGLQJPPWIVKTR-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000185030421 625674013 /nfs/dbraw/zinc/67/40/13/625674013.db2.gz AGLIIGCKRUGHQH-CQSZACIVSA-N 0 3 292.423 3.000 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC2CC(OC)C2)c1[O-] ZINC000826796565 623877138 /nfs/dbraw/zinc/87/71/38/623877138.db2.gz KUPSLSXSLPYVBB-UHFFFAOYSA-N 0 3 299.798 2.959 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@](C)(C3CC3)C2)c1 ZINC000826877748 623901205 /nfs/dbraw/zinc/90/12/05/623901205.db2.gz LIPXXGVCALZRKQ-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](CO)CC2CC2)c1[O-] ZINC000827358711 623993044 /nfs/dbraw/zinc/99/30/44/623993044.db2.gz DWWRXYFFPUPOAT-LLVKDONJSA-N 0 3 299.798 2.552 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)c1[O-] ZINC000827489995 624016036 /nfs/dbraw/zinc/01/60/36/624016036.db2.gz ZWUNMRNDUIQZAD-PTEHBNRSSA-N 0 3 267.756 2.942 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3COC[C@H]3C2)c1[O-] ZINC000827596129 624041698 /nfs/dbraw/zinc/04/16/98/624041698.db2.gz VGKADSLGPUHXKD-DGCLKSJQSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1[O-] ZINC000827596129 624041704 /nfs/dbraw/zinc/04/17/04/624041704.db2.gz VGKADSLGPUHXKD-DGCLKSJQSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)c1[O-] ZINC000827596128 624041935 /nfs/dbraw/zinc/04/19/35/624041935.db2.gz VGKADSLGPUHXKD-AAEUAGOBSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1[O-] ZINC000827596128 624041940 /nfs/dbraw/zinc/04/19/40/624041940.db2.gz VGKADSLGPUHXKD-AAEUAGOBSA-N 0 3 281.783 2.822 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](CO)Cc1ccccc1)CC2 ZINC000834531314 625702789 /nfs/dbraw/zinc/70/27/89/625702789.db2.gz VUOFQRZLMQHDNB-NVXWUHKLSA-N 0 3 297.398 2.820 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)NCc1ccccc1)c1ccccc1[O-] ZINC000154124190 624272430 /nfs/dbraw/zinc/27/24/30/624272430.db2.gz LNXFBDVNMKKBFL-AWEZNQCLSA-N 0 3 298.386 2.749 20 10 CFCDHN COc1ccc2c(c1)C[C@H](C[N@H+](C)Cc1ccccc1[O-])O2 ZINC000929974941 624335588 /nfs/dbraw/zinc/33/55/88/624335588.db2.gz CGQGGMYWAGTPBB-MRXNPFEDSA-N 0 3 299.370 2.836 20 10 CFCDHN COc1ccc2c(c1)C[C@H](C[N@@H+](C)Cc1ccccc1[O-])O2 ZINC000929974941 624335591 /nfs/dbraw/zinc/33/55/91/624335591.db2.gz CGQGGMYWAGTPBB-MRXNPFEDSA-N 0 3 299.370 2.836 20 10 CFCDHN CC(C)[C@@H]1C[N@H+](Cc2ccccc2[O-])CCS1 ZINC000179584743 624968358 /nfs/dbraw/zinc/96/83/58/624968358.db2.gz WUROSISWTMGORA-AWEZNQCLSA-N 0 3 251.395 2.966 20 10 CFCDHN CC(C)[C@@H]1C[N@@H+](Cc2ccccc2[O-])CCS1 ZINC000179584743 624968361 /nfs/dbraw/zinc/96/83/61/624968361.db2.gz WUROSISWTMGORA-AWEZNQCLSA-N 0 3 251.395 2.966 20 10 CFCDHN O=C(CC[NH2+][C@H]1CCc2cccc([O-])c21)Nc1ccccc1 ZINC000834585942 625727241 /nfs/dbraw/zinc/72/72/41/625727241.db2.gz WDTDWVYZADKVEX-HNNXBMFYSA-N 0 3 296.370 2.998 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@@H]1CCCO1 ZINC000834694491 625788139 /nfs/dbraw/zinc/78/81/39/625788139.db2.gz VULQBVUWTORQGL-GUTXKFCHSA-N 0 3 261.365 2.927 20 10 CFCDHN COC1(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000186147085 625851092 /nfs/dbraw/zinc/85/10/92/625851092.db2.gz SSRIECVHQRUHPD-ZDUSSCGKSA-N 0 3 279.380 2.547 20 10 CFCDHN CO[C@H](CC[NH2+][C@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834779568 625853983 /nfs/dbraw/zinc/85/39/83/625853983.db2.gz NKGDKBOKZKXGFS-CMPLNLGQSA-N 0 3 289.297 2.937 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)c1cc[nH]c(=O)c1 ZINC000834810224 625873168 /nfs/dbraw/zinc/87/31/68/625873168.db2.gz ALOKAZSMIAKIBS-GXFFZTMASA-N 0 3 270.332 2.831 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F)[C@H](C)O ZINC000834886617 625909607 /nfs/dbraw/zinc/90/96/07/625909607.db2.gz DYFUFYNSZWKIFO-FSZOTQKASA-N 0 3 267.344 2.829 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCC2(CO)CC2)c2c1c(F)ccc2[O-] ZINC000834895969 625912499 /nfs/dbraw/zinc/91/24/99/625912499.db2.gz GFICKAMVWCYVMZ-JQWIXIFHSA-N 0 3 279.355 2.832 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000769141242 625914449 /nfs/dbraw/zinc/91/44/49/625914449.db2.gz LHKCMIBZTPTADO-QWRGUYRKSA-N 0 3 267.394 2.727 20 10 CFCDHN CCc1ncc(CN[C@H]2CCc3cccc(O)c32)o1 ZINC000834900876 625915580 /nfs/dbraw/zinc/91/55/80/625915580.db2.gz SUCFQXIWTYFKNI-LBPRGKRZSA-N 0 3 258.321 2.720 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@]2(C)CCC(=O)N2)c1[O-] ZINC000834907844 625918914 /nfs/dbraw/zinc/91/89/14/625918914.db2.gz DJWFIGUXQRSXJV-MEBBXXQBSA-N 0 3 296.798 2.673 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CC2(O)CCCC2)c([O-])c1 ZINC000769448596 625924103 /nfs/dbraw/zinc/92/41/03/625924103.db2.gz UUOAVSNGVZMRKM-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CC2(O)CCCC2)c([O-])c1 ZINC000769448596 625924104 /nfs/dbraw/zinc/92/41/04/625924104.db2.gz UUOAVSNGVZMRKM-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CC[C@@H](C[NH2+]Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000922598200 626320225 /nfs/dbraw/zinc/32/02/25/626320225.db2.gz ACTMGHVLGCXADD-LBPRGKRZSA-N 0 3 279.380 2.850 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCCN1CC(F)(F)F ZINC000922707849 626347954 /nfs/dbraw/zinc/34/79/54/626347954.db2.gz FHXJWKMOHAUNAG-LBPRGKRZSA-N 0 3 288.313 2.509 20 10 CFCDHN CCOc1ccc(O)c(CNCc2c(C)noc2CC)c1 ZINC000922988856 626440248 /nfs/dbraw/zinc/44/02/48/626440248.db2.gz VPWKLXADYXUUNP-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN CCOc1ccc(C[NH2+]C2([C@@H]3CCCCO3)CC2)c([O-])c1 ZINC000923026906 626443867 /nfs/dbraw/zinc/44/38/67/626443867.db2.gz DNNDLBQJKBVSEU-INIZCTEOSA-N 0 3 291.391 2.982 20 10 CFCDHN C[C@H](O)C[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000757654373 626557306 /nfs/dbraw/zinc/55/73/06/626557306.db2.gz DJMGFVRODUTVGD-GMOBBJLQSA-N 0 3 267.344 2.829 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2Cc3cccc(O)c3C2)c([O-])c1 ZINC000758559410 626598449 /nfs/dbraw/zinc/59/84/49/626598449.db2.gz IMRAKJAHTBGCQH-AWEZNQCLSA-N 0 3 299.370 2.754 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1(C)C ZINC000758998479 626623277 /nfs/dbraw/zinc/62/32/77/626623277.db2.gz CKNRTZUMLAMLBJ-ABAIWWIYSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1(C)C ZINC000758998479 626623280 /nfs/dbraw/zinc/62/32/80/626623280.db2.gz CKNRTZUMLAMLBJ-ABAIWWIYSA-N 0 3 291.391 2.686 20 10 CFCDHN CN(Cc1cccn1C)Cc1cc2c(cc1O)CCC2 ZINC000760402440 626742547 /nfs/dbraw/zinc/74/25/47/626742547.db2.gz PMOPJVGJRSKXLU-UHFFFAOYSA-N 0 3 270.376 2.851 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC2(O)CCC2)c1[O-] ZINC000761220864 626816900 /nfs/dbraw/zinc/81/69/00/626816900.db2.gz ZKHSUWZFIBXCKR-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC2(O)CCC2)c1[O-] ZINC000761220864 626816902 /nfs/dbraw/zinc/81/69/02/626816902.db2.gz ZKHSUWZFIBXCKR-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](OC)[C@@H]1CCOC1 ZINC000851792376 634532506 /nfs/dbraw/zinc/53/25/06/634532506.db2.gz OCCZXNSCDBQLJG-NVXWUHKLSA-N 0 3 293.407 2.656 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](OC)[C@@H]1CCOC1 ZINC000851792376 634532509 /nfs/dbraw/zinc/53/25/09/634532509.db2.gz OCCZXNSCDBQLJG-NVXWUHKLSA-N 0 3 293.407 2.656 20 10 CFCDHN CCOc1ccc(C[NH2+]C(C)(C)CCC(=O)OC)c([O-])c1 ZINC000762788183 626937551 /nfs/dbraw/zinc/93/75/51/626937551.db2.gz VZNSSBGLIBOWCB-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)C[C@H](O)c1ccco1 ZINC000763524829 626995156 /nfs/dbraw/zinc/99/51/56/626995156.db2.gz MRAGLDBZIPHMMB-RISCZKNCSA-N 0 3 291.347 2.596 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CCO)C2CCOCC2)c([O-])c1 ZINC000763559047 626997702 /nfs/dbraw/zinc/99/77/02/626997702.db2.gz QJCIKRMXKFNCCD-BBRMVZONSA-N 0 3 293.407 2.529 20 10 CFCDHN CCC1(C)CC[NH+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768443292 627342399 /nfs/dbraw/zinc/34/23/99/627342399.db2.gz DUVLXNWENWHCPR-HNNXBMFYSA-N 0 3 291.391 2.830 20 10 CFCDHN C[C@H]1CCCCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768445081 627342684 /nfs/dbraw/zinc/34/26/84/627342684.db2.gz FDEUGNHNTGETGL-NHYWBVRUSA-N 0 3 277.364 2.583 20 10 CFCDHN C[C@H]1CCCCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@@H]2O ZINC000768445081 627342688 /nfs/dbraw/zinc/34/26/88/627342688.db2.gz FDEUGNHNTGETGL-NHYWBVRUSA-N 0 3 277.364 2.583 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)CC1CCCCC1 ZINC000768442649 627343356 /nfs/dbraw/zinc/34/33/56/627343356.db2.gz YEQVRMABXBMZCH-INIZCTEOSA-N 0 3 291.391 2.830 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)CC1CCCCC1 ZINC000768442649 627343364 /nfs/dbraw/zinc/34/33/64/627343364.db2.gz YEQVRMABXBMZCH-INIZCTEOSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768448433 627344084 /nfs/dbraw/zinc/34/40/84/627344084.db2.gz UXABBWNJKVYARL-MLGOLLRUSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768448433 627344088 /nfs/dbraw/zinc/34/40/88/627344088.db2.gz UXABBWNJKVYARL-MLGOLLRUSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2c([O-])cccc2OC)CCS1 ZINC000769445148 627439340 /nfs/dbraw/zinc/43/93/40/627439340.db2.gz FNPLECOIARZVKI-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2c([O-])cccc2OC)CCS1 ZINC000769445148 627439342 /nfs/dbraw/zinc/43/93/42/627439342.db2.gz FNPLECOIARZVKI-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000769451514 627440490 /nfs/dbraw/zinc/44/04/90/627440490.db2.gz MRKSRUGVXUZJNW-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000769451514 627440493 /nfs/dbraw/zinc/44/04/93/627440493.db2.gz MRKSRUGVXUZJNW-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCC1CCOCC1 ZINC000769468083 627443872 /nfs/dbraw/zinc/44/38/72/627443872.db2.gz ABXMBCGZDBXFCJ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCC1CCOCC1 ZINC000769468083 627443874 /nfs/dbraw/zinc/44/38/74/627443874.db2.gz ABXMBCGZDBXFCJ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]Cc1ccc2c(c1)COC2 ZINC000769927091 627488289 /nfs/dbraw/zinc/48/82/89/627488289.db2.gz DRPOHKGIASADTJ-UHFFFAOYSA-N 0 3 285.343 2.721 20 10 CFCDHN COc1cccc(O)c1CNCc1ccc2c(c1)COC2 ZINC000769927091 627488291 /nfs/dbraw/zinc/48/82/91/627488291.db2.gz DRPOHKGIASADTJ-UHFFFAOYSA-N 0 3 285.343 2.721 20 10 CFCDHN C[C@H](N[C@H](CO)c1ccsc1)c1ccccc1O ZINC000769987943 627494571 /nfs/dbraw/zinc/49/45/71/627494571.db2.gz WKFOJYIKXPKUQH-GXFFZTMASA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1ccsc1)c1ccccc1[O-] ZINC000769987943 627494574 /nfs/dbraw/zinc/49/45/74/627494574.db2.gz WKFOJYIKXPKUQH-GXFFZTMASA-N 0 3 263.362 2.838 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000769996220 627495189 /nfs/dbraw/zinc/49/51/89/627495189.db2.gz UGFJAYRBERVNFO-NHIOUQHZSA-N 0 3 279.355 2.996 20 10 CFCDHN CCN(C)c1ccc(CN2CCc3cc[nH]c(=O)c3C2)cc1 ZINC000773887078 627868067 /nfs/dbraw/zinc/86/80/67/627868067.db2.gz ASPUHFFVZIOOQZ-UHFFFAOYSA-N 0 3 297.402 2.802 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H](C)c1ccnn1C ZINC000774194327 627901103 /nfs/dbraw/zinc/90/11/03/627901103.db2.gz XCLQOERQDSVGFD-ZDUSSCGKSA-N 0 3 272.396 2.645 20 10 CFCDHN CCCCNC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000774480979 627931512 /nfs/dbraw/zinc/93/15/12/627931512.db2.gz GPFZOCCNMIKKQB-KBPBESRZSA-N 0 3 291.439 2.708 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(OC)CCCCC1 ZINC000775321147 628009401 /nfs/dbraw/zinc/00/94/01/628009401.db2.gz PIJSRPBPHMFXHH-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](CO)Cc1ccco1)c1ccccc1[O-] ZINC000775512861 628033288 /nfs/dbraw/zinc/03/32/88/628033288.db2.gz CTMXURTYRZYAGN-XJKSGUPXSA-N 0 3 289.375 2.877 20 10 CFCDHN CC[C@@H](NCc1cc(C)ncn1)c1ccccc1O ZINC000775524617 628033710 /nfs/dbraw/zinc/03/37/10/628033710.db2.gz UANTYFPGHHBMBM-CQSZACIVSA-N 0 3 257.337 2.732 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)ncn1)c1ccccc1[O-] ZINC000775524617 628033715 /nfs/dbraw/zinc/03/37/15/628033715.db2.gz UANTYFPGHHBMBM-CQSZACIVSA-N 0 3 257.337 2.732 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCC(C)(C)O)c2c1c(F)ccc2[O-] ZINC000775585539 628043174 /nfs/dbraw/zinc/04/31/74/628043174.db2.gz GVIXTHXXKOWNFP-ONGXEEELSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2CC(N)=O)c1[O-] ZINC000775663522 628052091 /nfs/dbraw/zinc/05/20/91/628052091.db2.gz DMBLEZJVBUQVFV-CYBMUJFWSA-N 0 3 296.798 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2CC(N)=O)c1[O-] ZINC000775663522 628052094 /nfs/dbraw/zinc/05/20/94/628052094.db2.gz DMBLEZJVBUQVFV-CYBMUJFWSA-N 0 3 296.798 2.584 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)[C@H](C)[C@H]2C)c1O ZINC000775984021 628090701 /nfs/dbraw/zinc/09/07/01/628090701.db2.gz FBDLIGSNMWRTDS-GHMZBOCLSA-N 0 3 298.814 2.579 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000776173900 628110971 /nfs/dbraw/zinc/11/09/71/628110971.db2.gz CVRZHJCFKGXOBR-CQSZACIVSA-N 0 3 271.788 2.995 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@]2(C)CCOC2)c1[O-] ZINC000776175541 628112269 /nfs/dbraw/zinc/11/22/69/628112269.db2.gz SOELNNJYECXOLU-CQSZACIVSA-N 0 3 269.772 2.870 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cccc(C)c1[O-])C1CCOCC1 ZINC000776230996 628120431 /nfs/dbraw/zinc/12/04/31/628120431.db2.gz DWAPXDLIWMYSLL-OAHLLOKOSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@H](C3CC3)C2)c1 ZINC000776770449 628176587 /nfs/dbraw/zinc/17/65/87/628176587.db2.gz ARYWDVKVANZSKI-HNNXBMFYSA-N 0 3 261.365 2.620 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@@H](C(C)C)C2)cc1C ZINC000777969908 628269034 /nfs/dbraw/zinc/26/90/34/628269034.db2.gz TUDGZQKBNMQVNJ-MRXNPFEDSA-N 0 3 263.381 2.866 20 10 CFCDHN CC(C)[C@@H]1C[C@H](C[NH2+]Cc2ccccc2[O-])CCO1 ZINC000778630917 628321466 /nfs/dbraw/zinc/32/14/66/628321466.db2.gz GZCCWNQFBWEFPJ-CJNGLKHVSA-N 0 3 263.381 2.933 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCn3ccnc3C2)c([O-])c1 ZINC000779066588 628349750 /nfs/dbraw/zinc/34/97/50/628349750.db2.gz SKLDMQLQWFFPJU-CHWSQXEVSA-N 0 3 271.364 2.563 20 10 CFCDHN C[C@H](Cc1ccncc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779087761 628351501 /nfs/dbraw/zinc/35/15/01/628351501.db2.gz PEIMLIOTFZWULC-LLVKDONJSA-N 0 3 260.312 2.647 20 10 CFCDHN COc1cccc(CN2CCC[C@@H](OC(F)F)C2)c1O ZINC000781533072 628557492 /nfs/dbraw/zinc/55/74/92/628557492.db2.gz YADGVCDYNJNPAD-LLVKDONJSA-N 0 3 287.306 2.604 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1cccc(F)c1)c1ccccc1[O-] ZINC000783522202 628716582 /nfs/dbraw/zinc/71/65/82/628716582.db2.gz MLIFUAOXONTMDY-XHDPSFHLSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@H](N[C@H](CO)c1cccc(F)c1)c1ccccc1O ZINC000783522202 628716587 /nfs/dbraw/zinc/71/65/87/628716587.db2.gz MLIFUAOXONTMDY-XHDPSFHLSA-N 0 3 275.323 2.916 20 10 CFCDHN CC1(C)CCC[C@](O)(C[NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000783735558 628739443 /nfs/dbraw/zinc/73/94/43/628739443.db2.gz QZTWBLZHDZQNKY-MRXNPFEDSA-N 0 3 281.371 2.952 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCCS1 ZINC000784616328 628831453 /nfs/dbraw/zinc/83/14/53/628831453.db2.gz KGRGNCSDIAOQQU-NSHDSACASA-N 0 3 267.394 2.776 20 10 CFCDHN CCn1cccc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])c1=O ZINC000788606262 629085763 /nfs/dbraw/zinc/08/57/63/629085763.db2.gz WZHVRBRKZJEVGT-CYBMUJFWSA-N 0 3 286.375 2.733 20 10 CFCDHN CCC[N@H+](CCC[C@H](C)O)Cc1ccccc1[O-] ZINC000789326386 629147604 /nfs/dbraw/zinc/14/76/04/629147604.db2.gz HFHAOCQLIWBCLP-ZDUSSCGKSA-N 0 3 251.370 2.765 20 10 CFCDHN CCC[N@@H+](CCC[C@H](C)O)Cc1ccccc1[O-] ZINC000789326386 629147607 /nfs/dbraw/zinc/14/76/07/629147607.db2.gz HFHAOCQLIWBCLP-ZDUSSCGKSA-N 0 3 251.370 2.765 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@]2(CC)CO)c([O-])c1 ZINC000789568068 629167313 /nfs/dbraw/zinc/16/73/13/629167313.db2.gz VZYPFGYUXIPAIO-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@]2(CC)CO)c([O-])c1 ZINC000789568068 629167317 /nfs/dbraw/zinc/16/73/17/629167317.db2.gz VZYPFGYUXIPAIO-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCSCC[C@H]1C ZINC000792195973 629408283 /nfs/dbraw/zinc/40/82/83/629408283.db2.gz HLKBTEBGLCUSQG-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCSCC[C@H]1C ZINC000792195973 629408288 /nfs/dbraw/zinc/40/82/88/629408288.db2.gz HLKBTEBGLCUSQG-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CCN(CC)c1ccc(C[NH2+]Cc2ncccc2[O-])cc1 ZINC000793257815 629516429 /nfs/dbraw/zinc/51/64/29/629516429.db2.gz UVPLBXCFQCIZBB-UHFFFAOYSA-N 0 3 285.391 2.923 20 10 CFCDHN COc1ccc(C[NH2+]C2CC(C(F)F)C2)c([O-])c1 ZINC000793385567 629535333 /nfs/dbraw/zinc/53/53/33/629535333.db2.gz BYWDAJOLJFZEFI-UHFFFAOYSA-N 0 3 257.280 2.534 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCCC1)c1ccc(C)cc1[O-] ZINC000794791603 629686567 /nfs/dbraw/zinc/68/65/67/629686567.db2.gz BQTCZURXSFOSAX-OAHLLOKOSA-N 0 3 262.397 2.837 20 10 CFCDHN CC[C@@H](CCO)[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794801299 629687619 /nfs/dbraw/zinc/68/76/19/629687619.db2.gz JIOINHGFPWJKQI-JSGCOSHPSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794805159 629688079 /nfs/dbraw/zinc/68/80/79/629688079.db2.gz FYCZBKWWPGECBQ-CZUORRHYSA-N 0 3 274.408 2.978 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)COCC1CC1)c1ccc(C)cc1[O-] ZINC000794802656 629688143 /nfs/dbraw/zinc/68/81/43/629688143.db2.gz GIDUPDKNPWINSN-GOEBONIOSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000794809037 629688919 /nfs/dbraw/zinc/68/89/19/629688919.db2.gz PFZSKCNAOXDECV-HOCLYGCPSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000794816107 629690541 /nfs/dbraw/zinc/69/05/41/629690541.db2.gz KJXOJLCRACLFGG-HOTGVXAUSA-N 0 3 293.407 2.529 20 10 CFCDHN CNC(=O)C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])c1ccccc1 ZINC000795849708 629841543 /nfs/dbraw/zinc/84/15/43/629841543.db2.gz QGXAKDXPFFVSOY-CZUORRHYSA-N 0 3 298.386 2.920 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccccc1[O-] ZINC000797057246 630010176 /nfs/dbraw/zinc/01/01/76/630010176.db2.gz OCBBTBVVJXNMHL-GFCCVEGCSA-N 0 3 267.332 2.891 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)COC(C)C ZINC000801597410 630461817 /nfs/dbraw/zinc/46/18/17/630461817.db2.gz GZQAPQALCYGFLL-MRXNPFEDSA-N 0 3 295.423 2.780 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)COC(C)C ZINC000801597410 630461822 /nfs/dbraw/zinc/46/18/22/630461822.db2.gz GZQAPQALCYGFLL-MRXNPFEDSA-N 0 3 295.423 2.780 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](CO)c2cccnc2)c([O-])c1 ZINC000806178906 630780517 /nfs/dbraw/zinc/78/05/17/630780517.db2.gz LGOHWWAOTBARKU-DZGCQCFKSA-N 0 3 286.375 2.522 20 10 CFCDHN CCN(CCC[NH+](CC)CC)C(=O)c1cc([O-])cs1 ZINC000807368553 630881510 /nfs/dbraw/zinc/88/15/10/630881510.db2.gz ITPVVFYIJCTGAF-UHFFFAOYSA-N 0 3 284.425 2.648 20 10 CFCDHN COc1cc([C@H](C)NCc2ccc3c(c2)CCO3)ccn1 ZINC000808432665 630991626 /nfs/dbraw/zinc/99/16/26/630991626.db2.gz WCYIIUAFEHQHQC-LBPRGKRZSA-N 0 3 284.359 2.876 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000808449759 630993867 /nfs/dbraw/zinc/99/38/67/630993867.db2.gz GBJTVGSNGWGRMG-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)CCO)c1[O-] ZINC000808697671 631031097 /nfs/dbraw/zinc/03/10/97/631031097.db2.gz QQXKFHNQXFNJCJ-ZJUUUORDSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc([O-])c(CN(C)CCC[NH+](C)C)c(Cl)c1 ZINC000840945795 631274851 /nfs/dbraw/zinc/27/48/51/631274851.db2.gz BIOVUZFBLYMEAG-UHFFFAOYSA-N 0 3 270.804 2.738 20 10 CFCDHN COc1cccc(CNCc2ccc(-c3cc[nH]n3)o2)c1O ZINC000809740342 631274860 /nfs/dbraw/zinc/27/48/60/631274860.db2.gz UUJFHBMVXFWNBL-UHFFFAOYSA-N 0 3 299.330 2.674 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@]1(C)CCCO ZINC000809757152 631283604 /nfs/dbraw/zinc/28/36/04/631283604.db2.gz KBWPOCVDXYQFBX-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@]1(C)CCCO ZINC000809757152 631283609 /nfs/dbraw/zinc/28/36/09/631283609.db2.gz KBWPOCVDXYQFBX-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CO[C@@](C)([C@@H](C)[NH2+]Cc1cc(F)ccc1[O-])C1CC1 ZINC000840961203 631285425 /nfs/dbraw/zinc/28/54/25/631285425.db2.gz SGXXKLYYIOKGDY-BMIGLBTASA-N 0 3 267.344 2.825 20 10 CFCDHN CC[N@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC(C)(C)C1 ZINC000840185607 631294545 /nfs/dbraw/zinc/29/45/45/631294545.db2.gz ZOMWSZAXYFXLRU-HNNXBMFYSA-N 0 3 291.391 2.829 20 10 CFCDHN CC[N@@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC(C)(C)C1 ZINC000840185607 631294548 /nfs/dbraw/zinc/29/45/48/631294548.db2.gz ZOMWSZAXYFXLRU-HNNXBMFYSA-N 0 3 291.391 2.829 20 10 CFCDHN CCCC[C@@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841029474 631309886 /nfs/dbraw/zinc/30/98/86/631309886.db2.gz BVGQNWYHHJAZCE-VIFPVBQESA-N 0 3 274.767 2.792 20 10 CFCDHN CCCC[C@@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841029474 631309896 /nfs/dbraw/zinc/30/98/96/631309896.db2.gz BVGQNWYHHJAZCE-VIFPVBQESA-N 0 3 274.767 2.792 20 10 CFCDHN CCCC[C@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841028649 631310910 /nfs/dbraw/zinc/31/09/10/631310910.db2.gz GFIQVAHDYSMYTH-GFCCVEGCSA-N 0 3 256.777 2.653 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)CN(C)C(C)C)c([O-])c1 ZINC000810163490 631337893 /nfs/dbraw/zinc/33/78/93/631337893.db2.gz WBQWUULWXAOWPJ-ZDUSSCGKSA-N 0 3 280.412 2.609 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCOC)COC)c1ccc(C)cc1[O-] ZINC000810256483 631350932 /nfs/dbraw/zinc/35/09/32/631350932.db2.gz AORSVBLMRCDGGL-DZGCQCFKSA-N 0 3 281.396 2.793 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(Cl)cc1[O-] ZINC000841756829 631468218 /nfs/dbraw/zinc/46/82/18/631468218.db2.gz KLPRVRHYFXTMJH-WDEREUQCSA-N 0 3 270.804 2.894 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](CC(C)C)OC ZINC000841888902 631487978 /nfs/dbraw/zinc/48/79/78/631487978.db2.gz UTGHGXQTTRWTMQ-GFCCVEGCSA-N 0 3 267.369 2.552 20 10 CFCDHN CN(Cc1cc(F)ccc1[O-])C(C)(C)C[NH+]1CCCC1 ZINC000841893244 631490484 /nfs/dbraw/zinc/49/04/84/631490484.db2.gz HMCAHYBTNDBQCB-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CCCC[C@](C)(CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000842745758 631726219 /nfs/dbraw/zinc/72/62/19/631726219.db2.gz FYVSCVXLHLAVPM-MRXNPFEDSA-N 0 3 281.396 2.822 20 10 CFCDHN CO[C@@H]1COC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000842752473 631728976 /nfs/dbraw/zinc/72/89/76/631728976.db2.gz MQRGWGGGWXMQKL-SJLPKXTDSA-N 0 3 299.370 2.563 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1=O)c1cc(F)ccc1[O-] ZINC000842886434 631773266 /nfs/dbraw/zinc/77/32/66/631773266.db2.gz SAJKDYRLGCDNJF-GWCFXTLKSA-N 0 3 294.370 2.581 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@]2(O)CCOC2)c([O-])c1 ZINC000842918774 631781705 /nfs/dbraw/zinc/78/17/05/631781705.db2.gz IYBAWJWWFWSANP-DYVFJYSZSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)[C@]1(O)CCOC1)c1ccccc1[O-] ZINC000842918252 631781794 /nfs/dbraw/zinc/78/17/94/631781794.db2.gz DXLYBDUIXQKHFM-YOEHRIQHSA-N 0 3 293.407 2.611 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCO)CSC)c1ccccc1[O-] ZINC000155979930 650039398 /nfs/dbraw/zinc/03/93/98/650039398.db2.gz MVIIRIKSLCFUFA-AAEUAGOBSA-N 0 3 269.410 2.547 20 10 CFCDHN COC(=O)[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1C ZINC000843412659 631946205 /nfs/dbraw/zinc/94/62/05/631946205.db2.gz SHARUFGHOCJGGA-ZWNOBZJWSA-N 0 3 297.782 2.595 20 10 CFCDHN COC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1C ZINC000843412659 631946208 /nfs/dbraw/zinc/94/62/08/631946208.db2.gz SHARUFGHOCJGGA-ZWNOBZJWSA-N 0 3 297.782 2.595 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1[O-] ZINC000843417899 631948964 /nfs/dbraw/zinc/94/89/64/631948964.db2.gz WYLKTBNQDKZXFC-CABCVRRESA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1[O-] ZINC000843417899 631948970 /nfs/dbraw/zinc/94/89/70/631948970.db2.gz WYLKTBNQDKZXFC-CABCVRRESA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419714 631950238 /nfs/dbraw/zinc/95/02/38/631950238.db2.gz QLXCHMFZVLVOPA-CQSZACIVSA-N 0 3 254.333 2.777 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000843419714 631950239 /nfs/dbraw/zinc/95/02/39/631950239.db2.gz QLXCHMFZVLVOPA-CQSZACIVSA-N 0 3 254.333 2.777 20 10 CFCDHN Cn1c2ccccc2cc(C[NH2+]Cc2ccccc2[O-])c1=O ZINC000813790593 631960393 /nfs/dbraw/zinc/96/03/93/631960393.db2.gz SBKYJHPIAPEUCZ-UHFFFAOYSA-N 0 3 294.354 2.534 20 10 CFCDHN C[NH+](C)[C@@H]1CCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000156067765 650042749 /nfs/dbraw/zinc/04/27/49/650042749.db2.gz HQASCMCKARNLCL-CYBMUJFWSA-N 0 3 268.788 2.572 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1ccccc1[O-])C1(CO)CCC1 ZINC000814169201 632021019 /nfs/dbraw/zinc/02/10/19/632021019.db2.gz FDZVYBYSVJTHOQ-OAHLLOKOSA-N 0 3 263.381 2.669 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](CSC)C1 ZINC000814179388 632024945 /nfs/dbraw/zinc/02/49/45/632024945.db2.gz SLXIQEVOPLWGLT-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](CSC)C1 ZINC000814179388 632024941 /nfs/dbraw/zinc/02/49/41/632024941.db2.gz SLXIQEVOPLWGLT-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](CSC)C1 ZINC000814179389 632025348 /nfs/dbraw/zinc/02/53/48/632025348.db2.gz SLXIQEVOPLWGLT-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](CSC)C1 ZINC000814179389 632025351 /nfs/dbraw/zinc/02/53/51/632025351.db2.gz SLXIQEVOPLWGLT-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cncc(C)n1)c1ccccc1[O-] ZINC000844312469 632165665 /nfs/dbraw/zinc/16/56/65/632165665.db2.gz LBXHROGEHAJFSW-OAHLLOKOSA-N 0 3 271.364 2.774 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2cncc(C)c2)cc1 ZINC000844401145 632196370 /nfs/dbraw/zinc/19/63/70/632196370.db2.gz IFBDWFDVFCRJLC-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN Cc1cc(C)c([C@@H](C)NCc2cc(C)ncn2)c(O)c1 ZINC000815599262 632295589 /nfs/dbraw/zinc/29/55/89/632295589.db2.gz OUEIBVYLZKVWJN-CYBMUJFWSA-N 0 3 271.364 2.958 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000816535869 632479047 /nfs/dbraw/zinc/47/90/47/632479047.db2.gz CTSFWSFGKLDODD-NWDGAFQWSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000816535869 632479051 /nfs/dbraw/zinc/47/90/51/632479051.db2.gz CTSFWSFGKLDODD-NWDGAFQWSA-N 0 3 298.789 2.901 20 10 CFCDHN COc1cc(OC)c(CNCc2ccccc2O)cc1F ZINC000845928697 632598762 /nfs/dbraw/zinc/59/87/62/632598762.db2.gz FMYNUNIXGTVVNI-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@](C)(O)c1ccccc1 ZINC000846038971 632620949 /nfs/dbraw/zinc/62/09/49/632620949.db2.gz OREDUGGEKRKPFT-GUYCJALGSA-N 0 3 271.360 2.778 20 10 CFCDHN CO[C@@H]1[C@H](C)[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000817407981 632621792 /nfs/dbraw/zinc/62/17/92/632621792.db2.gz BQZZUAWVYHRCER-OWYVNGRQSA-N 0 3 267.344 2.680 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CC1)C1CCOCC1 ZINC000846043002 632622868 /nfs/dbraw/zinc/62/28/68/632622868.db2.gz RBYROQISYVZXMZ-MRXNPFEDSA-N 0 3 261.365 2.687 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000846058792 632626200 /nfs/dbraw/zinc/62/62/00/632626200.db2.gz UWJFLLKIRIFUEI-WBVHZDCISA-N 0 3 284.359 2.797 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCO[C@H](CC)C2)c([O-])c1 ZINC000817415701 632626753 /nfs/dbraw/zinc/62/67/53/632626753.db2.gz WYKZYSZLUPFWHH-UONOGXRCSA-N 0 3 279.380 2.838 20 10 CFCDHN C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000846206429 632659494 /nfs/dbraw/zinc/65/94/94/632659494.db2.gz YRUDVNQITKORTE-QWRGUYRKSA-N 0 3 267.344 2.997 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@]1(O)CCCOC1)c1ccc(C)cc1[O-] ZINC000846215197 632663474 /nfs/dbraw/zinc/66/34/74/632663474.db2.gz ZCXIPSYZUFCLOH-NVXWUHKLSA-N 0 3 293.407 2.673 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000817588820 632672072 /nfs/dbraw/zinc/67/20/72/632672072.db2.gz ROQXPQNSHUJGNF-OCCSQVGLSA-N 0 3 291.391 2.553 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cc(C)nnc2C)c1 ZINC000930216546 632692438 /nfs/dbraw/zinc/69/24/38/632692438.db2.gz JZWRPDRANFVIDF-GFCCVEGCSA-N 0 3 287.363 2.658 20 10 CFCDHN C[C@H](NC[C@@H]1CCC[NH2+]1)c1ccc2ccccc2c1[O-] ZINC000817951333 632751357 /nfs/dbraw/zinc/75/13/57/632751357.db2.gz DXXMLFNAURYOHL-JSGCOSHPSA-N 0 3 270.376 2.948 20 10 CFCDHN CCC(N)(CC)C[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000817959978 632758002 /nfs/dbraw/zinc/75/80/02/632758002.db2.gz JLKLQSPVFHSYPU-SNVBAGLBSA-N 0 3 254.349 2.699 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](N)C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817964516 632762750 /nfs/dbraw/zinc/76/27/50/632762750.db2.gz BEZNKIKNCCFMCY-PRHODGIISA-N 0 3 288.313 2.799 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CNCC[C@H]1C)c1ccc(F)cc1[O-] ZINC000817969727 632769030 /nfs/dbraw/zinc/76/90/30/632769030.db2.gz YUVNZZWVHPHLAJ-DDTOSNHZSA-N 0 3 266.360 2.570 20 10 CFCDHN C[C@H](N)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817971725 632770819 /nfs/dbraw/zinc/77/08/19/632770819.db2.gz GOXGQJCBEHCAJY-BQBZGAKWSA-N 0 3 263.168 2.697 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2C[C@H](F)CN2)c1[O-] ZINC000817976136 632774363 /nfs/dbraw/zinc/77/43/63/632774363.db2.gz GZFYSGMPTVIPKZ-USWWRNFRSA-N 0 3 286.778 2.705 20 10 CFCDHN C[C@H](N[C@@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1[O-] ZINC000817981100 632777833 /nfs/dbraw/zinc/77/78/33/632777833.db2.gz PYBFFHCQPVGMLO-QPUJVOFHSA-N 0 3 290.741 2.693 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(F)cc1[O-] ZINC000818614551 632880004 /nfs/dbraw/zinc/88/00/04/632880004.db2.gz BYYCBUFTSQPZAA-MGPQQGTHSA-N 0 3 266.360 2.842 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c1[O-] ZINC000857062162 635922129 /nfs/dbraw/zinc/92/21/29/635922129.db2.gz YSWWUUJPOIWXRR-GWCFXTLKSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c1[O-] ZINC000857062162 635922131 /nfs/dbraw/zinc/92/21/31/635922131.db2.gz YSWWUUJPOIWXRR-GWCFXTLKSA-N 0 3 283.799 2.804 20 10 CFCDHN CCc1cccc(CNCc2cccc(N(C)C)n2)c1O ZINC000848899488 633388351 /nfs/dbraw/zinc/38/83/51/633388351.db2.gz OWQPLQBBSSKNNM-UHFFFAOYSA-N 0 3 285.391 2.705 20 10 CFCDHN O[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000850369543 633959839 /nfs/dbraw/zinc/95/98/39/633959839.db2.gz BAPIOJIDOUCCKF-DLBZAZTESA-N 0 3 281.355 2.890 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1COc2cc(F)ccc2C1 ZINC000850382837 633968843 /nfs/dbraw/zinc/96/88/43/633968843.db2.gz YXOPKMVONLIJHE-CQSZACIVSA-N 0 3 273.307 2.625 20 10 CFCDHN C[C@H](O)[C@H](NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000850420436 633985403 /nfs/dbraw/zinc/98/54/03/633985403.db2.gz OUCCKFUXOWCWEH-UGSOOPFHSA-N 0 3 283.371 2.833 20 10 CFCDHN COC1CC(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000850482013 634012044 /nfs/dbraw/zinc/01/20/44/634012044.db2.gz LYJIUXCMGMULIB-XSRFYTQQSA-N 0 3 267.344 2.997 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)C1CCOCC1)c1ccccc1[O-] ZINC000850494907 634017899 /nfs/dbraw/zinc/01/78/99/634017899.db2.gz ZVXHBBQEMCZBOM-JKSUJKDBSA-N 0 3 293.407 2.875 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)CC1CC1)c1cc(F)ccc1[O-] ZINC000850545880 634047754 /nfs/dbraw/zinc/04/77/54/634047754.db2.gz UCRTVKJBSMUOJN-PWSUYJOCSA-N 0 3 267.344 2.591 20 10 CFCDHN CNC[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233079 635268604 /nfs/dbraw/zinc/26/86/04/635268604.db2.gz WQXHXQRIIPQUTE-IUCAKERBSA-N 0 3 276.302 2.670 20 10 CFCDHN C[NH2+]C[C@H](C)N[C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233079 635268608 /nfs/dbraw/zinc/26/86/08/635268608.db2.gz WQXHXQRIIPQUTE-IUCAKERBSA-N 0 3 276.302 2.670 20 10 CFCDHN CC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])C1 ZINC000857084337 635927303 /nfs/dbraw/zinc/92/73/03/635927303.db2.gz NDUJNZKHKWRHPC-GXFFZTMASA-N 0 3 296.798 2.625 20 10 CFCDHN CC(C)C[C@@H](CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858106813 636126746 /nfs/dbraw/zinc/12/67/46/636126746.db2.gz STMWTRWAPSCGRL-LBPRGKRZSA-N 0 3 286.366 2.527 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccnc(F)c1 ZINC000858138978 636137241 /nfs/dbraw/zinc/13/72/41/636137241.db2.gz NDBFJPKDOWXFTN-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@@]2(C)CCCO2)cc1F ZINC000858149580 636141252 /nfs/dbraw/zinc/14/12/52/636141252.db2.gz OYNYIUKHAQYVTE-OAHLLOKOSA-N 0 3 284.350 2.690 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000858291355 636178596 /nfs/dbraw/zinc/17/85/96/636178596.db2.gz WRTGFGZBZQWGKC-DRXBFXEBSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1C[C@@H](O)C1 ZINC000858295963 636179975 /nfs/dbraw/zinc/17/99/75/636179975.db2.gz HPQWAOABLOREAI-XFHMXUHZSA-N 0 3 283.371 2.920 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000858482238 636267115 /nfs/dbraw/zinc/26/71/15/636267115.db2.gz WJLUDNAROWTOHJ-DMDPSCGWSA-N 0 3 278.371 2.763 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](CO)Cc1c[nH]c2ccccc12 ZINC000200640637 636475232 /nfs/dbraw/zinc/47/52/32/636475232.db2.gz GNNRVGDNBATRRW-HNNXBMFYSA-N 0 3 296.370 2.567 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000189993324 650406236 /nfs/dbraw/zinc/40/62/36/650406236.db2.gz JZJKZWOBQKXTLM-RYUDHWBXSA-N 0 3 294.395 2.956 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000189993339 650406286 /nfs/dbraw/zinc/40/62/86/650406286.db2.gz JZJKZWOBQKXTLM-NEPJUHHUSA-N 0 3 294.395 2.956 20 10 CFCDHN Cc1cc(CNCCCSc2nccs2)on1 ZINC000865468335 638354759 /nfs/dbraw/zinc/35/47/59/638354759.db2.gz GPYSZWUNXQRIBG-UHFFFAOYSA-N 0 3 269.395 2.712 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H]1C[C@@H](CO)C1 ZINC000865662708 638496865 /nfs/dbraw/zinc/49/68/65/638496865.db2.gz IROKXKNLKYOJCI-XFHMXUHZSA-N 0 3 283.371 2.920 20 10 CFCDHN C[C@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1ccccc1[O-] ZINC000865715029 638530767 /nfs/dbraw/zinc/53/07/67/638530767.db2.gz HHJNTQUULRIRBY-QGZVFWFLSA-N 0 3 289.350 2.615 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@H](O)C2CCCC2)c([O-])c1 ZINC000865876729 638637932 /nfs/dbraw/zinc/63/79/32/638637932.db2.gz XMWGSXLDSGPHAK-INIZCTEOSA-N 0 3 293.407 2.822 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CCO[C@H](C(F)F)CC1 ZINC000872254338 641718971 /nfs/dbraw/zinc/71/89/71/641718971.db2.gz ZXJRZMKBIIHGRT-HNNXBMFYSA-N 0 3 298.377 2.917 20 10 CFCDHN CCCOc1ccc(CNCC[S@](=O)CC)cc1C ZINC000873048976 641995956 /nfs/dbraw/zinc/99/59/56/641995956.db2.gz UFLLBFCNPIKCFC-LJQANCHMSA-N 0 3 283.437 2.642 20 10 CFCDHN CCCOc1ccc(CN[C@@H](C)C(=O)N(C)CC)cc1C ZINC000873113260 642014820 /nfs/dbraw/zinc/01/48/20/642014820.db2.gz WFEYBGYIFQAQBN-AWEZNQCLSA-N 0 3 292.423 2.740 20 10 CFCDHN Cc1cc(O)c(CN[C@H](C)c2nccnc2C)cc1C ZINC000873187419 642056156 /nfs/dbraw/zinc/05/61/56/642056156.db2.gz RNUYITQJEKUINU-CYBMUJFWSA-N 0 3 271.364 2.958 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1Cc3ccccc3CN1)CC2 ZINC000873296511 642127938 /nfs/dbraw/zinc/12/79/38/642127938.db2.gz HGZOTBQZBQTHMN-IRXDYDNUSA-N 0 3 294.398 2.684 20 10 CFCDHN COc1cc(CNCc2ccc(N(C)C)cc2)ccc1O ZINC000020145996 642306483 /nfs/dbraw/zinc/30/64/83/642306483.db2.gz XYYRKVHVPJCMJD-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN COCC[N@@H+](Cc1c(C)cccc1[O-])CC(C)C ZINC000876600524 642940548 /nfs/dbraw/zinc/94/05/48/642940548.db2.gz GFWBELGROKVXOQ-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN COCC[N@H+](Cc1c(C)cccc1[O-])CC(C)C ZINC000876600524 642940550 /nfs/dbraw/zinc/94/05/50/642940550.db2.gz GFWBELGROKVXOQ-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC000876759770 642998026 /nfs/dbraw/zinc/99/80/26/642998026.db2.gz MKVQQGHVLQSXBY-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](c1ccco1)N(C)C ZINC000876890936 643053967 /nfs/dbraw/zinc/05/39/67/643053967.db2.gz LZZAQAZSYOWGMC-CQSZACIVSA-N 0 3 274.364 2.686 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1Cc2ccccc2O1 ZINC000876916077 643062794 /nfs/dbraw/zinc/06/27/94/643062794.db2.gz KETLRHJSGZEYNJ-CQSZACIVSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000877062631 643129603 /nfs/dbraw/zinc/12/96/03/643129603.db2.gz BDBWNLWWYQDICF-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CCO)CC(C)C ZINC000877066937 643131117 /nfs/dbraw/zinc/13/11/17/643131117.db2.gz AYKOTUQHXSQGFP-CQSZACIVSA-N 0 3 265.397 2.835 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])C1CCOCC1 ZINC000877084621 643143528 /nfs/dbraw/zinc/14/35/28/643143528.db2.gz RDNQAQURDHPANN-OAHLLOKOSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3OCC[C@H]32)c([O-])c1 ZINC000877086062 643144470 /nfs/dbraw/zinc/14/44/70/643144470.db2.gz MFDRQUGINVFOOR-LZWOXQAQSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCOC2(CCOCC2)C1 ZINC000877093705 643149535 /nfs/dbraw/zinc/14/95/35/643149535.db2.gz CGVHZUWVTJTPFK-CQSZACIVSA-N 0 3 291.391 2.518 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)c([O-])c1 ZINC000877094576 643150618 /nfs/dbraw/zinc/15/06/18/643150618.db2.gz KIMNUKGZUAQTGY-ZBFHGGJFSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@]2(CCSC2)C1 ZINC000877095752 643150965 /nfs/dbraw/zinc/15/09/65/643150965.db2.gz SYBPQLGZWWXRKW-CZUORRHYSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(O)CCc2ccccc21 ZINC000877112972 643157605 /nfs/dbraw/zinc/15/76/05/643157605.db2.gz WLCOOJHABVMLKV-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)[C@@H](O)C(C)C ZINC000877123675 643162704 /nfs/dbraw/zinc/16/27/04/643162704.db2.gz NXQBUINQKIAFTP-HNNXBMFYSA-N 0 3 265.397 2.833 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000877305963 643228514 /nfs/dbraw/zinc/22/85/14/643228514.db2.gz BGEBPFWOQBADQX-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000877308939 643230721 /nfs/dbraw/zinc/23/07/21/643230721.db2.gz DRGBTPLJTZHXJK-KGLIPLIRSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1 ZINC000877395687 643257135 /nfs/dbraw/zinc/25/71/35/643257135.db2.gz LZIGCADOTHEWAE-IAGOWNOFSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877463629 643284871 /nfs/dbraw/zinc/28/48/71/643284871.db2.gz CSZSSOVIBJQFKS-MRXNPFEDSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877465336 643285706 /nfs/dbraw/zinc/28/57/06/643285706.db2.gz RXDUTGRTRVZBSL-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2[C@@H](C)O)c([O-])c1 ZINC000877465234 643285849 /nfs/dbraw/zinc/28/58/49/643285849.db2.gz RSJHGPHKRNCKCD-GUTXKFCHSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2[C@@H](C)O)c([O-])c1 ZINC000877465234 643285853 /nfs/dbraw/zinc/28/58/53/643285853.db2.gz RSJHGPHKRNCKCD-GUTXKFCHSA-N 0 3 263.381 2.682 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](c1ccnn1C)C(C)C ZINC000877467612 643286881 /nfs/dbraw/zinc/28/68/81/643286881.db2.gz KWJNCJCNOXTNAU-AWEZNQCLSA-N 0 3 287.407 2.964 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2Cc3cccc(O)c3C2)c([O-])c1 ZINC000877477008 643294443 /nfs/dbraw/zinc/29/44/43/643294443.db2.gz UAOKVEUPRZAVOK-AWEZNQCLSA-N 0 3 269.344 2.663 20 10 CFCDHN COCCN(Cc1cccnc1)Cc1c(C)cccc1O ZINC000877526035 643329508 /nfs/dbraw/zinc/32/95/08/643329508.db2.gz OUGFWDGZKPUULA-UHFFFAOYSA-N 0 3 286.375 2.744 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccc(F)c2N)c1 ZINC000877532269 643336510 /nfs/dbraw/zinc/33/65/10/643336510.db2.gz DKOPMMIQVYJWOQ-SNVBAGLBSA-N 0 3 290.338 2.973 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)[C@H](O)c2ccccc2)c([O-])c1 ZINC000877534533 643337824 /nfs/dbraw/zinc/33/78/24/643337824.db2.gz CFWWZLYDPUWYDD-DYVFJYSZSA-N 0 3 271.360 2.912 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877536740 643340335 /nfs/dbraw/zinc/34/03/35/643340335.db2.gz BJKZDBLLVONAQY-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877536740 643340337 /nfs/dbraw/zinc/34/03/37/643340337.db2.gz BJKZDBLLVONAQY-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2ccc(C)cc2[O-])CC1(C)C ZINC000877565112 643363889 /nfs/dbraw/zinc/36/38/89/643363889.db2.gz CCFZTWIMICXEOA-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2ccc(C)cc2[O-])CC1(C)C ZINC000877565112 643363892 /nfs/dbraw/zinc/36/38/92/643363892.db2.gz CCFZTWIMICXEOA-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2c(C)cccc2[O-])CC1(C)C ZINC000877565031 643364200 /nfs/dbraw/zinc/36/42/00/643364200.db2.gz AUKQHDWZTHQDIO-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2c(C)cccc2[O-])CC1(C)C ZINC000877565031 643364207 /nfs/dbraw/zinc/36/42/07/643364207.db2.gz AUKQHDWZTHQDIO-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ncccc2C)c([O-])c1 ZINC000877566282 643365793 /nfs/dbraw/zinc/36/57/93/643365793.db2.gz XDLKMVVJQSAYMJ-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](CCO)CC1 ZINC000877596955 643388798 /nfs/dbraw/zinc/38/87/98/643388798.db2.gz VTBSOAPEQMDMEZ-CQSZACIVSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](CCO)CC1 ZINC000877596955 643388805 /nfs/dbraw/zinc/38/88/05/643388805.db2.gz VTBSOAPEQMDMEZ-CQSZACIVSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605823 643393927 /nfs/dbraw/zinc/39/39/27/643393927.db2.gz JYVRZIWVBYLBCX-SMDDNHRTSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)C(=O)OC(C)(C)C)c([O-])c1 ZINC000877618456 643405139 /nfs/dbraw/zinc/40/51/39/643405139.db2.gz VIODRXMBKIVCRY-GFCCVEGCSA-N 0 3 279.380 2.768 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000877626448 643411202 /nfs/dbraw/zinc/41/12/02/643411202.db2.gz VFTFNLJYBIMYPR-IYBDPMFKSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000877626448 643411209 /nfs/dbraw/zinc/41/12/09/643411209.db2.gz VFTFNLJYBIMYPR-IYBDPMFKSA-N 0 3 261.365 2.559 20 10 CFCDHN COCC1(C2CCC2)C[NH+](Cc2ccc(C)cc2[O-])C1 ZINC000877626826 643411555 /nfs/dbraw/zinc/41/15/55/643411555.db2.gz YVMZCDUMAGUNON-UHFFFAOYSA-N 0 3 275.392 2.949 20 10 CFCDHN CO[C@H](C[NH2+]Cc1ccc(C)cc1[O-])C1CCCC1 ZINC000877638427 643422793 /nfs/dbraw/zinc/42/27/93/643422793.db2.gz GKEHIGVNMUEVOZ-MRXNPFEDSA-N 0 3 263.381 2.995 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877639405 643424346 /nfs/dbraw/zinc/42/43/46/643424346.db2.gz IVPFHEGEJOJEBD-DOTOQJQBSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCCN1CC(F)F ZINC000877650643 643431951 /nfs/dbraw/zinc/43/19/51/643431951.db2.gz CHRHIWNIBVIYEY-GFCCVEGCSA-N 0 3 284.350 2.520 20 10 CFCDHN CSC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000877663629 643440300 /nfs/dbraw/zinc/44/03/00/643440300.db2.gz WIHYKKMFIDZTPL-UHFFFAOYSA-N 0 3 255.358 2.859 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(C)(F)CC1 ZINC000877700118 643462803 /nfs/dbraw/zinc/46/28/03/643462803.db2.gz DXBZCJQKJMJLCT-UHFFFAOYSA-N 0 3 253.317 2.725 20 10 CFCDHN CC(C)([NH2+]Cc1cc(F)ccc1[O-])[C@H]1CCCCO1 ZINC000877702840 643467294 /nfs/dbraw/zinc/46/72/94/643467294.db2.gz YLEVASSBKRAVMO-CQSZACIVSA-N 0 3 267.344 2.969 20 10 CFCDHN CO[C@H](C[N@@H+]1Cc2cccc([O-])c2C1)C1CCCC1 ZINC000877703199 643468585 /nfs/dbraw/zinc/46/85/85/643468585.db2.gz VVPKHKBFNRGQHH-MRXNPFEDSA-N 0 3 261.365 2.913 20 10 CFCDHN CO[C@H](C[N@H+]1Cc2cccc([O-])c2C1)C1CCCC1 ZINC000877703199 643468592 /nfs/dbraw/zinc/46/85/92/643468592.db2.gz VVPKHKBFNRGQHH-MRXNPFEDSA-N 0 3 261.365 2.913 20 10 CFCDHN CN(C)c1ccccc1CN1Cc2cccc(O)c2C1 ZINC000877703415 643469099 /nfs/dbraw/zinc/46/90/99/643469099.db2.gz HZAYPDRZSJHKTP-UHFFFAOYSA-N 0 3 268.360 2.974 20 10 CFCDHN CO[C@@H](Cc1ccccc1)C[N@@H+]1Cc2cccc([O-])c2C1 ZINC000877703227 643469700 /nfs/dbraw/zinc/46/97/00/643469700.db2.gz XFIKLBFYEJMAOK-INIZCTEOSA-N 0 3 283.371 2.966 20 10 CFCDHN CO[C@@H](Cc1ccccc1)C[N@H+]1Cc2cccc([O-])c2C1 ZINC000877703227 643469705 /nfs/dbraw/zinc/46/97/05/643469705.db2.gz XFIKLBFYEJMAOK-INIZCTEOSA-N 0 3 283.371 2.966 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877741722 643512863 /nfs/dbraw/zinc/51/28/63/643512863.db2.gz ZFFXHABTLCDXDZ-STQMWFEESA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000877741722 643512868 /nfs/dbraw/zinc/51/28/68/643512868.db2.gz ZFFXHABTLCDXDZ-STQMWFEESA-N 0 3 263.406 2.886 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnn(CC(F)F)c1)c1ccccc1[O-] ZINC000877755941 643535048 /nfs/dbraw/zinc/53/50/48/643535048.db2.gz UMHJOHQBWDGXBC-SNVBAGLBSA-N 0 3 281.306 2.705 20 10 CFCDHN COC[C@H](CC1CCOCC1)[NH2+][C@H](C)c1ccccc1[O-] ZINC000877755883 643535140 /nfs/dbraw/zinc/53/51/40/643535140.db2.gz QSOOADXPNHPPLT-HIFRSBDPSA-N 0 3 293.407 2.875 20 10 CFCDHN COC(=O)C(C)(C)CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000877755896 643535697 /nfs/dbraw/zinc/53/56/97/643535697.db2.gz RWSDGZODJIMLDH-LLVKDONJSA-N 0 3 265.353 2.632 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2[O-])[C@H]1SC ZINC000877756010 643536785 /nfs/dbraw/zinc/53/67/85/643536785.db2.gz YHMIDDJEMIHARF-PZTHBURQSA-N 0 3 281.421 2.952 20 10 CFCDHN Cc1cc(C)n2c(C[NH2+][C@@H](C)c3ccccc3[O-])cnc2n1 ZINC000877757104 643536803 /nfs/dbraw/zinc/53/68/03/643536803.db2.gz GFURZLPNAJOUSJ-ZDUSSCGKSA-N 0 3 296.374 2.903 20 10 CFCDHN COc1cncc(C[NH2+][C@H](C)c2ccccc2[O-])c1C ZINC000877757758 643538488 /nfs/dbraw/zinc/53/84/88/643538488.db2.gz UAUVVXJOMMULQV-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H](O)C2CCCC2)c([O-])c1 ZINC000877779274 643554988 /nfs/dbraw/zinc/55/49/88/643554988.db2.gz VKOIQXLYHIYWNQ-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877818831 643584082 /nfs/dbraw/zinc/58/40/82/643584082.db2.gz PYQIEUJFJLELME-LBPRGKRZSA-N 0 3 295.354 2.697 20 10 CFCDHN COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000877818831 643584094 /nfs/dbraw/zinc/58/40/94/643584094.db2.gz PYQIEUJFJLELME-LBPRGKRZSA-N 0 3 295.354 2.697 20 10 CFCDHN Cc1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)c(O)c1 ZINC000877823414 643590882 /nfs/dbraw/zinc/59/08/82/643590882.db2.gz YYAQJIKDPLNPKB-CYBMUJFWSA-N 0 3 289.297 2.854 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(C)(C)O)C2)c1[O-] ZINC000877836528 643603554 /nfs/dbraw/zinc/60/35/54/643603554.db2.gz ZOAZDCLBYZUZRK-NSHDSACASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](C(C)(C)O)C2)c1[O-] ZINC000877836528 643603560 /nfs/dbraw/zinc/60/35/60/643603560.db2.gz ZOAZDCLBYZUZRK-NSHDSACASA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCC2(CCOCC2)O1)c1ccccc1[O-] ZINC000878355042 643857062 /nfs/dbraw/zinc/85/70/62/643857062.db2.gz UUIOHJJGKQCBLR-KBPBESRZSA-N 0 3 291.391 2.771 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1CCc2ccccc21)c1ccccc1[O-] ZINC000879647633 644361958 /nfs/dbraw/zinc/36/19/58/644361958.db2.gz GPSVFTCHWYNZDW-CYBMUJFWSA-N 0 3 296.370 2.632 20 10 CFCDHN Cc1cnc([C@@H](C)N[C@@H](C)c2ccccc2O)cn1 ZINC000879649675 644362836 /nfs/dbraw/zinc/36/28/36/644362836.db2.gz BSKGSTVMTPPQLR-NWDGAFQWSA-N 0 3 257.337 2.902 20 10 CFCDHN Cc1cnc([C@H](C)N[C@@H](C)c2ccccc2O)cn1 ZINC000879649677 644363334 /nfs/dbraw/zinc/36/33/34/644363334.db2.gz BSKGSTVMTPPQLR-RYUDHWBXSA-N 0 3 257.337 2.902 20 10 CFCDHN CCC(C)(C)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651807 644364217 /nfs/dbraw/zinc/36/42/17/644364217.db2.gz LHFAWKFPFRAXTM-NWDGAFQWSA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@H]([NH2+]CCOC(=O)Cc1ccccc1)c1ccccc1[O-] ZINC000879650512 644364400 /nfs/dbraw/zinc/36/44/00/644364400.db2.gz FLURCVLCLLSVAT-AWEZNQCLSA-N 0 3 299.370 2.829 20 10 CFCDHN COCCSCCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879650831 644364695 /nfs/dbraw/zinc/36/46/95/644364695.db2.gz SHWFYGFDEIVSKX-LBPRGKRZSA-N 0 3 269.410 2.813 20 10 CFCDHN C[C@H]([NH2+]CCCS(=O)(=O)C(C)(C)C)c1ccccc1[O-] ZINC000879650185 644364850 /nfs/dbraw/zinc/36/48/50/644364850.db2.gz NKOPBQANFNUWNW-LBPRGKRZSA-N 0 3 299.436 2.646 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000094618371 650960355 /nfs/dbraw/zinc/96/03/55/650960355.db2.gz TTWLOLBXPCSFGC-GWCFXTLKSA-N 0 3 255.333 2.853 20 10 CFCDHN C[C@@H]1CCCN(Cc2cc(Cl)ccc2[O-])[C@H]1C[NH3+] ZINC000252108139 650998021 /nfs/dbraw/zinc/99/80/21/650998021.db2.gz HIZCWAKKDJCLJJ-MFKMUULPSA-N 0 3 268.788 2.605 20 10 CFCDHN CC(C)CN1CCC([NH2+]Cc2cc(F)cc(F)c2[O-])CC1 ZINC000882886232 645492256 /nfs/dbraw/zinc/49/22/56/645492256.db2.gz KQEOGIOVOMEGSX-UHFFFAOYSA-N 0 3 298.377 2.880 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)C(F)(F)C(F)(F)F)c1ccccc1[O-] ZINC000883359495 645766218 /nfs/dbraw/zinc/76/62/18/645766218.db2.gz HSQJTZGHZJVDKU-GMSGAONNSA-N 0 3 299.239 2.601 20 10 CFCDHN CC(C)C[NH+]1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000133841299 646244533 /nfs/dbraw/zinc/24/45/33/646244533.db2.gz OBCQMLNKJFUESA-UHFFFAOYSA-N 0 3 282.815 2.819 20 10 CFCDHN CC[NH+](CC)[C@@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000134061324 646271272 /nfs/dbraw/zinc/27/12/72/646271272.db2.gz DLDDTACSUQQAOA-GFCCVEGCSA-N 0 3 282.815 2.962 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1c([O-])cccc1F ZINC000886501679 647021315 /nfs/dbraw/zinc/02/13/15/647021315.db2.gz TYDRPUWTIPCFMN-VXGBXAGGSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504303 647022113 /nfs/dbraw/zinc/02/21/13/647022113.db2.gz ZSSZFXGRVKZPLO-YUTCNCBUSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504303 647022118 /nfs/dbraw/zinc/02/21/18/647022118.db2.gz ZSSZFXGRVKZPLO-YUTCNCBUSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c([O-])cccc1F ZINC000886504303 647022122 /nfs/dbraw/zinc/02/21/22/647022122.db2.gz ZSSZFXGRVKZPLO-YUTCNCBUSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1c([O-])cccc1F ZINC000886505303 647022178 /nfs/dbraw/zinc/02/21/78/647022178.db2.gz UXRONUAFHXSIHZ-AVGNSLFASA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1c([O-])cccc1F ZINC000886505303 647022184 /nfs/dbraw/zinc/02/21/84/647022184.db2.gz UXRONUAFHXSIHZ-AVGNSLFASA-N 0 3 278.371 2.809 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886522591 647028035 /nfs/dbraw/zinc/02/80/35/647028035.db2.gz MUIXNSGOMBASEI-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[NH+](CC)C[C@@H](C)N[C@H](C)c1c([O-])cccc1F ZINC000886522591 647028038 /nfs/dbraw/zinc/02/80/38/647028038.db2.gz MUIXNSGOMBASEI-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1c([O-])cccc1F ZINC000886524914 647028839 /nfs/dbraw/zinc/02/88/39/647028839.db2.gz TZZFHJSKXFFLPK-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CC3(CCC3)CO1)CC2 ZINC000886701827 647116668 /nfs/dbraw/zinc/11/66/68/647116668.db2.gz WJUWVXLPFOKNKL-UONOGXRCSA-N 0 3 273.376 2.928 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1C=C[C@H]3C[C@@H]1CO3)CC2 ZINC000926936510 648664139 /nfs/dbraw/zinc/66/41/39/648664139.db2.gz OHCLUKKLCWTVGD-LJISPDSOSA-N 0 3 271.360 2.560 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2CC3(C2)OCCO3)c([O-])c1 ZINC000927002447 648679396 /nfs/dbraw/zinc/67/93/96/648679396.db2.gz WEMAOTNSZYTDIN-ZDUSSCGKSA-N 0 3 291.391 2.813 20 10 CFCDHN COC[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])C(C)C ZINC000927096814 648710357 /nfs/dbraw/zinc/71/03/57/648710357.db2.gz HSAXZGWPNXRBIP-STQMWFEESA-N 0 3 251.370 2.961 20 10 CFCDHN Cc1cc(C[NH2+][C@H](C)c2ccccc2[O-])c(C)nn1 ZINC000931555018 649453488 /nfs/dbraw/zinc/45/34/88/649453488.db2.gz UUSXFUOGFUCJFN-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN Oc1ccccc1CN1CCC([C@H](O)C(F)(F)F)CC1 ZINC000305745611 651073965 /nfs/dbraw/zinc/07/39/65/651073965.db2.gz OEIHLNUDJLFOBD-ZDUSSCGKSA-N 0 3 289.297 2.527 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@H](O)C(F)(F)F)CC1 ZINC000305745611 651073968 /nfs/dbraw/zinc/07/39/68/651073968.db2.gz OEIHLNUDJLFOBD-ZDUSSCGKSA-N 0 3 289.297 2.527 20 10 CFCDHN C[C@@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000305759935 651075593 /nfs/dbraw/zinc/07/55/93/651075593.db2.gz YBKLECAPRWOMJJ-SMDDNHRTSA-N 0 3 261.321 2.587 20 10 CFCDHN CC[C@](C)(CCO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000305782642 651077939 /nfs/dbraw/zinc/07/79/39/651077939.db2.gz PUEDZMBDARAWMX-CQSZACIVSA-N 0 3 271.788 2.995 20 10 CFCDHN CC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000119866827 651301468 /nfs/dbraw/zinc/30/14/68/651301468.db2.gz FEXSWMIHXXCZAT-IHRRRGAJSA-N 0 3 291.439 2.706 20 10 CFCDHN Cn1ncc2ccc(C[N@H+](C)Cc3ccccc3[O-])cc21 ZINC001139907900 769865546 /nfs/dbraw/zinc/86/55/46/769865546.db2.gz RBCJSFGUFAYQOH-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN Cn1ncc2ccc(C[N@@H+](C)Cc3ccccc3[O-])cc21 ZINC001139907900 769865556 /nfs/dbraw/zinc/86/55/56/769865556.db2.gz RBCJSFGUFAYQOH-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCOC1CCCC1)CC2 ZINC000382255830 770604943 /nfs/dbraw/zinc/60/49/43/770604943.db2.gz MHCGUKILXMUNJV-AWEZNQCLSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1ccc(O)c(CN2CC3(C2)C[C@H](F)CS3)c1 ZINC001140622608 773221493 /nfs/dbraw/zinc/22/14/93/773221493.db2.gz CBATWQRFBNHHRH-LBPRGKRZSA-N 0 3 267.369 2.730 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000690750975 773222427 /nfs/dbraw/zinc/22/24/27/773222427.db2.gz TYSFRJDUTGGXNJ-OAHLLOKOSA-N 0 3 255.317 2.875 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001140948661 775687180 /nfs/dbraw/zinc/68/71/80/775687180.db2.gz UDMNJKZXJDSBHZ-GOEBONIOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001140948661 775687186 /nfs/dbraw/zinc/68/71/86/775687186.db2.gz UDMNJKZXJDSBHZ-GOEBONIOSA-N 0 3 261.365 2.702 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cc(C)ccn2)c1 ZINC000328201448 775731390 /nfs/dbraw/zinc/73/13/90/775731390.db2.gz SXAWGHCBIWXXLM-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000722401027 776617416 /nfs/dbraw/zinc/61/74/16/776617416.db2.gz MLSBKOIFHLTPDA-ZYHUDNBSSA-N 0 3 293.260 2.731 20 10 CFCDHN COC(=O)CC[N@H+](C)Cc1c([O-])ccc2ccccc21 ZINC001231590907 777271636 /nfs/dbraw/zinc/27/16/36/777271636.db2.gz PTVNKNBSUYYKMK-UHFFFAOYSA-N 0 3 273.332 2.540 20 10 CFCDHN COC(=O)CC[N@@H+](C)Cc1c([O-])ccc2ccccc21 ZINC001231590907 777271637 /nfs/dbraw/zinc/27/16/37/777271637.db2.gz PTVNKNBSUYYKMK-UHFFFAOYSA-N 0 3 273.332 2.540 20 10 CFCDHN Cc1cnc2c(c1)CN(Cc1cccc(C)c1O)CC2 ZINC001231594710 777272996 /nfs/dbraw/zinc/27/29/96/777272996.db2.gz NWEWQPTXALFPES-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN Oc1cccc2c1CN(Cc1cc3cc[nH]c3cn1)CC2 ZINC001231670005 777305357 /nfs/dbraw/zinc/30/53/57/777305357.db2.gz TZDKFDUJZROPBZ-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001231841863 777345497 /nfs/dbraw/zinc/34/54/97/777345497.db2.gz FFFWFGIOACZSFU-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001231841863 777345503 /nfs/dbraw/zinc/34/55/03/777345503.db2.gz FFFWFGIOACZSFU-KRWDZBQOSA-N 0 3 277.408 2.994 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001231841873 777345672 /nfs/dbraw/zinc/34/56/72/777345672.db2.gz FIMOKORUQUXCST-YOEHRIQHSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001231841873 777345677 /nfs/dbraw/zinc/34/56/77/777345677.db2.gz FIMOKORUQUXCST-YOEHRIQHSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC[C@@]2(CC2(F)F)C1 ZINC001231854105 777351894 /nfs/dbraw/zinc/35/18/94/777351894.db2.gz ZAQUHJUISINVID-OAHLLOKOSA-N 0 3 296.361 2.992 20 10 CFCDHN CC[NH+]1C[C@H]2CN(Cc3cc(Cl)c(C)cc3[O-])C[C@@H]2C1 ZINC001231870912 777358751 /nfs/dbraw/zinc/35/87/51/777358751.db2.gz DGVAOPHWJVNCGW-KBPBESRZSA-N 0 3 294.826 2.738 20 10 CFCDHN CCN(Cc1cc(OC)ccn1)Cc1ccccc1O ZINC001231967994 777395328 /nfs/dbraw/zinc/39/53/28/777395328.db2.gz FKIUHZUYCBBYGF-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN COc1cc(C)c(CN(C)Cc2ccccc2O)cn1 ZINC001232353003 777535202 /nfs/dbraw/zinc/53/52/02/777535202.db2.gz FCCZJTUMBDLOJX-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN CC[N@H+](Cc1ccc(CCO)cc1)Cc1ccccc1[O-] ZINC001232779860 777663676 /nfs/dbraw/zinc/66/36/76/777663676.db2.gz WTJSRZOOJDNXDT-UHFFFAOYSA-N 0 3 285.387 2.949 20 10 CFCDHN CC[N@@H+](Cc1ccc(CCO)cc1)Cc1ccccc1[O-] ZINC001232779860 777663677 /nfs/dbraw/zinc/66/36/77/777663677.db2.gz WTJSRZOOJDNXDT-UHFFFAOYSA-N 0 3 285.387 2.949 20 10 CFCDHN Oc1cc(CN2CCC[C@@H]3CCC[C@@H]32)cc(O)c1O ZINC001233017026 777766480 /nfs/dbraw/zinc/76/64/80/777766480.db2.gz QOHPKNJPDPUZLP-RYUDHWBXSA-N 0 3 263.337 2.568 20 10 CFCDHN Oc1cc(CN2CCC[C@@H]3CCC[C@H]32)cc(O)c1O ZINC001233017023 777766831 /nfs/dbraw/zinc/76/68/31/777766831.db2.gz QOHPKNJPDPUZLP-NWDGAFQWSA-N 0 3 263.337 2.568 20 10 CFCDHN CC[C@@H](COc1ccc(N2CCN(CC)CC2)cc1)OC ZINC001234661227 778281832 /nfs/dbraw/zinc/28/18/32/778281832.db2.gz SCNUVNZSMRLVOB-INIZCTEOSA-N 0 3 292.423 2.632 20 10 CFCDHN CC(C)[C@@H]1CNCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235458060 778497371 /nfs/dbraw/zinc/49/73/71/778497371.db2.gz LTJVSSVQTHIIOX-KRWDZBQOSA-N 0 3 284.403 2.975 20 10 CFCDHN CC(C)[C@@H]1CNCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235458060 778497373 /nfs/dbraw/zinc/49/73/73/778497373.db2.gz LTJVSSVQTHIIOX-KRWDZBQOSA-N 0 3 284.403 2.975 20 10 CFCDHN CC(C)(C)c1ccc(CN2CC3(CC(O)C3)C2)c(O)c1 ZINC001235676927 778534211 /nfs/dbraw/zinc/53/42/11/778534211.db2.gz XNTNXODQRUWSCM-UHFFFAOYSA-N 0 3 275.392 2.646 20 10 CFCDHN COC[C@H]1CC[N@@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235681944 778536004 /nfs/dbraw/zinc/53/60/04/778536004.db2.gz SHEYSTOSFYHFRR-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN COC[C@H]1CC[N@H+]1Cc1ccc(C(C)(C)C)cc1[O-] ZINC001235681944 778536009 /nfs/dbraw/zinc/53/60/09/778536009.db2.gz SHEYSTOSFYHFRR-CQSZACIVSA-N 0 3 263.381 2.910 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN(C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238346 778747689 /nfs/dbraw/zinc/74/76/89/778747689.db2.gz CPCBKVQCTKATRO-CQSZACIVSA-N 0 3 280.799 2.762 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[NH2+][C@@H]3C2)cc1Cl ZINC001236286465 778762110 /nfs/dbraw/zinc/76/21/10/778762110.db2.gz NDQXLECPDLIPKE-BXUZGUMPSA-N 0 3 294.826 2.747 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC001236783381 778934906 /nfs/dbraw/zinc/93/49/06/778934906.db2.gz LCDVHKWPVGYSBC-INIZCTEOSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC001236783381 778934910 /nfs/dbraw/zinc/93/49/10/778934910.db2.gz LCDVHKWPVGYSBC-INIZCTEOSA-N 0 3 263.381 2.692 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3CCO[C@H]3C2)c([O-])c1 ZINC001236785123 778935113 /nfs/dbraw/zinc/93/51/13/778935113.db2.gz FPBLYTUWTFPFLM-CJNGLKHVSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3CCO[C@H]3C2)c([O-])c1 ZINC001236785123 778935116 /nfs/dbraw/zinc/93/51/16/778935116.db2.gz FPBLYTUWTFPFLM-CJNGLKHVSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(CN2CCc3cnccc3C2)c(O)c1 ZINC001236783991 778935432 /nfs/dbraw/zinc/93/54/32/778935432.db2.gz QRFHOOJDILSXLS-UHFFFAOYSA-N 0 3 268.360 2.908 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(COC3)CC2)c([O-])c1 ZINC001236784719 778935528 /nfs/dbraw/zinc/93/55/28/778935528.db2.gz ZJANDGRCKNZODU-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN CCc1ccc(CN2CCCC(=O)[C@H](C)C2)c(O)c1 ZINC001236784046 778935665 /nfs/dbraw/zinc/93/56/65/778935665.db2.gz RJFKZDOJNUTWAV-GFCCVEGCSA-N 0 3 261.365 2.756 20 10 CFCDHN COc1cc([O-])c(CN2CCC[C@@H]([NH+](C)C)C2)c(Cl)c1 ZINC001236797979 778941739 /nfs/dbraw/zinc/94/17/39/778941739.db2.gz CNOFSNSFFXYJRC-LLVKDONJSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cc(C)c(C[NH+]2CCC3(CCCO3)CC2)c([O-])c1 ZINC001236811609 778948092 /nfs/dbraw/zinc/94/80/92/778948092.db2.gz SPSIUWMDSZWRAM-UHFFFAOYSA-N 0 3 291.391 2.854 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001236810975 778948751 /nfs/dbraw/zinc/94/87/51/778948751.db2.gz MCPJYZRVVJXDFA-ZDUSSCGKSA-N 0 3 277.364 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@H](C(C)=O)C2)c([O-])c1 ZINC001236810975 778948759 /nfs/dbraw/zinc/94/87/59/778948759.db2.gz MCPJYZRVVJXDFA-ZDUSSCGKSA-N 0 3 277.364 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001236816034 778950381 /nfs/dbraw/zinc/95/03/81/778950381.db2.gz QGZGEAWOIGCJLP-DOMZBBRYSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c([O-])c1 ZINC001236816034 778950382 /nfs/dbraw/zinc/95/03/82/778950382.db2.gz QGZGEAWOIGCJLP-DOMZBBRYSA-N 0 3 289.375 2.510 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])CC[C@@H]1O ZINC001236827674 778956719 /nfs/dbraw/zinc/95/67/19/778956719.db2.gz VRAAYYVXIMVEJB-LRDDRELGSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])CC[C@@H]1O ZINC001236827674 778956723 /nfs/dbraw/zinc/95/67/23/778956723.db2.gz VRAAYYVXIMVEJB-LRDDRELGSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc3ccccc3cc2[O-])CCN1C ZINC001236834113 778959708 /nfs/dbraw/zinc/95/97/08/778959708.db2.gz UWDAGIVIKHSQOT-CYBMUJFWSA-N 0 3 270.376 2.681 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc3ccccc3cc2[O-])CCN1C ZINC001236834113 778959715 /nfs/dbraw/zinc/95/97/15/778959715.db2.gz UWDAGIVIKHSQOT-CYBMUJFWSA-N 0 3 270.376 2.681 20 10 CFCDHN CC(=O)N1CCC[N@H+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236840905 778961807 /nfs/dbraw/zinc/96/18/07/778961807.db2.gz SKBZCOMQCLOIIA-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CC(=O)N1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236840905 778961810 /nfs/dbraw/zinc/96/18/10/778961810.db2.gz SKBZCOMQCLOIIA-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001237040448 778996078 /nfs/dbraw/zinc/99/60/78/778996078.db2.gz DFTRUCIEJLVISL-PBHICJAKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001237040448 778996083 /nfs/dbraw/zinc/99/60/83/778996083.db2.gz DFTRUCIEJLVISL-PBHICJAKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCSC)c([O-])c1 ZINC001237043874 778997499 /nfs/dbraw/zinc/99/74/99/778997499.db2.gz DIKXMXWUDIVTJX-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCSC)c([O-])c1 ZINC001237043874 778997503 /nfs/dbraw/zinc/99/75/03/778997503.db2.gz DIKXMXWUDIVTJX-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001237047349 778999256 /nfs/dbraw/zinc/99/92/56/778999256.db2.gz LRYRITBITOCJOU-IUODEOHRSA-N 0 3 289.375 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001237047349 778999258 /nfs/dbraw/zinc/99/92/58/778999258.db2.gz LRYRITBITOCJOU-IUODEOHRSA-N 0 3 289.375 2.592 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@]3(CCCO3)C2)c([O-])c1 ZINC001237049769 778999745 /nfs/dbraw/zinc/99/97/45/778999745.db2.gz JALJYMFFHCSILO-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@]3(CCCO3)C2)c([O-])c1 ZINC001237049769 778999748 /nfs/dbraw/zinc/99/97/48/778999748.db2.gz JALJYMFFHCSILO-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)CCCC(=O)OC)c([O-])c1 ZINC001237050725 779000396 /nfs/dbraw/zinc/00/03/96/779000396.db2.gz WDKFEXKZUBKNJB-UHFFFAOYSA-N 0 3 295.379 2.566 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)CCCC(=O)OC)c([O-])c1 ZINC001237050725 779000401 /nfs/dbraw/zinc/00/04/01/779000401.db2.gz WDKFEXKZUBKNJB-UHFFFAOYSA-N 0 3 295.379 2.566 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237051774 779000863 /nfs/dbraw/zinc/00/08/63/779000863.db2.gz QLUZASBPZHZMPX-KRWDZBQOSA-N 0 3 291.391 2.901 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237051774 779000867 /nfs/dbraw/zinc/00/08/67/779000867.db2.gz QLUZASBPZHZMPX-KRWDZBQOSA-N 0 3 291.391 2.901 20 10 CFCDHN CO[C@@H](C)C1C[NH+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237054770 779001785 /nfs/dbraw/zinc/00/17/85/779001785.db2.gz GODYPPYJZRRLNI-LBPRGKRZSA-N 0 3 263.381 2.982 20 10 CFCDHN C[N@H+](Cc1c([O-])cccc1OC(F)(F)F)C1CC1 ZINC001237120685 779016955 /nfs/dbraw/zinc/01/69/55/779016955.db2.gz RHZNRAJMUUWCNS-UHFFFAOYSA-N 0 3 261.243 2.885 20 10 CFCDHN C[N@@H+](Cc1c([O-])cccc1OC(F)(F)F)C1CC1 ZINC001237120685 779016963 /nfs/dbraw/zinc/01/69/63/779016963.db2.gz RHZNRAJMUUWCNS-UHFFFAOYSA-N 0 3 261.243 2.885 20 10 CFCDHN CC(=O)[C@@H]1CCCN(Cc2c(O)ccc(F)c2Cl)C1 ZINC001237127238 779021742 /nfs/dbraw/zinc/02/17/42/779021742.db2.gz XLJAOYLQDJWXOE-SNVBAGLBSA-N 0 3 285.746 2.986 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1C[C@@H]2CCCC(=O)[C@H]2C1 ZINC001237491598 779118989 /nfs/dbraw/zinc/11/89/89/779118989.db2.gz PXMCGYJMNUYOGM-JSGCOSHPSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1C[C@@H]2CCCC(=O)[C@H]2C1 ZINC001237491598 779118990 /nfs/dbraw/zinc/11/89/90/779118990.db2.gz PXMCGYJMNUYOGM-JSGCOSHPSA-N 0 3 259.349 2.502 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](O)[C@@H]1Cc1ccccc1 ZINC001237489650 779119355 /nfs/dbraw/zinc/11/93/55/779119355.db2.gz ZZDVDKRSZOGABZ-PKOBYXMFSA-N 0 3 297.398 2.879 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](O)[C@@H]1Cc1ccccc1 ZINC001237489650 779119360 /nfs/dbraw/zinc/11/93/60/779119360.db2.gz ZZDVDKRSZOGABZ-PKOBYXMFSA-N 0 3 297.398 2.879 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@@H]2C1 ZINC001237617705 779143862 /nfs/dbraw/zinc/14/38/62/779143862.db2.gz CCUWLLCDJJOZKN-PWSUYJOCSA-N 0 3 298.789 2.568 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@@H]2C1 ZINC001237617705 779143864 /nfs/dbraw/zinc/14/38/64/779143864.db2.gz CCUWLLCDJJOZKN-PWSUYJOCSA-N 0 3 298.789 2.568 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC001238059000 779241689 /nfs/dbraw/zinc/24/16/89/779241689.db2.gz XCKPSPDDOUFGPC-OAHLLOKOSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC001238059000 779241691 /nfs/dbraw/zinc/24/16/91/779241691.db2.gz XCKPSPDDOUFGPC-OAHLLOKOSA-N 0 3 267.344 2.577 20 10 CFCDHN CCOCCN(CCOCC)Cc1cc(F)cc(C)c1O ZINC001238061908 779242412 /nfs/dbraw/zinc/24/24/12/779242412.db2.gz LGFYYWLQZZJQDX-UHFFFAOYSA-N 0 3 299.386 2.715 20 10 CFCDHN Cc1cc(CN(C)CCO)c(C)n1-c1ccccc1 ZINC001236254350 779512396 /nfs/dbraw/zinc/51/23/96/779512396.db2.gz YPKDUUIIUVNWTK-UHFFFAOYSA-N 0 3 258.365 2.518 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC001236795368 779638742 /nfs/dbraw/zinc/63/87/42/779638742.db2.gz UZPKWERHRPZXFI-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](OC)CC2)c([O-])c1 ZINC001236795368 779638748 /nfs/dbraw/zinc/63/87/48/779638748.db2.gz UZPKWERHRPZXFI-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCOCC1CC[NH+](Cc2c(C)cc(OC)cc2[O-])CC1 ZINC001236809966 779642325 /nfs/dbraw/zinc/64/23/25/779642325.db2.gz AOSIFHMMFYEWJK-UHFFFAOYSA-N 0 3 293.407 2.958 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(Oc2ccccn2)CC1 ZINC001203556921 780035803 /nfs/dbraw/zinc/03/58/03/780035803.db2.gz WYWLDNYCHGIBBD-UHFFFAOYSA-N 0 3 284.359 2.831 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2C=CCC2)c1[O-] ZINC000700587414 780701776 /nfs/dbraw/zinc/70/17/76/780701776.db2.gz SBZORZZZXYZAFE-LLVKDONJSA-N 0 3 253.729 2.862 20 10 CFCDHN [O-]c1cccc(F)c1C[N@@H+]1CCC[C@@H]1CN1CCCC1 ZINC001137837894 781140816 /nfs/dbraw/zinc/14/08/16/781140816.db2.gz YHTBXNZKZCGDFA-CYBMUJFWSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1cccc(F)c1C[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC001137837894 781140822 /nfs/dbraw/zinc/14/08/22/781140822.db2.gz YHTBXNZKZCGDFA-CYBMUJFWSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@H]1CCCC13CC3)OCO2 ZINC000706916288 781208827 /nfs/dbraw/zinc/20/88/27/781208827.db2.gz OZLHOLBYUFEHMT-AWEZNQCLSA-N 0 3 261.321 2.543 20 10 CFCDHN C[N@H+](CCNCc1cc(F)cc(F)c1[O-])C1CCCC1 ZINC000708558587 781294027 /nfs/dbraw/zinc/29/40/27/781294027.db2.gz KDZOGCHPOLRUIP-UHFFFAOYSA-N 0 3 284.350 2.634 20 10 CFCDHN C[N@@H+](CCNCc1cc(F)cc(F)c1[O-])C1CCCC1 ZINC000708558587 781294030 /nfs/dbraw/zinc/29/40/30/781294030.db2.gz KDZOGCHPOLRUIP-UHFFFAOYSA-N 0 3 284.350 2.634 20 10 CFCDHN CC(C)(C)N1CC[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000822133897 781893313 /nfs/dbraw/zinc/89/33/13/781893313.db2.gz WUHYJVIPVOWQKB-ZIAGYGMSSA-N 0 3 274.408 2.842 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)CCCCO)c([O-])c1 ZINC000295003867 199295457 /nfs/dbraw/zinc/29/54/57/199295457.db2.gz IUGWBPUCSNQFNO-CYBMUJFWSA-N 0 3 281.396 2.822 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1cc(C)c(C)cc1[O-])C(C)C ZINC000072924773 346949439 /nfs/dbraw/zinc/94/94/39/346949439.db2.gz DSJOZJWWOCBNGD-HNNXBMFYSA-N 0 3 251.370 2.770 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2(CCO)CCCC2)c1 ZINC000072925711 346949560 /nfs/dbraw/zinc/94/95/60/346949560.db2.gz PMJMDNYPRRXJAY-UHFFFAOYSA-N 0 3 263.381 2.733 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)c1[O-] ZINC000032131238 346300779 /nfs/dbraw/zinc/30/07/79/346300779.db2.gz QAQTZSBWVPRFJE-LRDDRELGSA-N 0 3 287.359 2.613 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H](CO)C(C)(C)C)c1 ZINC000093837446 347684931 /nfs/dbraw/zinc/68/49/31/347684931.db2.gz SKDBKHSCBVMFMH-HNNXBMFYSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c1 ZINC000093837446 347684933 /nfs/dbraw/zinc/68/49/33/347684933.db2.gz SKDBKHSCBVMFMH-HNNXBMFYSA-N 0 3 281.396 2.630 20 10 CFCDHN CC[N@H+](CCO)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000100692645 347713760 /nfs/dbraw/zinc/71/37/60/347713760.db2.gz IXMVTZOKXNWXIG-UHFFFAOYSA-N 0 3 271.360 2.873 20 10 CFCDHN CC[N@@H+](CCO)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000100692645 347713764 /nfs/dbraw/zinc/71/37/64/347713764.db2.gz IXMVTZOKXNWXIG-UHFFFAOYSA-N 0 3 271.360 2.873 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)c1ccccc1)CC2 ZINC000296012554 199752704 /nfs/dbraw/zinc/75/27/04/199752704.db2.gz OZYMIGDCHAUYSX-ZBFHGGJFSA-N 0 3 269.344 2.703 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](OC)[C@H](C)CC)c1[O-] ZINC000294330515 199001064 /nfs/dbraw/zinc/00/10/64/199001064.db2.gz XQNCKLHYUXPXGP-DOMZBBRYSA-N 0 3 281.396 2.942 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)CCCO)c1ccccc1[O-] ZINC000294759324 199169904 /nfs/dbraw/zinc/16/99/04/199169904.db2.gz IXADLFUUGAASEP-JSGCOSHPSA-N 0 3 251.370 2.842 20 10 CFCDHN COC(=O)[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccccc1[O-] ZINC000294848052 199211999 /nfs/dbraw/zinc/21/19/99/199211999.db2.gz RUMJSPIWDXBIDA-KGLIPLIRSA-N 0 3 277.364 2.604 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)CC2 ZINC000297050342 200072749 /nfs/dbraw/zinc/07/27/49/200072749.db2.gz VNTMZHYZKMDOBA-UBHSHLNASA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccsc1 ZINC000297944217 200307344 /nfs/dbraw/zinc/30/73/44/200307344.db2.gz YFDDFEAIDVGNLO-XJKSGUPXSA-N 0 3 289.400 2.938 20 10 CFCDHN C[C@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccsc1 ZINC000297944210 200307545 /nfs/dbraw/zinc/30/75/45/200307545.db2.gz YFDDFEAIDVGNLO-CJNGLKHVSA-N 0 3 289.400 2.938 20 10 CFCDHN COc1cccc(C[N@H+](C)Cc2ccccc2[O-])c1O ZINC000091974489 375072835 /nfs/dbraw/zinc/07/28/35/375072835.db2.gz SASUZNPUIOHEPC-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN COc1cccc(C[N@@H+](C)Cc2ccccc2[O-])c1O ZINC000091974489 375072843 /nfs/dbraw/zinc/07/28/43/375072843.db2.gz SASUZNPUIOHEPC-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@H]2CCCN(C)C2)c1[O-] ZINC000092253597 375098705 /nfs/dbraw/zinc/09/87/05/375098705.db2.gz RKSNWLRKSWBCID-AWEZNQCLSA-N 0 3 292.423 2.565 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@H]2CCCN(C)C2)c1[O-] ZINC000092253597 375098711 /nfs/dbraw/zinc/09/87/11/375098711.db2.gz RKSNWLRKSWBCID-AWEZNQCLSA-N 0 3 292.423 2.565 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000093644244 375280688 /nfs/dbraw/zinc/28/06/88/375280688.db2.gz TYAQBQNKVZKSKO-HIFRSBDPSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1[O-] ZINC000093644244 375280695 /nfs/dbraw/zinc/28/06/95/375280695.db2.gz TYAQBQNKVZKSKO-HIFRSBDPSA-N 0 3 292.423 2.705 20 10 CFCDHN CCCC(C)(C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000111387327 375843162 /nfs/dbraw/zinc/84/31/62/375843162.db2.gz BQSQCPCXQBYCNH-UHFFFAOYSA-N 0 3 251.326 2.789 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000124703180 377080482 /nfs/dbraw/zinc/08/04/82/377080482.db2.gz OTECFETZLZHQCH-NSHDSACASA-N 0 3 280.799 2.620 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CC[S@](C)=O)c1ccccc1[O-] ZINC000128064185 377315498 /nfs/dbraw/zinc/31/54/98/377315498.db2.gz FPGRDYLIYQVIJY-RRUGBERISA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@@H](N[C@@H](C)C(=O)NC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000135138694 378090100 /nfs/dbraw/zinc/09/01/00/378090100.db2.gz ZHDGPGLAYHYNHO-OLZOCXBDSA-N 0 3 291.439 2.706 20 10 CFCDHN CC1(C)[C@H]([NH2+]Cc2ccccc2[O-])[C@@H]2CCCO[C@@H]21 ZINC000135201283 378097612 /nfs/dbraw/zinc/09/76/12/378097612.db2.gz XLTUCQRIDOESNW-CFVMTHIKSA-N 0 3 261.365 2.685 20 10 CFCDHN CC[C@H]([NH2+]CCC(=O)N1CCCCC1)c1ccccc1[O-] ZINC000135733415 378161832 /nfs/dbraw/zinc/16/18/32/378161832.db2.gz XZPWCAGMIFYVSI-HNNXBMFYSA-N 0 3 290.407 2.836 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@H]1CCN(C(C)C)C1=O ZINC000175284080 380038077 /nfs/dbraw/zinc/03/80/77/380038077.db2.gz ZGLCEDDBLBMZGE-HNNXBMFYSA-N 0 3 290.407 2.614 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@H]1CCN(C(C)C)C1=O ZINC000175284080 380038086 /nfs/dbraw/zinc/03/80/86/380038086.db2.gz ZGLCEDDBLBMZGE-HNNXBMFYSA-N 0 3 290.407 2.614 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H]2CCN2C2CCCC2)c1[O-] ZINC000529668258 383745018 /nfs/dbraw/zinc/74/50/18/383745018.db2.gz FJKXROFBJICCFH-MRXNPFEDSA-N 0 3 274.408 2.807 20 10 CFCDHN CCN(CC)c1ccc(CNC2(CO)CCC2)cc1F ZINC000178638734 380473948 /nfs/dbraw/zinc/47/39/48/380473948.db2.gz YKZAAELHYDLPDA-UHFFFAOYSA-N 0 3 280.387 2.677 20 10 CFCDHN C[N@H+](CCCC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000179569182 380558989 /nfs/dbraw/zinc/55/89/89/380558989.db2.gz MIAHHZBZDPPYDV-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000179569182 380558993 /nfs/dbraw/zinc/55/89/93/380558993.db2.gz MIAHHZBZDPPYDV-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000179667872 380569750 /nfs/dbraw/zinc/56/97/50/380569750.db2.gz BLYNNRYOBZFGNT-QWHCGFSZSA-N 0 3 273.380 2.884 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+](CCO)Cc1ccccc1 ZINC000179868673 380589996 /nfs/dbraw/zinc/58/99/96/380589996.db2.gz ZUGBOLZXISETED-UHFFFAOYSA-N 0 3 275.323 2.526 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+](CCO)Cc1ccccc1 ZINC000179868673 380589999 /nfs/dbraw/zinc/58/99/99/380589999.db2.gz ZUGBOLZXISETED-UHFFFAOYSA-N 0 3 275.323 2.526 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1ccccc1[O-] ZINC000179882359 380592329 /nfs/dbraw/zinc/59/23/29/380592329.db2.gz FROJRWTVQNPDCY-ZFWWWQNUSA-N 0 3 271.360 2.646 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)c1ccccc1F)c1ccccc1[O-] ZINC000179890671 380593715 /nfs/dbraw/zinc/59/37/15/380593715.db2.gz CZVBXHWWIZCTQI-MEDUHNTESA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cccc(CN(C)[C@H]2CCCc3c2cnn3C)c1O ZINC000180640604 380685107 /nfs/dbraw/zinc/68/51/07/380685107.db2.gz DCZRMEJQSJJWJH-HNNXBMFYSA-N 0 3 285.391 2.944 20 10 CFCDHN COC(C)(C)C[C@@H](C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180805745 380701583 /nfs/dbraw/zinc/70/15/83/380701583.db2.gz JERODLOGSKYOAI-SNVBAGLBSA-N 0 3 255.333 2.825 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c1 ZINC000181096411 380737922 /nfs/dbraw/zinc/73/79/22/380737922.db2.gz LKHVETDWXRLALQ-CJNGLKHVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c1 ZINC000181096411 380737928 /nfs/dbraw/zinc/73/79/28/380737928.db2.gz LKHVETDWXRLALQ-CJNGLKHVSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCOC[C@@H]2C)c1 ZINC000287426381 380830077 /nfs/dbraw/zinc/83/00/77/380830077.db2.gz KJYNJJZRGILAFS-RWMBFGLXSA-N 0 3 279.380 2.724 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)c1 ZINC000288614731 381018375 /nfs/dbraw/zinc/01/83/75/381018375.db2.gz QXZQIQPGCDRVCQ-GUYCJALGSA-N 0 3 271.360 2.912 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)c1 ZINC000289270397 381027539 /nfs/dbraw/zinc/02/75/39/381027539.db2.gz GHWWIJRGMQDUOM-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1 ZINC000289270397 381027542 /nfs/dbraw/zinc/02/75/42/381027542.db2.gz GHWWIJRGMQDUOM-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@](C)(O)c2ccc(F)cc2)c1[O-] ZINC000182676841 381135236 /nfs/dbraw/zinc/13/52/36/381135236.db2.gz MKBRRZNFBGGSKW-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(OC)CCCC2)c1 ZINC000296057268 381235766 /nfs/dbraw/zinc/23/57/66/381235766.db2.gz PAFAJLSYGNNOIN-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN COc1ccc(N2CCN(CC3CC(F)(F)C3)CC2)cc1 ZINC000296184296 381291607 /nfs/dbraw/zinc/29/16/07/381291607.db2.gz BDDRHWZKYMNHDW-UHFFFAOYSA-N 0 3 296.361 2.863 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)c1ccccc1[O-] ZINC000183628775 381297076 /nfs/dbraw/zinc/29/70/76/381297076.db2.gz HZLWTVWHFVZOPA-UONOGXRCSA-N 0 3 283.375 2.717 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccccc1[O-] ZINC000183623442 381297130 /nfs/dbraw/zinc/29/71/30/381297130.db2.gz DPPIYRQCTKJULR-NWDGAFQWSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccccc1[O-] ZINC000183527732 381283997 /nfs/dbraw/zinc/28/39/97/381283997.db2.gz WWIQGAKHDRGSPO-FATJJJSSSA-N 0 3 261.365 2.856 20 10 CFCDHN C[C@@H]([NH2+]CCC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183529042 381284343 /nfs/dbraw/zinc/28/43/43/381284343.db2.gz BDAGZZURWJFZME-LLVKDONJSA-N 0 3 265.353 2.775 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@H](C)c2cccnc2)c1 ZINC000183726371 381311561 /nfs/dbraw/zinc/31/15/61/381311561.db2.gz BGBMAHFMAPQYLK-GFCCVEGCSA-N 0 3 272.348 2.989 20 10 CFCDHN COc1ncccc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296235687 381314192 /nfs/dbraw/zinc/31/41/92/381314192.db2.gz AOJXFXDRRKZTQU-AWEZNQCLSA-N 0 3 284.359 2.615 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296329486 381350170 /nfs/dbraw/zinc/35/01/70/381350170.db2.gz GFTCSGHFCABNHX-ZDUSSCGKSA-N 0 3 263.381 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCO[C@]2(CCOC2)C1 ZINC000184286109 381397706 /nfs/dbraw/zinc/39/77/06/381397706.db2.gz ZCFBEVWBDNXCLD-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCO[C@]2(CCOC2)C1 ZINC000184286109 381397715 /nfs/dbraw/zinc/39/77/15/381397715.db2.gz ZCFBEVWBDNXCLD-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)CCCO)c([O-])c1 ZINC000296440744 381397902 /nfs/dbraw/zinc/39/79/02/381397902.db2.gz MGZKXJCQKZLYML-OLZOCXBDSA-N 0 3 251.370 2.760 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000296613611 381472315 /nfs/dbraw/zinc/47/23/15/381472315.db2.gz YRFVEPGMVNBCAM-RDBSUJKOSA-N 0 3 289.375 2.701 20 10 CFCDHN C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1[O-] ZINC000296625738 381477549 /nfs/dbraw/zinc/47/75/49/381477549.db2.gz XCDDNMPJFANVFK-NDNKKMJESA-N 0 3 278.371 2.807 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)C[C@H]2CCCO2)c1[O-] ZINC000184678153 381458373 /nfs/dbraw/zinc/45/83/73/381458373.db2.gz IVQSQFRALHKSQG-GFCCVEGCSA-N 0 3 285.771 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CCCO2)c1[O-] ZINC000184678153 381458378 /nfs/dbraw/zinc/45/83/78/381458378.db2.gz IVQSQFRALHKSQG-GFCCVEGCSA-N 0 3 285.771 2.665 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@H]([NH+](C)C)C2)c1[O-] ZINC000184687224 381461204 /nfs/dbraw/zinc/46/12/04/381461204.db2.gz XSEKTAJQUYGGRX-ZDUSSCGKSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCCOC2)c1[O-] ZINC000184706306 381465058 /nfs/dbraw/zinc/46/50/58/381465058.db2.gz RMVNQOOTJCVFCG-SNVBAGLBSA-N 0 3 285.771 2.570 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1[C@H]3CCO[C@@H]3C13CCC3)CC2 ZINC000297129141 381551266 /nfs/dbraw/zinc/55/12/66/381551266.db2.gz YWTYHYYBRUYLOC-KFZJALRRSA-N 0 3 285.387 2.927 20 10 CFCDHN COc1cc(CNCc2ccc3c(c2)CCN3C)ccc1O ZINC000370967379 381526933 /nfs/dbraw/zinc/52/69/33/381526933.db2.gz ZJRULVKVDIGWLI-UHFFFAOYSA-N 0 3 298.386 2.683 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297918740 381575824 /nfs/dbraw/zinc/57/58/24/381575824.db2.gz XAVPSVYWHWWDLI-OCCSQVGLSA-N 0 3 262.397 2.699 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000371313475 381589337 /nfs/dbraw/zinc/58/93/37/381589337.db2.gz HQHZVPVFZNGSBH-ZIAGYGMSSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000371313475 381589343 /nfs/dbraw/zinc/58/93/43/381589343.db2.gz HQHZVPVFZNGSBH-ZIAGYGMSSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c([O-])c1 ZINC000185369168 381615066 /nfs/dbraw/zinc/61/50/66/381615066.db2.gz KDTQMKYOAVUULN-STQMWFEESA-N 0 3 262.397 2.834 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 ZINC000371471781 381636260 /nfs/dbraw/zinc/63/62/60/381636260.db2.gz WVWCVOCPMLDJFO-FVQBIDKESA-N 0 3 291.391 2.646 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 ZINC000371471781 381636264 /nfs/dbraw/zinc/63/62/64/381636264.db2.gz WVWCVOCPMLDJFO-FVQBIDKESA-N 0 3 291.391 2.646 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 ZINC000371471784 381637044 /nfs/dbraw/zinc/63/70/44/381637044.db2.gz WVWCVOCPMLDJFO-NUEKZKHPSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 ZINC000371471784 381637050 /nfs/dbraw/zinc/63/70/50/381637050.db2.gz WVWCVOCPMLDJFO-NUEKZKHPSA-N 0 3 291.391 2.646 20 10 CFCDHN C[C@@H](O)CC[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185456393 381638797 /nfs/dbraw/zinc/63/87/97/381638797.db2.gz VGOQZYYYBPZRGV-NEPJUHHUSA-N 0 3 263.381 2.693 20 10 CFCDHN CCOC(=O)C1(C)CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000371616835 381666177 /nfs/dbraw/zinc/66/61/77/381666177.db2.gz QRQJEPMXTDUYBO-UHFFFAOYSA-N 0 3 295.354 2.697 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H]2c3ccccc3C[C@@H]2O)c1 ZINC000185674418 381702388 /nfs/dbraw/zinc/70/23/88/381702388.db2.gz MYRQYUSMWNDKJE-NBHSMZAVSA-N 0 3 299.370 2.710 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)C2CCOCC2)c1 ZINC000185782546 381732751 /nfs/dbraw/zinc/73/27/51/381732751.db2.gz MWPHNMRQSITRFD-NEPJUHHUSA-N 0 3 279.380 2.867 20 10 CFCDHN C[C@H]1CCC[N@@H+]1C1CCN(Cc2ccccc2[O-])CC1 ZINC000360041987 381745865 /nfs/dbraw/zinc/74/58/65/381745865.db2.gz SMUFQPLOJZSOAY-AWEZNQCLSA-N 0 3 274.408 2.841 20 10 CFCDHN C[C@H]1CCC[N@H+]1C1CCN(Cc2ccccc2[O-])CC1 ZINC000360041987 381745866 /nfs/dbraw/zinc/74/58/66/381745866.db2.gz SMUFQPLOJZSOAY-AWEZNQCLSA-N 0 3 274.408 2.841 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1cc2c(cc1[O-])CCCC2 ZINC000185830595 381748144 /nfs/dbraw/zinc/74/81/44/381748144.db2.gz UVGMPPJONPGEGW-HEHGZKQESA-N 0 3 287.403 2.859 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c1 ZINC000185735948 381719947 /nfs/dbraw/zinc/71/99/47/381719947.db2.gz HJCRGDUMAGEXOB-MCIONIFRSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)Cc2cc(C)n[nH]2)c1 ZINC000186130866 381830407 /nfs/dbraw/zinc/83/04/07/381830407.db2.gz RNCSSNCAFZBBHR-ZYHUDNBSSA-N 0 3 289.379 2.714 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000186154204 381837192 /nfs/dbraw/zinc/83/71/92/381837192.db2.gz CZDHXJRDQBPGEA-ZANVPECISA-N 0 3 253.317 2.607 20 10 CFCDHN CC[C@H]([NH2+]CCc1cccc(C(N)=O)c1)c1ccccc1[O-] ZINC000186264608 381868316 /nfs/dbraw/zinc/86/83/16/381868316.db2.gz OVOOZCIFBDBHCD-INIZCTEOSA-N 0 3 298.386 2.775 20 10 CFCDHN COCC(C)(C)[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000292867122 381874840 /nfs/dbraw/zinc/87/48/40/381874840.db2.gz VZFGCDDYSBKZEG-UHFFFAOYSA-N 0 3 287.787 2.911 20 10 CFCDHN COCC(C)(C)[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000292867122 381874844 /nfs/dbraw/zinc/87/48/44/381874844.db2.gz VZFGCDDYSBKZEG-UHFFFAOYSA-N 0 3 287.787 2.911 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](c3nccn3C)C2)c1[O-] ZINC000372996341 381906499 /nfs/dbraw/zinc/90/64/99/381906499.db2.gz HYOZQTVYFHRPHY-HNNXBMFYSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](c3nccn3C)C2)c1[O-] ZINC000372996341 381906504 /nfs/dbraw/zinc/90/65/04/381906504.db2.gz HYOZQTVYFHRPHY-HNNXBMFYSA-N 0 3 285.391 2.814 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186501783 381928634 /nfs/dbraw/zinc/92/86/34/381928634.db2.gz XOSLIXSYTLDYMK-UHFFFAOYSA-N 0 3 297.395 2.629 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCSC2(CCOCC2)C1 ZINC000186501783 381928636 /nfs/dbraw/zinc/92/86/36/381928636.db2.gz XOSLIXSYTLDYMK-UHFFFAOYSA-N 0 3 297.395 2.629 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCCC3(CCC3)C1)OCO2 ZINC000373485830 382015247 /nfs/dbraw/zinc/01/52/47/382015247.db2.gz PGBSCUALHUOJAE-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCCC3(CCC3)C1)OCO2 ZINC000373485830 382015251 /nfs/dbraw/zinc/01/52/51/382015251.db2.gz PGBSCUALHUOJAE-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000373535432 382019022 /nfs/dbraw/zinc/01/90/22/382019022.db2.gz REIWGUKNBRYKSQ-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000373535432 382019030 /nfs/dbraw/zinc/01/90/30/382019030.db2.gz REIWGUKNBRYKSQ-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1C[C@@H](CO)c2ccccc21 ZINC000373636705 382022464 /nfs/dbraw/zinc/02/24/64/382022464.db2.gz XIPBNODSAUYMPV-BBRMVZONSA-N 0 3 269.344 2.703 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1cc(Cl)cc(OC)c1[O-])OC ZINC000293725267 382251694 /nfs/dbraw/zinc/25/16/94/382251694.db2.gz QZIPVJAOBLUGDG-GFCCVEGCSA-N 0 3 287.787 2.959 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCN2CCC1CC2 ZINC000377623991 382305202 /nfs/dbraw/zinc/30/52/02/382305202.db2.gz JVCVHNHIPSHDOC-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCN2CCC1CC2 ZINC000377623991 382305210 /nfs/dbraw/zinc/30/52/10/382305210.db2.gz JVCVHNHIPSHDOC-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1ccccc1[O-] ZINC000187975282 382313783 /nfs/dbraw/zinc/31/37/83/382313783.db2.gz JMFZULPSISMPLZ-BPLDGKMQSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1ccccc1[O-] ZINC000187975304 382314067 /nfs/dbraw/zinc/31/40/67/382314067.db2.gz JMFZULPSISMPLZ-SNPRPXQTSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@@](=O)CC[C@@H]1C ZINC000377698944 382323938 /nfs/dbraw/zinc/32/39/38/382323938.db2.gz NBVMQYDREUNYON-CFZJUORYSA-N 0 3 281.421 2.686 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCN2CCOC2=O)c([O-])c1 ZINC000293920926 382337547 /nfs/dbraw/zinc/33/75/47/382337547.db2.gz XIOWSGNJZVDKQG-ZDUSSCGKSA-N 0 3 292.379 2.502 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCc2cn[nH]c2)c([O-])c1 ZINC000294039247 382390028 /nfs/dbraw/zinc/39/00/28/382390028.db2.gz FYWKDOYCYCZTKI-LBPRGKRZSA-N 0 3 259.353 2.625 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H](O)CC2)c([O-])c1 ZINC000294066012 382400969 /nfs/dbraw/zinc/40/09/69/382400969.db2.gz QHMJBMKBPFJGSU-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H](O)CC2)c([O-])c1 ZINC000294066012 382400972 /nfs/dbraw/zinc/40/09/72/382400972.db2.gz QHMJBMKBPFJGSU-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN [O-]c1c(F)cccc1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000378488527 382471244 /nfs/dbraw/zinc/47/12/44/382471244.db2.gz BFHNILLFJPJRCH-HNNXBMFYSA-N 0 3 292.398 2.982 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cccc(OCC)c1[O-])C(C)C ZINC000188868462 382495500 /nfs/dbraw/zinc/49/55/00/382495500.db2.gz NCMNWTHNWQEHKH-CQSZACIVSA-N 0 3 281.396 2.942 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@@H]21 ZINC000378538101 382479284 /nfs/dbraw/zinc/47/92/84/382479284.db2.gz ZZKJCYBEOINOKU-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@@H]21 ZINC000378538101 382479290 /nfs/dbraw/zinc/47/92/90/382479290.db2.gz ZZKJCYBEOINOKU-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CCN1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263490 382484958 /nfs/dbraw/zinc/48/49/58/382484958.db2.gz NYMUDHYPCUWEAN-SNVBAGLBSA-N 0 3 286.778 2.616 20 10 CFCDHN CC[N@@H+]1CC[C@H](CNCc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263490 382484961 /nfs/dbraw/zinc/48/49/61/382484961.db2.gz NYMUDHYPCUWEAN-SNVBAGLBSA-N 0 3 286.778 2.616 20 10 CFCDHN CC[N@H+]1CC[C@H](CNCc2cc(Cl)c(F)cc2[O-])C1 ZINC000294263490 382484965 /nfs/dbraw/zinc/48/49/65/382484965.db2.gz NYMUDHYPCUWEAN-SNVBAGLBSA-N 0 3 286.778 2.616 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC2(CO)CC2)c1[O-] ZINC000188962204 382513272 /nfs/dbraw/zinc/51/32/72/382513272.db2.gz PAKKQCICODTQDM-UHFFFAOYSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC2(CO)CC2)c1[O-] ZINC000188962204 382513274 /nfs/dbraw/zinc/51/32/74/382513274.db2.gz PAKKQCICODTQDM-UHFFFAOYSA-N 0 3 269.772 2.558 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])CC1(C)C ZINC000295122698 382576843 /nfs/dbraw/zinc/57/68/43/382576843.db2.gz XOOBYEBEVFAKST-AWEZNQCLSA-N 0 3 267.344 2.778 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])CC1(C)C ZINC000295122698 382576846 /nfs/dbraw/zinc/57/68/46/382576846.db2.gz XOOBYEBEVFAKST-AWEZNQCLSA-N 0 3 267.344 2.778 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](SC)C2)c1 ZINC000295141642 382577946 /nfs/dbraw/zinc/57/79/46/382577946.db2.gz ZSPLAALMFWSSSS-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](SC)C2)c1 ZINC000295141642 382577947 /nfs/dbraw/zinc/57/79/47/382577947.db2.gz ZSPLAALMFWSSSS-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@@]1(CO)CCC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000190235137 382657988 /nfs/dbraw/zinc/65/79/88/382657988.db2.gz UXMFDOWNYVEKFD-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[C@@]1(CO)CCC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000190235137 382657990 /nfs/dbraw/zinc/65/79/90/382657990.db2.gz UXMFDOWNYVEKFD-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)cc1C ZINC000190344613 382663226 /nfs/dbraw/zinc/66/32/26/382663226.db2.gz VRYBMHSKPORFLD-FMKPAKJESA-N 0 3 261.365 2.666 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c1 ZINC000251695546 383393739 /nfs/dbraw/zinc/39/37/39/383393739.db2.gz JQKKOGWHQXCEDW-GMZLATJGSA-N 0 3 261.365 2.919 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c1 ZINC000251685375 383394040 /nfs/dbraw/zinc/39/40/40/383394040.db2.gz JENGNLPZQBTFGD-PNEXNCLXSA-N 0 3 277.364 2.619 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)cc1C ZINC000249955337 383368226 /nfs/dbraw/zinc/36/82/26/383368226.db2.gz VRYBMHSKPORFLD-LZWOXQAQSA-N 0 3 261.365 2.666 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000252805595 383435487 /nfs/dbraw/zinc/43/54/87/383435487.db2.gz GANQILYAQULYFL-DCAQKATOSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@H](N[C@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1[O-] ZINC000530216071 383768359 /nfs/dbraw/zinc/76/83/59/383768359.db2.gz MHVMHLNUPKELPO-HZMBPMFUSA-N 0 3 280.799 2.981 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCC[C@H]1O)c1ccccc1[O-] ZINC000246862261 522631967 /nfs/dbraw/zinc/63/19/67/522631967.db2.gz DSVIBOAPIOQPGF-VHDGCEQUSA-N 0 3 263.381 2.984 20 10 CFCDHN COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000266961813 384269407 /nfs/dbraw/zinc/26/94/07/384269407.db2.gz KICUDNYTMDESGF-MRXNPFEDSA-N 0 3 271.360 2.740 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])c1ccc([S@@](C)=O)cc1 ZINC000268824191 384670908 /nfs/dbraw/zinc/67/09/08/384670908.db2.gz KUEXXWTUFBFREW-MPBGBICISA-N 0 3 289.400 2.980 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000268968726 384704978 /nfs/dbraw/zinc/70/49/78/384704978.db2.gz LVYJNDJYOCEPRO-CQSZACIVSA-N 0 3 291.391 2.982 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(N(C)C)nc1)c1ccccc1[O-] ZINC000269231149 384739520 /nfs/dbraw/zinc/73/95/20/384739520.db2.gz FYHCZDNBUQQUFL-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@@H](C)C(C)C)cc1OC ZINC000271100294 385336627 /nfs/dbraw/zinc/33/66/27/385336627.db2.gz OSWYPTYKJUXWRN-NSHDSACASA-N 0 3 267.369 2.886 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@@H](C)C(C)C)cc1OC ZINC000271100294 385336629 /nfs/dbraw/zinc/33/66/29/385336629.db2.gz OSWYPTYKJUXWRN-NSHDSACASA-N 0 3 267.369 2.886 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](CCO)c2ccccc2)c1[O-] ZINC000271794205 385392182 /nfs/dbraw/zinc/39/21/82/385392182.db2.gz HPVQQKGJNCRBEL-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1cccc(CN[C@H](CCO)c2ccccc2)c1O ZINC000271794205 385392185 /nfs/dbraw/zinc/39/21/85/385392185.db2.gz HPVQQKGJNCRBEL-MRXNPFEDSA-N 0 3 271.360 2.914 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CSC2(C)C)c1 ZINC000282970452 385417400 /nfs/dbraw/zinc/41/74/00/385417400.db2.gz DCZSNCLVSLORBD-NOZJJQNGSA-N 0 3 267.394 2.945 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@@]1(C)[NH2+]Cc1cccc(C)c1[O-] ZINC000272415175 385531818 /nfs/dbraw/zinc/53/18/18/385531818.db2.gz MFKPNZHLZSROPF-RHSMWYFYSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2cc(C)ccc2O)n(C)n1 ZINC000284147841 385541320 /nfs/dbraw/zinc/54/13/20/385541320.db2.gz DKTIBXKBZGCSAI-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN COC[C@@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000284006651 385523437 /nfs/dbraw/zinc/52/34/37/385523437.db2.gz HYAOZXAYHBWWOX-AAEUAGOBSA-N 0 3 251.370 2.942 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000272394947 385526449 /nfs/dbraw/zinc/52/64/49/385526449.db2.gz HXXIPKABSMAEBD-LSDHHAIUSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000272394947 385526452 /nfs/dbraw/zinc/52/64/52/385526452.db2.gz HXXIPKABSMAEBD-LSDHHAIUSA-N 0 3 277.408 2.930 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCO[C@@H]1c1cccnc1 ZINC000284641493 385549912 /nfs/dbraw/zinc/54/99/12/385549912.db2.gz OATNUAQLPCJDOJ-GOEBONIOSA-N 0 3 288.322 2.546 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000285003881 385551047 /nfs/dbraw/zinc/55/10/47/385551047.db2.gz GXSINURAIKUWFK-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000285236370 385552264 /nfs/dbraw/zinc/55/22/64/385552264.db2.gz SIKFZEGDUHUGKK-HIFRSBDPSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000285236370 385552267 /nfs/dbraw/zinc/55/22/67/385552267.db2.gz SIKFZEGDUHUGKK-HIFRSBDPSA-N 0 3 265.328 2.675 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c([O-])c1 ZINC000285219845 385552596 /nfs/dbraw/zinc/55/25/96/385552596.db2.gz OVWHRSJBGGGFKT-RNODOKPDSA-N 0 3 295.448 2.961 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H]2CCOC[C@H]2C)c1 ZINC000285413085 385555739 /nfs/dbraw/zinc/55/57/39/385555739.db2.gz GCJNWDMIVTVYDK-OLZOCXBDSA-N 0 3 279.380 2.553 20 10 CFCDHN Cc1cccc(CCC[NH2+]Cc2ccccc2[O-])n1 ZINC000285480110 385556415 /nfs/dbraw/zinc/55/64/15/385556415.db2.gz HZSKWYDOFYFPHZ-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000272683488 385587914 /nfs/dbraw/zinc/58/79/14/385587914.db2.gz VVPSSNXOTRTXMT-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000272683488 385587917 /nfs/dbraw/zinc/58/79/17/385587917.db2.gz VVPSSNXOTRTXMT-HIFRSBDPSA-N 0 3 263.381 2.684 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCc2cnccn2)cc1 ZINC000272896570 385645673 /nfs/dbraw/zinc/64/56/73/385645673.db2.gz ZYQNQXWWISEPLH-UHFFFAOYSA-N 0 3 298.434 2.997 20 10 CFCDHN Cc1ccc([C@H](C)NCc2cnn(C)c2)c(O)c1C ZINC000273423133 385682677 /nfs/dbraw/zinc/68/26/77/385682677.db2.gz SOGZTTHOMWHVDM-LBPRGKRZSA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c([O-])c1C ZINC000273469430 385684233 /nfs/dbraw/zinc/68/42/33/385684233.db2.gz JKJGICGXWQYVFD-MELADBBJSA-N 0 3 261.365 2.597 20 10 CFCDHN C[C@H]([NH2+]CCOc1ncccc1F)c1cc(F)ccc1[O-] ZINC000273496030 385686518 /nfs/dbraw/zinc/68/65/18/385686518.db2.gz PAWVHKKKQWRWBB-JTQLQIEISA-N 0 3 294.301 2.795 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cn2cccn2)c([O-])c1C ZINC000273503757 385686626 /nfs/dbraw/zinc/68/66/26/385686626.db2.gz QPACLWZRCXLQPT-OCCSQVGLSA-N 0 3 273.380 2.945 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000273548986 385687743 /nfs/dbraw/zinc/68/77/43/385687743.db2.gz FNPNKORZTVKXIS-WQGACYEGSA-N 0 3 290.407 2.534 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@]2(N(C)C)CCSC2)c([O-])c1 ZINC000273570640 385688931 /nfs/dbraw/zinc/68/89/31/385688931.db2.gz KOXZBBBPXWUYEJ-BBRMVZONSA-N 0 3 294.464 2.789 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273584303 385690001 /nfs/dbraw/zinc/69/00/01/385690001.db2.gz NISFJJDQZAGSQY-DOMZBBRYSA-N 0 3 251.370 2.821 20 10 CFCDHN CC(=O)NC1CCC([NH2+][C@@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273609600 385691052 /nfs/dbraw/zinc/69/10/52/385691052.db2.gz VIHIGZUBKNFONP-GRTSSRMGSA-N 0 3 290.407 2.799 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@H](C)c2cc(F)ccc2[O-])o1 ZINC000273619846 385692695 /nfs/dbraw/zinc/69/26/95/385692695.db2.gz YQXMNPZRKUDQNO-QMTHXVAHSA-N 0 3 279.311 2.817 20 10 CFCDHN CCn1cc(CNCc2cc(Cl)cc(OC)c2O)cn1 ZINC000273692973 385694544 /nfs/dbraw/zinc/69/45/44/385694544.db2.gz BOYQAWLCHAAZID-UHFFFAOYSA-N 0 3 295.770 2.560 20 10 CFCDHN OCC[C@@H](N[C@H]1CCc2cccc(O)c21)c1ccco1 ZINC000296465602 285263503 /nfs/dbraw/zinc/26/35/03/285263503.db2.gz OBDWRWOIBLNWAD-OLZOCXBDSA-N 0 3 273.332 2.686 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CC[C@H](N2CCCCC2)C1 ZINC000166374796 285380318 /nfs/dbraw/zinc/38/03/18/285380318.db2.gz FSCXSLPWTLEPGD-AWEZNQCLSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CC[C@H](N2CCCCC2)C1 ZINC000166374796 285380323 /nfs/dbraw/zinc/38/03/23/285380323.db2.gz FSCXSLPWTLEPGD-AWEZNQCLSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1COc3ccccc3C1)CC2 ZINC000297502524 285396746 /nfs/dbraw/zinc/39/67/46/285396746.db2.gz CAXUPQCMQDIIDL-CABCVRRESA-N 0 3 281.355 2.973 20 10 CFCDHN Oc1cccc2c1[C@@H](N[C@@H]1CCCc3c[nH]nc31)CC2 ZINC000296660796 285396964 /nfs/dbraw/zinc/39/69/64/285396964.db2.gz FEQNYVMBAGEHFP-QWHCGFSZSA-N 0 3 269.348 2.770 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+]Cc2cccc(C)c2[O-])n1 ZINC000164418847 130329297 /nfs/dbraw/zinc/32/92/97/130329297.db2.gz MCFGLFODWBZWNK-UHFFFAOYSA-N 0 3 273.380 2.694 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000179944379 393471779 /nfs/dbraw/zinc/47/17/79/393471779.db2.gz GBDGCKYADQDQMD-NSHDSACASA-N 0 3 275.327 2.634 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000179944379 393471786 /nfs/dbraw/zinc/47/17/86/393471786.db2.gz GBDGCKYADQDQMD-NSHDSACASA-N 0 3 275.327 2.634 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC23CCOCC3)c1[O-] ZINC000374283961 393491084 /nfs/dbraw/zinc/49/10/84/393491084.db2.gz NMRDTOQIOHBCGT-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC23CCOCC3)c1[O-] ZINC000374283961 393491088 /nfs/dbraw/zinc/49/10/88/393491088.db2.gz NMRDTOQIOHBCGT-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@]3(CCOC3)C2)cc1F ZINC000374256641 393491195 /nfs/dbraw/zinc/49/11/95/393491195.db2.gz WWBPREBDNRMWIH-INIZCTEOSA-N 0 3 278.371 2.504 20 10 CFCDHN Cc1ccc(O)c(CN[C@@]2(CO)CCc3ccccc32)c1 ZINC000305127538 393500083 /nfs/dbraw/zinc/50/00/83/393500083.db2.gz DGWHSHCINNNZOK-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@]2(CO)CCc3ccccc32)c1 ZINC000305127538 393500092 /nfs/dbraw/zinc/50/00/92/393500092.db2.gz DGWHSHCINNNZOK-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185424992 393534331 /nfs/dbraw/zinc/53/43/31/393534331.db2.gz BYPIHYGMBHZUGK-ZUZCIYMTSA-N 0 3 269.360 2.979 20 10 CFCDHN C[N@H+](CCOc1ccccc1)Cc1ccccc1[O-] ZINC000109772594 393879579 /nfs/dbraw/zinc/87/95/79/393879579.db2.gz VHFNGALSRQFDOD-UHFFFAOYSA-N 0 3 257.333 2.903 20 10 CFCDHN C[N@@H+](CCOc1ccccc1)Cc1ccccc1[O-] ZINC000109772594 393879581 /nfs/dbraw/zinc/87/95/81/393879581.db2.gz VHFNGALSRQFDOD-UHFFFAOYSA-N 0 3 257.333 2.903 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562598 394030255 /nfs/dbraw/zinc/03/02/55/394030255.db2.gz FAGRMVDNPDHUOR-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562598 394030259 /nfs/dbraw/zinc/03/02/59/394030259.db2.gz FAGRMVDNPDHUOR-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562598 394030260 /nfs/dbraw/zinc/03/02/60/394030260.db2.gz FAGRMVDNPDHUOR-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562598 394030262 /nfs/dbraw/zinc/03/02/62/394030262.db2.gz FAGRMVDNPDHUOR-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CSC ZINC000282341710 394123176 /nfs/dbraw/zinc/12/31/76/394123176.db2.gz BYGFRCSACZFSKF-CQSZACIVSA-N 0 3 283.437 2.718 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CSC ZINC000282341710 394123179 /nfs/dbraw/zinc/12/31/79/394123179.db2.gz BYGFRCSACZFSKF-CQSZACIVSA-N 0 3 283.437 2.718 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccc3c(c2)CCN3C)c1[O-] ZINC000364448245 394214637 /nfs/dbraw/zinc/21/46/37/394214637.db2.gz QNWYDYCXMKPSHK-UHFFFAOYSA-N 0 3 298.386 2.683 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@](C)(C(=O)OC)C1 ZINC000368795933 394277404 /nfs/dbraw/zinc/27/74/04/394277404.db2.gz HQCMNUNRXJJCAX-XJKSGUPXSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@](C)(C(=O)OC)C1 ZINC000368795933 394277407 /nfs/dbraw/zinc/27/74/07/394277407.db2.gz HQCMNUNRXJJCAX-XJKSGUPXSA-N 0 3 277.364 2.728 20 10 CFCDHN C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)[C@@H](C)O1 ZINC000295233685 394298069 /nfs/dbraw/zinc/29/80/69/394298069.db2.gz SECDSDFCNCIMQU-GYSYKLTISA-N 0 3 266.360 2.547 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(CO)CC3(CCC3)C1)CC2 ZINC000296339971 394307963 /nfs/dbraw/zinc/30/79/63/394307963.db2.gz GXCRUDPNYOSDGK-AWEZNQCLSA-N 0 3 287.403 2.912 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@]1(O)CCc3ccccc31)CC2 ZINC000297050654 394313170 /nfs/dbraw/zinc/31/31/70/394313170.db2.gz VOVZWRCIVKOXOV-QFBILLFUSA-N 0 3 295.382 2.803 20 10 CFCDHN COc1cccc([C@H](C)[NH2+]CC[C@H]2CCCOC2)c1[O-] ZINC000527925211 394426703 /nfs/dbraw/zinc/42/67/03/394426703.db2.gz LIYSLGFHBSXQTO-QWHCGFSZSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CC(C)(C)O)c1 ZINC000295069911 286338885 /nfs/dbraw/zinc/33/88/85/286338885.db2.gz PEPKSLXTLGRDBL-GHMZBOCLSA-N 0 3 267.369 2.601 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccccn2)c1 ZINC000019916726 170926104 /nfs/dbraw/zinc/92/61/04/170926104.db2.gz QLDNVKTUQQYINJ-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc(O)c2)cc1 ZINC000020146115 171031723 /nfs/dbraw/zinc/03/17/23/171031723.db2.gz WCBOHBHAUBBMLR-UHFFFAOYSA-N 0 3 256.349 2.748 20 10 CFCDHN CN(C)[C@@H](C[NH2+]Cc1ccccc1[O-])c1cccs1 ZINC000020147582 171034186 /nfs/dbraw/zinc/03/41/86/171034186.db2.gz NHRKAGAPLAWFHC-ZDUSSCGKSA-N 0 3 276.405 2.846 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCOC(C)C)c1 ZINC000020198129 171061895 /nfs/dbraw/zinc/06/18/95/171061895.db2.gz HRASJCXOOWQWJE-LBPRGKRZSA-N 0 3 267.369 2.867 20 10 CFCDHN Cc1ncc(CNCc2ccc(N(C)C)cc2)s1 ZINC000037505447 173241001 /nfs/dbraw/zinc/24/10/01/173241001.db2.gz KGOPLQCHIKYGRA-UHFFFAOYSA-N 0 3 261.394 2.807 20 10 CFCDHN CN(C)c1ccc(CN2CCOCC3(CCC3)C2)cc1 ZINC000363929180 262036105 /nfs/dbraw/zinc/03/61/05/262036105.db2.gz PKXLOXMGDMGGTH-UHFFFAOYSA-N 0 3 274.408 2.755 20 10 CFCDHN COCC(C)(C)[N@H+](C)Cc1cc(C)c(C)cc1[O-] ZINC000292710690 263134097 /nfs/dbraw/zinc/13/40/97/263134097.db2.gz DEGVJOKLKKNHAZ-UHFFFAOYSA-N 0 3 251.370 2.866 20 10 CFCDHN COCC(C)(C)[N@@H+](C)Cc1cc(C)c(C)cc1[O-] ZINC000292710690 263134098 /nfs/dbraw/zinc/13/40/98/263134098.db2.gz DEGVJOKLKKNHAZ-UHFFFAOYSA-N 0 3 251.370 2.866 20 10 CFCDHN COCC1(C[NH2+][C@H](C)c2cc(C)ccc2[O-])CCOCC1 ZINC000368363789 267166623 /nfs/dbraw/zinc/16/66/23/267166623.db2.gz KDMXMZFHGASFML-CQSZACIVSA-N 0 3 293.407 2.794 20 10 CFCDHN COc1cccc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000368763032 267202411 /nfs/dbraw/zinc/20/24/11/267202411.db2.gz BGGQRHJEJNBTHF-SJORKVTESA-N 0 3 291.391 2.696 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCC23CCOCC3)c1[O-] ZINC000371391445 267397620 /nfs/dbraw/zinc/39/76/20/267397620.db2.gz DQHDWPYOXMBWOR-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCC23CCOCC3)c1[O-] ZINC000371391445 267397622 /nfs/dbraw/zinc/39/76/22/267397622.db2.gz DQHDWPYOXMBWOR-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@@H](C)[C@H]2C)c1[O-] ZINC000093501196 278010869 /nfs/dbraw/zinc/01/08/69/278010869.db2.gz HWVPPRDKPLQABP-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(CN2CCS[C@@H](C)[C@H]2C)c1O ZINC000093501196 278010866 /nfs/dbraw/zinc/01/08/66/278010866.db2.gz HWVPPRDKPLQABP-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c1[O-] ZINC000093501196 278010868 /nfs/dbraw/zinc/01/08/68/278010868.db2.gz HWVPPRDKPLQABP-MNOVXSKESA-N 0 3 267.394 2.727 20 10 CFCDHN CCN1CCCC[C@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297962726 279282968 /nfs/dbraw/zinc/28/29/68/279282968.db2.gz ZIQMTUBUBLRFNX-GJZGRUSLSA-N 0 3 274.408 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCN2CCCCCC2)c1 ZINC000071408298 280919626 /nfs/dbraw/zinc/91/96/26/280919626.db2.gz HSPIPSWZMBEYLN-UHFFFAOYSA-N 0 3 262.397 2.666 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)C[C@@H](C)O)c1 ZINC000186075214 295168386 /nfs/dbraw/zinc/16/83/86/295168386.db2.gz XGJHCKMTARAZAD-NEPJUHHUSA-N 0 3 281.396 2.849 20 10 CFCDHN CC(C)(C)C[C@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296242273 327091506 /nfs/dbraw/zinc/09/15/06/327091506.db2.gz AWJCHCKHGJKRAV-OLZOCXBDSA-N 0 3 263.381 2.766 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCc3ccccc3OC2)c1[O-] ZINC000374544423 328993319 /nfs/dbraw/zinc/99/33/19/328993319.db2.gz RJTCKHWNKUDIGT-HNNXBMFYSA-N 0 3 299.370 2.884 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000378126340 329040770 /nfs/dbraw/zinc/04/07/70/329040770.db2.gz DNFVMXYMKOHTOJ-INIZCTEOSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000378126340 329040772 /nfs/dbraw/zinc/04/07/72/329040772.db2.gz DNFVMXYMKOHTOJ-INIZCTEOSA-N 0 3 263.381 2.541 20 10 CFCDHN CCOc1ccc(O)c(CNCc2cccnc2C)c1 ZINC000527790758 330283450 /nfs/dbraw/zinc/28/34/50/330283450.db2.gz KKXQTMFMRPWBLD-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[C@H]2CCCOC2)c1 ZINC000527928166 330296806 /nfs/dbraw/zinc/29/68/06/330296806.db2.gz NHIGYLDLTHOKRE-QWHCGFSZSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc(CC[NH2+][C@H]2CCc3cccc([O-])c32)cn1 ZINC000527990477 330299183 /nfs/dbraw/zinc/29/91/83/330299183.db2.gz OHHUGRVRELSCTF-AWEZNQCLSA-N 0 3 284.359 2.615 20 10 CFCDHN CCc1cccc(C[NH2+]CC[C@@H]2CCCOC2)c1[O-] ZINC000529636882 333502339 /nfs/dbraw/zinc/50/23/39/333502339.db2.gz KOVPITYHRNRTLW-ZDUSSCGKSA-N 0 3 263.381 2.861 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](CO)C(C)(C)C)c([O-])c1 ZINC000194631847 520375762 /nfs/dbraw/zinc/37/57/62/520375762.db2.gz UOUXEWWBBNONKX-OAHLLOKOSA-N 0 3 281.396 2.678 20 10 CFCDHN CC(C)CCOCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000226587951 519668895 /nfs/dbraw/zinc/66/88/95/519668895.db2.gz SJSPVPRISJLKGT-UHFFFAOYSA-N 0 3 255.333 2.684 20 10 CFCDHN CCOCc1cc(CNC[C@@H](OC)C2CC2)ccc1OC ZINC000293202136 520186570 /nfs/dbraw/zinc/18/65/70/520186570.db2.gz XTFYSHBIOSSHDO-QGZVFWFLSA-N 0 3 293.407 2.746 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])[C@H]1OC ZINC000274988828 520427336 /nfs/dbraw/zinc/42/73/36/520427336.db2.gz YQYRNPWLKBUAFD-GZBFAFLISA-N 0 3 299.798 2.636 20 10 CFCDHN CCN(CC)c1ccc(CNCc2c[nH]nc2C)cc1 ZINC000037989171 520908973 /nfs/dbraw/zinc/90/89/73/520908973.db2.gz QTRIOOBBVODERD-UHFFFAOYSA-N 0 3 272.396 2.854 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000290247243 520965481 /nfs/dbraw/zinc/96/54/81/520965481.db2.gz VILHRQVVVYBKQU-OAHLLOKOSA-N 0 3 267.344 2.516 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000290247243 520965490 /nfs/dbraw/zinc/96/54/90/520965490.db2.gz VILHRQVVVYBKQU-OAHLLOKOSA-N 0 3 267.344 2.516 20 10 CFCDHN CCN(CC[NH2+]Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000227874299 521077331 /nfs/dbraw/zinc/07/73/31/521077331.db2.gz PDYUPRAFUWYRDI-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H]2CC[C@H](O)CC2)c1 ZINC000275893038 521144822 /nfs/dbraw/zinc/14/48/22/521144822.db2.gz CHQQVVBKBMMDPH-HDJSIYSDSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c1 ZINC000275893038 521144830 /nfs/dbraw/zinc/14/48/30/521144830.db2.gz CHQQVVBKBMMDPH-HDJSIYSDSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(CCCO)CC2)c1 ZINC000272908314 521145068 /nfs/dbraw/zinc/14/50/68/521145068.db2.gz HHSNCKPGWKJDTF-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000245796705 521145889 /nfs/dbraw/zinc/14/58/89/521145889.db2.gz XBWKGILEVKXUTQ-SUMWQHHRSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000245796705 521145899 /nfs/dbraw/zinc/14/58/99/521145899.db2.gz XBWKGILEVKXUTQ-SUMWQHHRSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H]2CCO[C@@H](C)C2)c1 ZINC000271569587 521151072 /nfs/dbraw/zinc/15/10/72/521151072.db2.gz WXOFIGOLAFRWNZ-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H](O)c2ccc(C)o2)c1 ZINC000266038000 521152645 /nfs/dbraw/zinc/15/26/45/521152645.db2.gz SZEGQDHHNHWGIC-HNNXBMFYSA-N 0 3 291.347 2.516 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H]2CCSC2)c1 ZINC000279891298 521152942 /nfs/dbraw/zinc/15/29/42/521152942.db2.gz GPTKFUFIZIMATD-NSHDSACASA-N 0 3 267.394 2.634 20 10 CFCDHN CC[N@@H+](Cc1cc(OC)c(OC)cc1[O-])CC1CC1 ZINC000160185861 521291366 /nfs/dbraw/zinc/29/13/66/521291366.db2.gz RLNLXMHJQJHDKI-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN CC[N@H+](Cc1cc(OC)c(OC)cc1[O-])CC1CC1 ZINC000160185861 521291374 /nfs/dbraw/zinc/29/13/74/521291374.db2.gz RLNLXMHJQJHDKI-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(OCC)ccc1[O-] ZINC000278716891 521316811 /nfs/dbraw/zinc/31/68/11/521316811.db2.gz PGKHFQWFOBEHDX-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cc(OCC)ccc1[O-] ZINC000278716891 521316819 /nfs/dbraw/zinc/31/68/19/521316819.db2.gz PGKHFQWFOBEHDX-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(CCOC)CC2)c1[O-] ZINC000151178640 521362964 /nfs/dbraw/zinc/36/29/64/521362964.db2.gz HVTKRRKLYCSCHX-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H]2CCO[C@H](C)C2)c1[O-] ZINC000271591062 521365831 /nfs/dbraw/zinc/36/58/31/521365831.db2.gz ZUQNTENNXRIMCI-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228668711 521658651 /nfs/dbraw/zinc/65/86/51/521658651.db2.gz BOLJGOCRCKVKKG-ZDUSSCGKSA-N 0 3 298.814 2.628 20 10 CFCDHN CCOCC(C)(C)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000293056625 521671426 /nfs/dbraw/zinc/67/14/26/521671426.db2.gz UMCDCNMDVKYWNP-UHFFFAOYSA-N 0 3 251.370 2.914 20 10 CFCDHN CCCN(Cc1cc(C)ncn1)Cc1ccccc1O ZINC000292379105 521681180 /nfs/dbraw/zinc/68/11/80/521681180.db2.gz HFWUJUPAKGSCDZ-UHFFFAOYSA-N 0 3 271.364 2.903 20 10 CFCDHN CCC[N@H+](Cc1ccnc(N)c1)Cc1ccccc1[O-] ZINC000193364979 521691016 /nfs/dbraw/zinc/69/10/16/521691016.db2.gz AVFCYYPTXLPYAY-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN CCC[N@@H+](Cc1ccnc(N)c1)Cc1ccccc1[O-] ZINC000193364979 521691018 /nfs/dbraw/zinc/69/10/18/521691018.db2.gz AVFCYYPTXLPYAY-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2c([O-])cccc2Cl)C1 ZINC000156071136 522097508 /nfs/dbraw/zinc/09/75/08/522097508.db2.gz KNIJTCJUYQFENM-NSHDSACASA-N 0 3 268.788 2.572 20 10 CFCDHN CC[C@H]([NH2+]CC1(C)OCCCO1)c1ccc(C)cc1[O-] ZINC000280134070 522571088 /nfs/dbraw/zinc/57/10/88/522571088.db2.gz PDFQGCNQJZSOBO-AWEZNQCLSA-N 0 3 279.380 2.894 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)C[C@@H](C)O)c1ccccc1[O-] ZINC000155962444 522605597 /nfs/dbraw/zinc/60/55/97/522605597.db2.gz DITXSAHSKQHFIG-SCRDCRAPSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H]([NH2+]C[C@@]1(O)CCSC1)c1ccc(C)cc1[O-] ZINC000279957424 522625704 /nfs/dbraw/zinc/62/57/04/522625704.db2.gz CDTANZMUWPHWSR-ZFWWWQNUSA-N 0 3 281.421 2.609 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])[C@@H]1CCCO1 ZINC000278605872 522758619 /nfs/dbraw/zinc/75/86/19/522758619.db2.gz BHVDPRZDFAOZNG-NOLJZWGESA-N 0 3 279.380 2.545 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2n[nH]cc2C1)c1ccccc1[O-] ZINC000156735966 522760365 /nfs/dbraw/zinc/76/03/65/522760365.db2.gz JHFOERZXUGXNIK-JSGCOSHPSA-N 0 3 271.364 2.714 20 10 CFCDHN COc1cc([O-])c(C[NH+]2CCC(C)CC2)cc1OC ZINC000158826970 522774529 /nfs/dbraw/zinc/77/45/29/522774529.db2.gz WUINJPFTOUGKHC-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN CC[C@@H]([NH2+]CCN(CC)C1CC1)c1ccccc1[O-] ZINC000155564746 522833439 /nfs/dbraw/zinc/83/34/39/522833439.db2.gz ZIKUITYHYIDLNK-OAHLLOKOSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCc2n[nH]cc2C1)c1ccccc1[O-] ZINC000156736089 522951690 /nfs/dbraw/zinc/95/16/90/522951690.db2.gz JHFOERZXUGXNIK-GXTWGEPZSA-N 0 3 271.364 2.714 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccc1F ZINC000264755186 523384317 /nfs/dbraw/zinc/38/43/17/523384317.db2.gz XRDVGDOBUVWFSL-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccc1F ZINC000264755186 523384328 /nfs/dbraw/zinc/38/43/28/523384328.db2.gz XRDVGDOBUVWFSL-MRXNPFEDSA-N 0 3 275.323 2.697 20 10 CFCDHN COCCOCC[N@H+](C)Cc1c([O-])ccc2ccccc21 ZINC000288666213 523999791 /nfs/dbraw/zinc/99/97/91/523999791.db2.gz RVQUXWGIURPSOW-UHFFFAOYSA-N 0 3 289.375 2.640 20 10 CFCDHN COCCOCC[N@@H+](C)Cc1c([O-])ccc2ccccc21 ZINC000288666213 523999796 /nfs/dbraw/zinc/99/97/96/523999796.db2.gz RVQUXWGIURPSOW-UHFFFAOYSA-N 0 3 289.375 2.640 20 10 CFCDHN CO[C@](C)(C[NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000291357451 524027774 /nfs/dbraw/zinc/02/77/74/524027774.db2.gz XVOKPWVPLDWTFB-MEBBXXQBSA-N 0 3 267.344 2.997 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H](CO)CC(C)C)c1[O-] ZINC000290589343 524380158 /nfs/dbraw/zinc/38/01/58/524380158.db2.gz VETFLALVCBLRRD-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H](CO)CC(C)C)c1[O-] ZINC000290589343 524380171 /nfs/dbraw/zinc/38/01/71/524380171.db2.gz VETFLALVCBLRRD-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000062748262 524477565 /nfs/dbraw/zinc/47/75/65/524477565.db2.gz XNKJHDZPFZZJFF-QWRGUYRKSA-N 0 3 254.349 2.522 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+]Cc2cc(F)ccc2[O-])n1 ZINC000226581913 524524649 /nfs/dbraw/zinc/52/46/49/524524649.db2.gz BUEYQBXNDOMLKA-UHFFFAOYSA-N 0 3 277.343 2.525 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290414408 524742151 /nfs/dbraw/zinc/74/21/51/524742151.db2.gz KGPKHZCOYITCKY-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@]2(C)CCCO)c1 ZINC000290414408 524742158 /nfs/dbraw/zinc/74/21/58/524742158.db2.gz KGPKHZCOYITCKY-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC[C@@H](O)c2ccccc2)c1 ZINC000289389544 524749762 /nfs/dbraw/zinc/74/97/62/524749762.db2.gz DPBCHNCZMFMJBY-QGZVFWFLSA-N 0 3 287.359 2.614 20 10 CFCDHN COc1ccc(O)c(CNCc2ccccc2OC)c1 ZINC000020087236 524751502 /nfs/dbraw/zinc/75/15/02/524751502.db2.gz QZDZHXQJIDAFPF-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN C[C@H](Cc1cccs1)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879910 524753325 /nfs/dbraw/zinc/75/33/25/524753325.db2.gz NGYBDVUMGWLYCI-SNVBAGLBSA-N 0 3 291.372 2.903 20 10 CFCDHN COc1ccc(O)c(CN[C@H](C)c2ccccn2)c1 ZINC000020123954 524755958 /nfs/dbraw/zinc/75/59/58/524755958.db2.gz QBSAGLFGXJXDNK-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCCCC2)c1 ZINC000049574526 524763357 /nfs/dbraw/zinc/76/33/57/524763357.db2.gz RHKCOZUWKOFMRJ-CYBMUJFWSA-N 0 3 278.396 2.537 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)CCCO)c1 ZINC000230666402 524769296 /nfs/dbraw/zinc/76/92/96/524769296.db2.gz PQOAIIGGWOJRNY-LBPRGKRZSA-N 0 3 281.396 2.850 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C2CCN(C3CC3)CC2)c1 ZINC000037140947 524769429 /nfs/dbraw/zinc/76/94/29/524769429.db2.gz XZJMOBOMLWGDJD-LBPRGKRZSA-N 0 3 290.407 2.678 20 10 CFCDHN C[C@H]1[C@@H]([NH+]2CCCC2)CCN1Cc1cc(F)ccc1[O-] ZINC000289753926 525090225 /nfs/dbraw/zinc/09/02/25/525090225.db2.gz JILKAPUBDSBNHK-WFASDCNBSA-N 0 3 278.371 2.590 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H](CO)CC(C)C)cc1C ZINC000290665182 525316368 /nfs/dbraw/zinc/31/63/68/525316368.db2.gz ZYDWLENHIDQAPR-OAHLLOKOSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H](CO)CC(C)C)cc1C ZINC000290665182 525316374 /nfs/dbraw/zinc/31/63/74/525316374.db2.gz ZYDWLENHIDQAPR-OAHLLOKOSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](O)C(C)(C)C2)cc1C ZINC000276027586 525319962 /nfs/dbraw/zinc/31/99/62/525319962.db2.gz RGAUBCVFXRBNRG-HNNXBMFYSA-N 0 3 263.381 2.602 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](O)C(C)(C)C2)cc1C ZINC000276027586 525319968 /nfs/dbraw/zinc/31/99/68/525319968.db2.gz RGAUBCVFXRBNRG-HNNXBMFYSA-N 0 3 263.381 2.602 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)CCCOC(C)C)c1 ZINC000271206576 525340192 /nfs/dbraw/zinc/34/01/92/525340192.db2.gz SBLOMEAZXYLYBM-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)CCCOC(C)C)c1 ZINC000271206576 525340203 /nfs/dbraw/zinc/34/02/03/525340203.db2.gz SBLOMEAZXYLYBM-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280610701 525341370 /nfs/dbraw/zinc/34/13/70/525341370.db2.gz YYDHTOJDXMZBLZ-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280610701 525341380 /nfs/dbraw/zinc/34/13/80/525341380.db2.gz YYDHTOJDXMZBLZ-UKRRQHHQSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCCOCC(C)C)c1 ZINC000071406654 525350682 /nfs/dbraw/zinc/35/06/82/525350682.db2.gz ZYYNWQWKZVEGOS-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)CNC(=O)OC(C)(C)C)c1 ZINC000227684970 525351949 /nfs/dbraw/zinc/35/19/49/525351949.db2.gz YNULHZQRQPGPIO-GFCCVEGCSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)Cn2cccn2)c1 ZINC000037155946 525362457 /nfs/dbraw/zinc/36/24/57/525362457.db2.gz LKRNKIGNYOBQKM-QWHCGFSZSA-N 0 3 259.353 2.636 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCCO1)c1cc(F)ccc1[O-] ZINC000094617933 525412741 /nfs/dbraw/zinc/41/27/41/525412741.db2.gz DKNLKIIHQDKCBT-CMPLNLGQSA-N 0 3 253.317 2.751 20 10 CFCDHN C[C@@H](NCCC[NH+]1CCCC1)c1ccc(F)c(F)c1[O-] ZINC000191188462 525434515 /nfs/dbraw/zinc/43/45/15/525434515.db2.gz QGBPJOBCLWXRMS-LLVKDONJSA-N 0 3 284.350 2.807 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccncc1)c1cc(F)ccc1[O-] ZINC000094617626 525465851 /nfs/dbraw/zinc/46/58/51/525465851.db2.gz KBDJDKCMDZHKNI-LLVKDONJSA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCCN2C)c1ccnn1C ZINC000192780819 525530286 /nfs/dbraw/zinc/53/02/86/525530286.db2.gz JOJVNUKUBSDAKQ-CYBMUJFWSA-N 0 3 284.407 2.653 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000094618166 525626719 /nfs/dbraw/zinc/62/67/19/525626719.db2.gz CGEPSMVBKAWDKT-ABAIWWIYSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000163861060 525660192 /nfs/dbraw/zinc/66/01/92/525660192.db2.gz KZMNWSVTOKCYIP-CHWSQXEVSA-N 0 3 272.396 2.898 20 10 CFCDHN C[C@@H]1[C@H]([NH+]2CCCC2)CCN1Cc1cc(F)ccc1[O-] ZINC000289753918 525703117 /nfs/dbraw/zinc/70/31/17/525703117.db2.gz JILKAPUBDSBNHK-IUODEOHRSA-N 0 3 278.371 2.590 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2([S@](C)=O)CCC2)c([O-])c1 ZINC000280896555 525722116 /nfs/dbraw/zinc/72/21/16/525722116.db2.gz BXOHULOPTSKQLW-BLVKFPJESA-N 0 3 281.421 2.652 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)c([O-])c1 ZINC000293613931 525730683 /nfs/dbraw/zinc/73/06/83/525730683.db2.gz JHNAXOJDXNTMSI-QWHCGFSZSA-N 0 3 250.386 2.549 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cn2ccnc2)c([O-])c1 ZINC000037156853 525744613 /nfs/dbraw/zinc/74/46/13/525744613.db2.gz CRQWZQZPCXHGRH-CHWSQXEVSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](CCO)C(C)C)c([O-])c1 ZINC000230664237 525747198 /nfs/dbraw/zinc/74/71/98/525747198.db2.gz AZDFKRBEYQFPPH-TZMCWYRMSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])o1 ZINC000272901891 525783069 /nfs/dbraw/zinc/78/30/69/525783069.db2.gz VDVSARKEXKHSRP-FZMZJTMJSA-N 0 3 261.321 2.678 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c([O-])c1 ZINC000280896571 525917414 /nfs/dbraw/zinc/91/74/14/525917414.db2.gz BXOHULOPTSKQLW-HXPMCKFVSA-N 0 3 281.421 2.652 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H]2C2CC2)c([O-])c1 ZINC000230669886 525938605 /nfs/dbraw/zinc/93/86/05/525938605.db2.gz ZCLZJXOJGRWCIO-SGIREYDYSA-N 0 3 261.365 2.919 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c([O-])c1 ZINC000168841373 525940437 /nfs/dbraw/zinc/94/04/37/525940437.db2.gz LLZPTMXKARTILD-FTLABTOESA-N 0 3 269.410 2.508 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CCO)C(C)C)c([O-])c1 ZINC000230664240 525942251 /nfs/dbraw/zinc/94/22/51/525942251.db2.gz AZDFKRBEYQFPPH-GXTWGEPZSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2cccc(C)c2[O-])cc1 ZINC000278680899 525975855 /nfs/dbraw/zinc/97/58/55/525975855.db2.gz MBVOSGWAWOQWDN-MRXNPFEDSA-N 0 3 271.360 2.832 20 10 CFCDHN COc1cccc(C[NH2+]CC2(c3ncccc3C)CC2)c1[O-] ZINC000365836696 526013479 /nfs/dbraw/zinc/01/34/79/526013479.db2.gz IZWQBVWELKTLNU-UHFFFAOYSA-N 0 3 298.386 2.926 20 10 CFCDHN COc1cccc(CNCc2ccc3c(n2)CCCC3)c1O ZINC000277795654 526027538 /nfs/dbraw/zinc/02/75/38/526027538.db2.gz WTTVHTDNOOSHTP-UHFFFAOYSA-N 0 3 298.386 2.964 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000278128082 526351902 /nfs/dbraw/zinc/35/19/02/526351902.db2.gz BTKQHTWJWKRQSU-OAHLLOKOSA-N 0 3 278.371 2.638 20 10 CFCDHN Cc1nc(CC[NH2+]Cc2cccc(C)c2[O-])cs1 ZINC000224540731 526826806 /nfs/dbraw/zinc/82/68/06/526826806.db2.gz RPEVOZHBKKFKGY-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCC(=O)OC(C)(C)C ZINC000744450269 574075266 /nfs/dbraw/zinc/07/52/66/574075266.db2.gz QCBMXCZAIDNLSQ-UHFFFAOYSA-N 0 3 295.379 2.612 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCSC[C@H](C)C1 ZINC000754156304 574078505 /nfs/dbraw/zinc/07/85/05/574078505.db2.gz PBRFZJJHLGCTAY-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCSC[C@H](C)C1 ZINC000754156304 574078507 /nfs/dbraw/zinc/07/85/07/574078507.db2.gz PBRFZJJHLGCTAY-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN CC[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H](C)O1 ZINC000732185176 574145061 /nfs/dbraw/zinc/14/50/61/574145061.db2.gz LSAPXOGHYBHKFY-MLGOLLRUSA-N 0 3 275.392 2.880 20 10 CFCDHN Cc1ccc(O)c(CNCC(=O)Nc2cccc(F)c2)c1 ZINC000733327424 574221859 /nfs/dbraw/zinc/22/18/59/574221859.db2.gz QZUOZWIFSPEBDG-UHFFFAOYSA-N 0 3 288.322 2.568 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H](O)c2ccco2)c2c1c(F)ccc2[O-] ZINC000756386727 574232324 /nfs/dbraw/zinc/23/23/24/574232324.db2.gz YTKKRNCRGOIVQM-XWIASGKRSA-N 0 3 291.322 2.996 20 10 CFCDHN CC(C)NC(=O)CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756395179 574233556 /nfs/dbraw/zinc/23/35/56/574233556.db2.gz HREKQDWGPVTKEX-PWSUYJOCSA-N 0 3 294.370 2.584 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c([O-])c1C ZINC000756433013 574236778 /nfs/dbraw/zinc/23/67/78/574236778.db2.gz MGDMNHPEGZSISU-XJKSGUPXSA-N 0 3 276.424 3.000 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000756449964 574237879 /nfs/dbraw/zinc/23/78/79/574237879.db2.gz PTFPWSDRPATPER-KDILMLJESA-N 0 3 293.260 2.592 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2cnn(C)c2)c2c1c(F)ccc2[O-] ZINC000756445260 574237894 /nfs/dbraw/zinc/23/78/94/574237894.db2.gz ZMAWXHZYRSEQOM-GWCFXTLKSA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCCC(=O)N(C)C)c2c1c(F)ccc2[O-] ZINC000756480146 574240242 /nfs/dbraw/zinc/24/02/42/574240242.db2.gz REORXHAIMDWJAG-JQWIXIFHSA-N 0 3 294.370 2.538 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)Cc2cnccn2)c1 ZINC000756496090 574241772 /nfs/dbraw/zinc/24/17/72/574241772.db2.gz UXXNBKHGDHHACS-CHWSQXEVSA-N 0 3 271.364 2.772 20 10 CFCDHN CCc1cc(CN[C@H](C)c2cc(C)ccc2O)n[nH]1 ZINC000756570429 574248779 /nfs/dbraw/zinc/24/87/79/574248779.db2.gz BRYBXTHVEDOJHI-LLVKDONJSA-N 0 3 259.353 2.837 20 10 CFCDHN CCOC[C@H](O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733613630 574249253 /nfs/dbraw/zinc/24/92/53/574249253.db2.gz FAAJOXZBUMTCDC-MRXNPFEDSA-N 0 3 293.407 2.534 20 10 CFCDHN CCOC[C@H](O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000733613630 574249255 /nfs/dbraw/zinc/24/92/55/574249255.db2.gz FAAJOXZBUMTCDC-MRXNPFEDSA-N 0 3 293.407 2.534 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCOC[C@@H]2CCCO2)c1 ZINC000756583889 574250327 /nfs/dbraw/zinc/25/03/27/574250327.db2.gz RKRZBFYQRKGNPE-KBPBESRZSA-N 0 3 279.380 2.547 20 10 CFCDHN CC(C)[C@@H](O)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756584827 574250735 /nfs/dbraw/zinc/25/07/35/574250735.db2.gz GWBBUNAUQYBHPC-XWIASGKRSA-N 0 3 267.344 2.686 20 10 CFCDHN CS[C@H](CO)[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756591249 574251156 /nfs/dbraw/zinc/25/11/56/574251156.db2.gz FUYLCDKIMHZZIB-UPBCOZELSA-N 0 3 299.411 2.782 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756603626 574252065 /nfs/dbraw/zinc/25/20/65/574252065.db2.gz JESAZDZQPOHDHH-JBLDHEPKSA-N 0 3 299.411 2.783 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@H]2C)c1 ZINC000756619766 574252430 /nfs/dbraw/zinc/25/24/30/574252430.db2.gz ZSJMVYYEYMZCFX-OLZOCXBDSA-N 0 3 278.396 2.536 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCNc2ncccn2)c([O-])c1 ZINC000756642699 574254417 /nfs/dbraw/zinc/25/44/17/574254417.db2.gz QXTDRSNUTLNJJM-CYBMUJFWSA-N 0 3 286.379 2.643 20 10 CFCDHN C[C@H](C[C@H]1CCOC1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756645051 574255239 /nfs/dbraw/zinc/25/52/39/574255239.db2.gz DLMKKVKCKOEGAQ-GRYCIOLGSA-N 0 3 267.344 2.997 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CCO)C2CC2)c([O-])c1C ZINC000756738763 574260201 /nfs/dbraw/zinc/26/02/01/574260201.db2.gz KXHNHYRLMDFOFX-WFASDCNBSA-N 0 3 263.381 2.821 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H](CO)CC2CC2)c2c1c(F)ccc2[O-] ZINC000756770481 574261862 /nfs/dbraw/zinc/26/18/62/574261862.db2.gz XTBLTPTZUFGPKW-XWIASGKRSA-N 0 3 279.355 2.830 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NC[C@H](OC)C(F)(F)F)c1 ZINC000756835990 574267004 /nfs/dbraw/zinc/26/70/04/574267004.db2.gz RMWSBZFLYYJNFJ-PELKAZGASA-N 0 3 293.285 2.629 20 10 CFCDHN CCSCCN(C)Cc1ccc(N(C)C)cc1 ZINC000741807416 574304788 /nfs/dbraw/zinc/30/47/88/574304788.db2.gz ZEKJDHVWLUYYGQ-UHFFFAOYSA-N 0 3 252.427 2.938 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](CO)CC(C)C)cc1C ZINC000742367765 574324328 /nfs/dbraw/zinc/32/43/28/574324328.db2.gz IKPDWNABRJOIHD-CQSZACIVSA-N 0 3 251.370 2.506 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCOC(C)(C)C)c1 ZINC000725850254 574331244 /nfs/dbraw/zinc/33/12/44/574331244.db2.gz UWPYCGILXKGENN-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN c1ccc2c(c1)CCN2CCNCc1ccc2c(c1)CCO2 ZINC000742710661 574340951 /nfs/dbraw/zinc/34/09/51/574340951.db2.gz MLCRZQDTCFKXOT-UHFFFAOYSA-N 0 3 294.398 2.774 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](CC)C[C@H](C)CO)c1[O-] ZINC000743499989 574366852 /nfs/dbraw/zinc/36/68/52/574366852.db2.gz SJTJOJNRSVRDSG-GXTWGEPZSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](CC)C[C@H](C)CO)c1[O-] ZINC000743499990 574367489 /nfs/dbraw/zinc/36/74/89/574367489.db2.gz SJTJOJNRSVRDSG-JSGCOSHPSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2C[C@H](OC)C2(C)C)c1 ZINC000753374223 574401878 /nfs/dbraw/zinc/40/18/78/574401878.db2.gz QVFHWFGPFSLMEB-GJZGRUSLSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1cc(O)c(CN2C[C@H](C)S[C@@H](C)C2)cc1OC ZINC000160301357 617964694 /nfs/dbraw/zinc/96/46/94/617964694.db2.gz DOWFYRMGQBGPCF-QWRGUYRKSA-N 0 3 297.420 2.735 20 10 CFCDHN COc1ccc(C[N@H+](C)CCC2CC2)c([O-])c1OC ZINC000892234296 618017878 /nfs/dbraw/zinc/01/78/78/618017878.db2.gz CORRAYJFEGOLAQ-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN COc1ccc(C[N@@H+](C)CCC2CC2)c([O-])c1OC ZINC000892234296 618017883 /nfs/dbraw/zinc/01/78/83/618017883.db2.gz CORRAYJFEGOLAQ-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCN2CCCCC2)c([O-])c1 ZINC000049574618 618058306 /nfs/dbraw/zinc/05/83/06/618058306.db2.gz NMRHJIOBYVMHBX-CQSZACIVSA-N 0 3 262.397 2.837 20 10 CFCDHN CCCC[N@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891450118 618215846 /nfs/dbraw/zinc/21/58/46/618215846.db2.gz IWYPWHNESUGJLS-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCCC[N@@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000891450118 618215847 /nfs/dbraw/zinc/21/58/47/618215847.db2.gz IWYPWHNESUGJLS-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)S(C)(=O)=O)c([O-])c1 ZINC000840877008 618223880 /nfs/dbraw/zinc/22/38/80/618223880.db2.gz RBFIOCIZZOJYTM-GFCCVEGCSA-N 0 3 299.436 2.565 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H]2C)c1[O-] ZINC000310286532 618276733 /nfs/dbraw/zinc/27/67/33/618276733.db2.gz MKPJLQRBLRQSFW-LDYMZIIASA-N 0 3 255.745 2.942 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(F)cc(F)c1[O-] ZINC000894087559 618317315 /nfs/dbraw/zinc/31/73/15/618317315.db2.gz CXZSIMSOPXXAOQ-KGLIPLIRSA-N 0 3 296.361 2.729 20 10 CFCDHN CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)cc(F)c1[O-] ZINC000894087559 618317320 /nfs/dbraw/zinc/31/73/20/618317320.db2.gz CXZSIMSOPXXAOQ-KGLIPLIRSA-N 0 3 296.361 2.729 20 10 CFCDHN CN(C)c1ccc(CNCc2cn3ccnc3s2)cc1 ZINC000892476560 618338324 /nfs/dbraw/zinc/33/83/24/618338324.db2.gz VWXLMLOMPNWGIA-UHFFFAOYSA-N 0 3 286.404 2.752 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1F ZINC000249530162 618366693 /nfs/dbraw/zinc/36/66/93/618366693.db2.gz AUFMJQIVANLKLK-GUYCJALGSA-N 0 3 294.414 2.875 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)c1ccccc1[O-] ZINC000311420851 618711128 /nfs/dbraw/zinc/71/11/28/618711128.db2.gz NWPOPCGZSNXQSA-NFAWXSAZSA-N 0 3 263.381 2.984 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@@H](C)C(=O)NC(C)C)cc1 ZINC000840890279 618724423 /nfs/dbraw/zinc/72/44/23/618724423.db2.gz LYXBAMVYODRXOQ-KGLIPLIRSA-N 0 3 291.439 2.706 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC1(CO)CCCC1)CC2 ZINC000312109287 618876254 /nfs/dbraw/zinc/87/62/54/618876254.db2.gz YFQHNHRHXSULKA-CYBMUJFWSA-N 0 3 261.365 2.522 20 10 CFCDHN C[C@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+]Cc1ccccc1[O-] ZINC000309915874 618890585 /nfs/dbraw/zinc/89/05/85/618890585.db2.gz UHWLVPCUPLNVLB-RYUDHWBXSA-N 0 3 294.395 2.784 20 10 CFCDHN CC[C@H]([NH2+]CCc1nnc2ccccn21)c1ccccc1[O-] ZINC000314034797 619045153 /nfs/dbraw/zinc/04/51/53/619045153.db2.gz AQFJKMVUQOZSGR-AWEZNQCLSA-N 0 3 296.374 2.718 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1Cc3ccccc3O1)CC2 ZINC000314577981 619085281 /nfs/dbraw/zinc/08/52/81/619085281.db2.gz RIHHFIIQKGHENG-LSDHHAIUSA-N 0 3 281.355 2.973 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)C(C)C)c1ccccc1[O-] ZINC000054110805 619136503 /nfs/dbraw/zinc/13/65/03/619136503.db2.gz NLKBOYVDSLNHIA-CQSZACIVSA-N 0 3 250.386 2.773 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(C(F)(F)F)CCCN1)c1ccccc1[O-] ZINC000925851640 619183107 /nfs/dbraw/zinc/18/31/07/619183107.db2.gz BWUQFBABRWBZOP-GXFFZTMASA-N 0 3 288.313 2.727 20 10 CFCDHN Cc1nc([C@@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000894776464 619461772 /nfs/dbraw/zinc/46/17/72/619461772.db2.gz DSNIODGQGQQYSN-FOQNGQEVSA-N 0 3 285.395 2.543 20 10 CFCDHN CCn1cc([C@@H](C)NCc2cc(C)cc(OC)c2O)cn1 ZINC000894919642 619512692 /nfs/dbraw/zinc/51/26/92/619512692.db2.gz SNGHSTTZFKFVTB-GFCCVEGCSA-N 0 3 289.379 2.776 20 10 CFCDHN CO[C@@]1(C(F)(F)F)CCN(Cc2cccc(C)c2O)C1 ZINC000895578242 619559944 /nfs/dbraw/zinc/55/99/44/619559944.db2.gz XGBTUIDCSBNEKO-ZDUSSCGKSA-N 0 3 289.297 2.854 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895584492 619560982 /nfs/dbraw/zinc/56/09/82/619560982.db2.gz QSZNKYGQQYCBFL-LBPRGKRZSA-N 0 3 260.362 2.838 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895584492 619560985 /nfs/dbraw/zinc/56/09/85/619560985.db2.gz QSZNKYGQQYCBFL-LBPRGKRZSA-N 0 3 260.362 2.838 20 10 CFCDHN CCOc1ccc(CNCc2cc(C)ccc2O)o1 ZINC000895580130 619562742 /nfs/dbraw/zinc/56/27/42/619562742.db2.gz GPCUFWXKWAUOEF-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN CC(C)([NH2+]Cc1ccccc1[O-])[C@@H](O)c1ccccc1 ZINC000895658129 619577170 /nfs/dbraw/zinc/57/71/70/619577170.db2.gz HLLNQAVZIFXVDS-INIZCTEOSA-N 0 3 271.360 2.994 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)cc1[O-])[C@H]1CCCOC1 ZINC000895662298 619578585 /nfs/dbraw/zinc/57/85/85/619578585.db2.gz DIFDWGTYAUQVDI-GJZGRUSLSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)Cc1ccccc1F ZINC000895749385 619595221 /nfs/dbraw/zinc/59/52/21/619595221.db2.gz NYAWIMXKDATUMP-AWEZNQCLSA-N 0 3 289.350 2.533 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895847804 619621790 /nfs/dbraw/zinc/62/17/90/619621790.db2.gz VUBPYPNSZPTXRS-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c([O-])c1 ZINC000895847804 619621791 /nfs/dbraw/zinc/62/17/91/619621791.db2.gz VUBPYPNSZPTXRS-WMLDXEAASA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cc2c(cc1O)CCN(Cc1cccc(C)c1O)C2 ZINC000895888074 619627933 /nfs/dbraw/zinc/62/79/33/619627933.db2.gz HJEBZLSXSZDVKY-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cccc2c1OCCO2 ZINC000897209770 619950870 /nfs/dbraw/zinc/95/08/70/619950870.db2.gz JQCZGVMGSIAXEG-UHFFFAOYSA-N 0 3 299.370 2.804 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC(C)(C)OC)c1[O-] ZINC000169090777 620073482 /nfs/dbraw/zinc/07/34/82/620073482.db2.gz HSNOGIMXKBGUMG-UHFFFAOYSA-N 0 3 273.760 2.569 20 10 CFCDHN COC(=O)C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)(C)C ZINC000897889234 620298853 /nfs/dbraw/zinc/29/88/53/620298853.db2.gz OQSLWBSPIVVYLO-CYBMUJFWSA-N 0 3 283.343 2.599 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCOC12CCCC2 ZINC000898112858 620336006 /nfs/dbraw/zinc/33/60/06/620336006.db2.gz XBIKUSKRPRFTPT-CQSZACIVSA-N 0 3 265.328 2.723 20 10 CFCDHN CCC1([NH+]2CCC2)CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000899562149 620581310 /nfs/dbraw/zinc/58/13/10/620581310.db2.gz PEFGLIGKBLRQSL-UHFFFAOYSA-N 0 3 294.420 2.544 20 10 CFCDHN C[C@@H]1CC2(CC([NH2+][C@@H]3CCc4cccc([O-])c43)C2)CO1 ZINC000903277888 621311003 /nfs/dbraw/zinc/31/10/03/621311003.db2.gz ANNDIFUNJDFIBW-KTYIZKFGSA-N 0 3 273.376 2.927 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@H]2C)c2c1c(F)ccc2[O-] ZINC000903301579 621315659 /nfs/dbraw/zinc/31/56/59/621315659.db2.gz SBFDROLFZXWHSR-DNIRFERGSA-N 0 3 278.371 2.762 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)[C@@H]2C)c2c1c(F)ccc2[O-] ZINC000903301581 621315763 /nfs/dbraw/zinc/31/57/63/621315763.db2.gz SBFDROLFZXWHSR-WFFHOREQSA-N 0 3 278.371 2.762 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC(C)(C)C1)c1ccccc1[O-] ZINC000903344928 621336942 /nfs/dbraw/zinc/33/69/42/621336942.db2.gz RWDIIXPLPRHQKU-ZDUSSCGKSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](O)C1CC1)c1ccc(C)cc1[O-] ZINC000903408528 621363841 /nfs/dbraw/zinc/36/38/41/621363841.db2.gz SBLFYSUKJOEKDR-GJZGRUSLSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@](O)(CNCc1ccc(N(C)C)cc1)C(F)(F)F ZINC000905028981 621689339 /nfs/dbraw/zinc/68/93/39/621689339.db2.gz VNKVBKSZRNIYHN-CYBMUJFWSA-N 0 3 290.329 2.546 20 10 CFCDHN Cn1nccc1[C@H]1CCCN1Cc1cc2c(cc1O)CCC2 ZINC000905740578 621842107 /nfs/dbraw/zinc/84/21/07/621842107.db2.gz KVVAXKWDYOQYDK-QGZVFWFLSA-N 0 3 297.402 2.952 20 10 CFCDHN Nc1ccc(NC(=O)[C@@H](N)C2CCCCCC2)cc1 ZINC000911659886 622531862 /nfs/dbraw/zinc/53/18/62/622531862.db2.gz GQRHGMHCCQVTFK-AWEZNQCLSA-N 0 3 261.369 2.505 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000045691070 623012876 /nfs/dbraw/zinc/01/28/76/623012876.db2.gz LSBLTJCQVIXVFD-QWHCGFSZSA-N 0 3 250.386 2.773 20 10 CFCDHN CN(C)C1(C[NH2+]Cc2cc(F)ccc2[O-])CCCCC1 ZINC000226581939 623083846 /nfs/dbraw/zinc/08/38/46/623083846.db2.gz NMHIQCZTPRUMAJ-UHFFFAOYSA-N 0 3 280.387 2.885 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1cccs1 ZINC000226582669 623084158 /nfs/dbraw/zinc/08/41/58/623084158.db2.gz XZZRSMQIBAXWKK-UHFFFAOYSA-N 0 3 251.326 2.925 20 10 CFCDHN CC[C@@H]([NH2+]CC1CCC(O)CC1)c1ccccc1[O-] ZINC000227656498 623116198 /nfs/dbraw/zinc/11/61/98/623116198.db2.gz PPDIKMFWPZSSLH-SSDMNJCBSA-N 0 3 263.381 2.984 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@](C)(O)c1ccccc1 ZINC000822517154 623120014 /nfs/dbraw/zinc/12/00/14/623120014.db2.gz UMHCMJXPPPXFDV-KRWDZBQOSA-N 0 3 289.350 2.871 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@](C)(O)c1ccccc1 ZINC000822517154 623120016 /nfs/dbraw/zinc/12/00/16/623120016.db2.gz UMHCMJXPPPXFDV-KRWDZBQOSA-N 0 3 289.350 2.871 20 10 CFCDHN CC(C)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000228969998 623171680 /nfs/dbraw/zinc/17/16/80/623171680.db2.gz JFHLVDPOUUKUAY-KBPBESRZSA-N 0 3 291.439 2.564 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)CC(C)C)c([O-])c1 ZINC000230660076 623291911 /nfs/dbraw/zinc/29/19/11/623291911.db2.gz YQVRPUDKNGQIJC-QWHCGFSZSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](O)C2)c([O-])c1 ZINC000230663693 623291980 /nfs/dbraw/zinc/29/19/80/623291980.db2.gz VUTAMCDKJDXSRX-BFHYXJOUSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCC1CCOCC1 ZINC000824477205 623511456 /nfs/dbraw/zinc/51/14/56/623511456.db2.gz JXWIYODKDWMRLC-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@H](CO)C2)c1[O-] ZINC000312448488 623519338 /nfs/dbraw/zinc/51/93/38/623519338.db2.gz OCFNUMHJUYHRME-GXFFZTMASA-N 0 3 299.798 2.695 20 10 CFCDHN Cc1cc(O)c(CNCc2n[nH]c(C(C)C)n2)cc1C ZINC000824603358 623531424 /nfs/dbraw/zinc/53/14/24/623531424.db2.gz QFAAQRRERRAORJ-UHFFFAOYSA-N 0 3 274.368 2.540 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824714420 623550158 /nfs/dbraw/zinc/55/01/58/623550158.db2.gz DUNMJVKXWUJNKG-LZWOXQAQSA-N 0 3 261.365 2.518 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000824714420 623550162 /nfs/dbraw/zinc/55/01/62/623550162.db2.gz DUNMJVKXWUJNKG-LZWOXQAQSA-N 0 3 261.365 2.518 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000824799321 623567184 /nfs/dbraw/zinc/56/71/84/623567184.db2.gz MOGJRLOPMSKBGU-CXAGYDPISA-N 0 3 293.407 2.942 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]3CCC[NH2+][C@@H]3C2)cc1Cl ZINC000824823911 623573047 /nfs/dbraw/zinc/57/30/47/623573047.db2.gz GAHBRMGRZNJDSO-SMDDNHRTSA-N 0 3 280.799 2.538 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000825035855 623612706 /nfs/dbraw/zinc/61/27/06/623612706.db2.gz SQAGQELMVMLRAQ-RISCZKNCSA-N 0 3 283.799 2.995 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOCC12CCCCC2 ZINC000825098133 623628446 /nfs/dbraw/zinc/62/84/46/623628446.db2.gz ANPUQTLCONLBJD-UHFFFAOYSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOCC12CCCCC2 ZINC000825098133 623628452 /nfs/dbraw/zinc/62/84/52/623628452.db2.gz ANPUQTLCONLBJD-UHFFFAOYSA-N 0 3 261.365 2.927 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)[C@@H](OC)C2CC2)c([O-])c1 ZINC000825099067 623630102 /nfs/dbraw/zinc/63/01/02/623630102.db2.gz TZWNCKVOSUGMDO-BDJLRTHQSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@H]1C[C@@H](OC)C12CCC2 ZINC000825104382 623631253 /nfs/dbraw/zinc/63/12/53/623631253.db2.gz VTDMUJJAYGFZGT-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@H]1C[C@@H](OC)C12CCC2 ZINC000825104382 623631258 /nfs/dbraw/zinc/63/12/58/623631258.db2.gz VTDMUJJAYGFZGT-JKSUJKDBSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc(C[NH2+]C2CC(CF)(CF)C2)c([O-])c1 ZINC000825753297 623750997 /nfs/dbraw/zinc/75/09/97/623750997.db2.gz OWBCHYCYUOGBFW-UHFFFAOYSA-N 0 3 271.307 2.578 20 10 CFCDHN Cc1cccc(CNCc2cnc(C(F)(F)F)nc2)c1O ZINC000826839302 623888319 /nfs/dbraw/zinc/88/83/19/623888319.db2.gz PWHNRLNVMNTZCZ-UHFFFAOYSA-N 0 3 297.280 2.799 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2C[C@@H](O)c3ccccc32)c1 ZINC000827179362 623960409 /nfs/dbraw/zinc/96/04/09/623960409.db2.gz VUZLVUKDEYNCNV-NVXWUHKLSA-N 0 3 285.343 2.669 20 10 CFCDHN CCCN1CC[C@@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000827519411 624021658 /nfs/dbraw/zinc/02/16/58/624021658.db2.gz MMCXVAXZEWLKNM-CQSZACIVSA-N 0 3 282.815 2.928 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2CCC(O)CC2)c1[O-] ZINC000827515733 624022290 /nfs/dbraw/zinc/02/22/90/624022290.db2.gz PBLXYFZUVNJETJ-UHFFFAOYSA-N 0 3 283.799 2.995 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827698925 624069029 /nfs/dbraw/zinc/06/90/29/624069029.db2.gz CXWAQPNGZCYDAT-MEBBXXQBSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827698925 624069035 /nfs/dbraw/zinc/06/90/35/624069035.db2.gz CXWAQPNGZCYDAT-MEBBXXQBSA-N 0 3 299.798 2.505 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@H]1[NH2+]Cc1ccccc1[O-] ZINC000827751362 624084910 /nfs/dbraw/zinc/08/49/10/624084910.db2.gz TZDXWKNUXFCXTA-GDBMZVCRSA-N 0 3 277.364 2.604 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@@H]1[NH2+]Cc1ccccc1[O-] ZINC000827751364 624085274 /nfs/dbraw/zinc/08/52/74/624085274.db2.gz TZDXWKNUXFCXTA-HOCLYGCPSA-N 0 3 277.364 2.604 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](O)c1ccccc1F)CC2 ZINC000834526741 625701994 /nfs/dbraw/zinc/70/19/94/625701994.db2.gz OLEWNFIDTRCDLX-GDBMZVCRSA-N 0 3 287.334 2.842 20 10 CFCDHN Cc1ncc2c(n1)CC[C@H]([NH2+][C@H]1CCc3cccc([O-])c31)C2 ZINC000834508477 625699668 /nfs/dbraw/zinc/69/96/68/625699668.db2.gz MUTLNENHEAZSIZ-HOCLYGCPSA-N 0 3 295.386 2.625 20 10 CFCDHN CCCC[N@H+](CC[C@@H](C)O)Cc1ccccc1[O-] ZINC000829516003 624450534 /nfs/dbraw/zinc/45/05/34/624450534.db2.gz MCCXVIUBTLQTHW-CYBMUJFWSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@@H+](CC[C@@H](C)O)Cc1ccccc1[O-] ZINC000829516003 624450537 /nfs/dbraw/zinc/45/05/37/624450537.db2.gz MCCXVIUBTLQTHW-CYBMUJFWSA-N 0 3 251.370 2.765 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])C(=O)Nc1ccccc1 ZINC000112100231 624653998 /nfs/dbraw/zinc/65/39/98/624653998.db2.gz CFKYECOVXBMEMS-GFCCVEGCSA-N 0 3 270.332 2.509 20 10 CFCDHN CSC[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000180219535 625004704 /nfs/dbraw/zinc/00/47/04/625004704.db2.gz GFWOIOZIJZVBEK-GFCCVEGCSA-N 0 3 255.358 2.859 20 10 CFCDHN CSC[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000180219535 625004706 /nfs/dbraw/zinc/00/47/06/625004706.db2.gz GFWOIOZIJZVBEK-GFCCVEGCSA-N 0 3 255.358 2.859 20 10 CFCDHN Cc1n[nH]cc1[C@@H](C)NCc1ccc2c(c1)CCCN2C ZINC000180331469 625016921 /nfs/dbraw/zinc/01/69/21/625016921.db2.gz ZGLQUBVONFKVJC-GFCCVEGCSA-N 0 3 284.407 2.951 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834581854 625724292 /nfs/dbraw/zinc/72/42/92/625724292.db2.gz NXCSOXBKJONUIR-GHJWDPDVSA-N 0 3 263.381 2.766 20 10 CFCDHN CCCCN(C)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834582262 625726326 /nfs/dbraw/zinc/72/63/26/625726326.db2.gz YONHZUQBZZFGTM-CQSZACIVSA-N 0 3 262.397 2.701 20 10 CFCDHN Oc1cccc2c1[C@H](NCc1ccc(F)cn1)CC2 ZINC000834625030 625740607 /nfs/dbraw/zinc/74/06/07/625740607.db2.gz SIXNDBQPKQFNKL-CYBMUJFWSA-N 0 3 258.296 2.703 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@@H]2CCc3cccc([O-])c32)n1 ZINC000834675194 625777108 /nfs/dbraw/zinc/77/71/08/625777108.db2.gz DFZYWRYFCFEPTP-CQSZACIVSA-N 0 3 283.375 2.785 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccc(CO)cc1)CC2 ZINC000834702372 625791750 /nfs/dbraw/zinc/79/17/50/625791750.db2.gz OADNXEIJHMXFEB-MRXNPFEDSA-N 0 3 283.371 2.704 20 10 CFCDHN COCC(COC)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834890054 625911657 /nfs/dbraw/zinc/91/16/57/625911657.db2.gz IGYDMGMHZWTCRN-SNVBAGLBSA-N 0 3 287.787 2.666 20 10 CFCDHN CCc1ncc(CN[C@@H]2CCc3cccc(O)c32)o1 ZINC000834900874 625915542 /nfs/dbraw/zinc/91/55/42/625915542.db2.gz SUCFQXIWTYFKNI-GFCCVEGCSA-N 0 3 258.321 2.720 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-])C(=O)NC ZINC000834913885 625920978 /nfs/dbraw/zinc/92/09/78/625920978.db2.gz QKNFAEDBAPCEBN-SKDRFNHKSA-N 0 3 284.787 2.529 20 10 CFCDHN CC[C@H]([NH2+]CCc1cn(C)cn1)c1ccc(C)cc1[O-] ZINC000840766295 625921723 /nfs/dbraw/zinc/92/17/23/625921723.db2.gz LVZLVSCDARFTDC-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)N)c1ccc(Br)cc1[O-] ZINC000817960980 625964697 /nfs/dbraw/zinc/96/46/97/625964697.db2.gz VLBYKLKHUSLJJX-QMMMGPOBSA-N 0 3 287.201 2.543 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@](C)(O)C(C)C)c1ccccc1[O-] ZINC000186189224 626011904 /nfs/dbraw/zinc/01/19/04/626011904.db2.gz CUJHOACGYZHJQP-UKRRQHHQSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H](NCc1cnn(CCF)c1)c1ccc(N(C)C)cc1 ZINC000922014417 626196276 /nfs/dbraw/zinc/19/62/76/626196276.db2.gz HIEXRGDVJAAGCP-ZDUSSCGKSA-N 0 3 290.386 2.769 20 10 CFCDHN FC1(F)CC(NCc2ccc3c(c2)CCCO3)C1 ZINC000922058959 626202478 /nfs/dbraw/zinc/20/24/78/626202478.db2.gz DBGWGOQJKXHAPC-UHFFFAOYSA-N 0 3 253.292 2.899 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCCN1CC(F)(F)F ZINC000922707677 626347868 /nfs/dbraw/zinc/34/78/68/626347868.db2.gz FHXJWKMOHAUNAG-GFCCVEGCSA-N 0 3 288.313 2.509 20 10 CFCDHN Oc1ccccc1CNCc1ccc2c(n1)CCC2 ZINC000838921392 626513961 /nfs/dbraw/zinc/51/39/61/626513961.db2.gz AAUHSAQIUNFDRW-UHFFFAOYSA-N 0 3 254.333 2.566 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH+]1CC(CCO)C1 ZINC000839141552 626528573 /nfs/dbraw/zinc/52/85/73/626528573.db2.gz ZHWIPDUFUFYISE-UHFFFAOYSA-N 0 3 283.371 2.873 20 10 CFCDHN CCCN(Cc1ccccc1O)[C@@H](C)c1n[nH]c(C)n1 ZINC000839498374 626538256 /nfs/dbraw/zinc/53/82/56/626538256.db2.gz IWZINLSFRPXOLA-NSHDSACASA-N 0 3 274.368 2.792 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc2c(c1)C(=O)NCC2)c1ccccc1[O-] ZINC000757660521 626557438 /nfs/dbraw/zinc/55/74/38/626557438.db2.gz FNJVIAMFAWXLSX-LBPRGKRZSA-N 0 3 296.370 2.529 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000760897097 626783087 /nfs/dbraw/zinc/78/30/87/626783087.db2.gz PDCYUBVVQRJOKW-MFKMUULPSA-N 0 3 289.354 2.645 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000762619916 626926520 /nfs/dbraw/zinc/92/65/20/626926520.db2.gz XVOMRGKHHNGNIC-KWCYVHTRSA-N 0 3 281.446 2.861 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CCO)C2CCOCC2)c1 ZINC000763559872 626998169 /nfs/dbraw/zinc/99/81/69/626998169.db2.gz XQDOPVYXTSMLQI-BBRMVZONSA-N 0 3 293.407 2.529 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCN1CCCC(C)(C)C1 ZINC000767740347 627281648 /nfs/dbraw/zinc/28/16/48/627281648.db2.gz VNVXHTOGRYEFEM-UHFFFAOYSA-N 0 3 292.423 2.612 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000767926194 627295591 /nfs/dbraw/zinc/29/55/91/627295591.db2.gz CDEPZATYGJLSCJ-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN CC(C)CC[N@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC1 ZINC000768441469 627342771 /nfs/dbraw/zinc/34/27/71/627342771.db2.gz LUJWWTHDXFJZPU-MRXNPFEDSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)CC[N@@H+](Cc1cc2c(cc1[O-])OC[C@H]2O)C1CC1 ZINC000768441469 627342776 /nfs/dbraw/zinc/34/27/76/627342776.db2.gz LUJWWTHDXFJZPU-MRXNPFEDSA-N 0 3 291.391 2.829 20 10 CFCDHN C[C@@H]1CCCCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768445078 627342829 /nfs/dbraw/zinc/34/28/29/627342829.db2.gz FDEUGNHNTGETGL-IAQYHMDHSA-N 0 3 277.364 2.583 20 10 CFCDHN C[C@@H]1CCCCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768445078 627342832 /nfs/dbraw/zinc/34/28/32/627342832.db2.gz FDEUGNHNTGETGL-IAQYHMDHSA-N 0 3 277.364 2.583 20 10 CFCDHN CCC1(CC)CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464143 627344975 /nfs/dbraw/zinc/34/49/75/627344975.db2.gz NQQSYXXPYIPIIY-OAHLLOKOSA-N 0 3 291.391 2.830 20 10 CFCDHN CCC1(CC)CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768464143 627344979 /nfs/dbraw/zinc/34/49/79/627344979.db2.gz NQQSYXXPYIPIIY-OAHLLOKOSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000768903532 627385855 /nfs/dbraw/zinc/38/58/55/627385855.db2.gz NPZJPPHLSKNFOK-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000768903532 627385861 /nfs/dbraw/zinc/38/58/61/627385861.db2.gz NPZJPPHLSKNFOK-GFCCVEGCSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000769005196 627394657 /nfs/dbraw/zinc/39/46/57/627394657.db2.gz YPXSEHBXJYMRFL-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000769513825 627449921 /nfs/dbraw/zinc/44/99/21/627449921.db2.gz FOEGLJWHBVPBIR-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([O-])c1 ZINC000769513825 627449923 /nfs/dbraw/zinc/44/99/23/627449923.db2.gz FOEGLJWHBVPBIR-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000769534638 627453149 /nfs/dbraw/zinc/45/31/49/627453149.db2.gz XJPVQFPAXAFBKZ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2ccc(OCC)cc2[O-])C1 ZINC000769534638 627453151 /nfs/dbraw/zinc/45/31/51/627453151.db2.gz XJPVQFPAXAFBKZ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1ccsc1)c1cc(F)ccc1[O-] ZINC000769990586 627494759 /nfs/dbraw/zinc/49/47/59/627494759.db2.gz UVXCBACOIREFKL-ZANVPECISA-N 0 3 281.352 2.977 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@@H]32)c([O-])c1 ZINC000770285897 627511839 /nfs/dbraw/zinc/51/18/39/627511839.db2.gz LHIIRKAIWIHXNS-ZBFHGGJFSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c([O-])c1 ZINC000770285897 627511840 /nfs/dbraw/zinc/51/18/40/627511840.db2.gz LHIIRKAIWIHXNS-ZBFHGGJFSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+](CCO)C2CCCCC2)c([O-])c1 ZINC000771933568 627650776 /nfs/dbraw/zinc/65/07/76/627650776.db2.gz NMKIGAPKADFJAI-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCO)C2CCCCC2)c([O-])c1 ZINC000771933568 627650779 /nfs/dbraw/zinc/65/07/79/627650779.db2.gz NMKIGAPKADFJAI-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCC(C)(C)O)c2c1c(F)ccc2[O-] ZINC000775585537 628042790 /nfs/dbraw/zinc/04/27/90/628042790.db2.gz GVIXTHXXKOWNFP-KOLCDFICSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCN(C)[C@@H](C)C2)c1[O-] ZINC000776222279 628118856 /nfs/dbraw/zinc/11/88/56/628118856.db2.gz AZGDVNDMGPWITA-FZMZJTMJSA-N 0 3 282.815 2.926 20 10 CFCDHN COc1ccc(CNCc2cc(OC)ccc2O)c(F)c1 ZINC000776247260 628121329 /nfs/dbraw/zinc/12/13/29/628121329.db2.gz BTQCWKPAFNZLCB-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CC(C)[C@H]1CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000777968619 628269144 /nfs/dbraw/zinc/26/91/44/628269144.db2.gz NCNPIHPKSKSYHM-QGZVFWFLSA-N 0 3 275.392 2.738 20 10 CFCDHN Cc1n[nH]cc1[C@H](C)NCc1ccc2c(c1)CCO2 ZINC000779045194 628348546 /nfs/dbraw/zinc/34/85/46/628348546.db2.gz LMHVYGNZJSSSGS-JTQLQIEISA-N 0 3 257.337 2.504 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](CCO)c1ccccc1 ZINC000779089316 628351438 /nfs/dbraw/zinc/35/14/38/628351438.db2.gz XLPZJAHYVKUOMB-OAHLLOKOSA-N 0 3 275.323 2.745 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H](CO)c1ccccc1 ZINC000779349040 628375954 /nfs/dbraw/zinc/37/59/54/628375954.db2.gz UXYHGPXUVUSIOE-SFHVURJKSA-N 0 3 284.403 2.884 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(C)(OC)CC2)c([O-])c1 ZINC000779598523 628389499 /nfs/dbraw/zinc/38/94/99/628389499.db2.gz KXZBTIDTUHJYGA-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000780499806 628469748 /nfs/dbraw/zinc/46/97/48/628469748.db2.gz UAMRXMFPMYJHPM-LRDDRELGSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000780499806 628469749 /nfs/dbraw/zinc/46/97/49/628469749.db2.gz UAMRXMFPMYJHPM-LRDDRELGSA-N 0 3 291.391 2.686 20 10 CFCDHN COC(=O)c1cccc(CNCc2ccc(N(C)C)cc2)c1 ZINC000781054587 628515493 /nfs/dbraw/zinc/51/54/93/628515493.db2.gz IATCCMWYKAWTRJ-UHFFFAOYSA-N 0 3 298.386 2.829 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000783510497 628714611 /nfs/dbraw/zinc/71/46/11/628714611.db2.gz PFKXPCACSZSPJU-ZOWXZIJZSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@H](C)[C@H](C)O1 ZINC000783546830 628719389 /nfs/dbraw/zinc/71/93/89/628719389.db2.gz UFXZCNXGMDFKQV-UPJWGTAASA-N 0 3 275.392 2.879 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CCO[C@H](C)C1 ZINC000784645917 628833555 /nfs/dbraw/zinc/83/35/55/628833555.db2.gz CUEBZWCDPIVDND-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](OC)C2)c([O-])c1 ZINC000784667110 628835516 /nfs/dbraw/zinc/83/55/16/628835516.db2.gz DYKLUDVNNDITOZ-LRDDRELGSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)[C@@H](OC)C2)c([O-])c1 ZINC000784667110 628835517 /nfs/dbraw/zinc/83/55/17/628835517.db2.gz DYKLUDVNNDITOZ-LRDDRELGSA-N 0 3 279.380 2.648 20 10 CFCDHN CO[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000785572419 628894385 /nfs/dbraw/zinc/89/43/85/628894385.db2.gz GSCGOLGKEAYBQM-FXPVBKGRSA-N 0 3 253.317 2.704 20 10 CFCDHN CCOC(CC[NH2+][C@@H](C)c1cc(F)ccc1[O-])OCC ZINC000786969902 628986897 /nfs/dbraw/zinc/98/68/97/628986897.db2.gz GZANJJKCGOAVCK-NSHDSACASA-N 0 3 285.359 2.971 20 10 CFCDHN CC[C@@H](CCO)[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000788604049 629085568 /nfs/dbraw/zinc/08/55/68/629085568.db2.gz TUBVDQZNQGNPHR-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CCN(C3CCC3)CC2)cc1 ZINC000835027372 629324213 /nfs/dbraw/zinc/32/42/13/629324213.db2.gz FEDVLNTYPKISBB-SNAWJCMRSA-N 0 3 299.462 2.936 20 10 CFCDHN C[C@H](NC/C=C/c1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000835041610 629335712 /nfs/dbraw/zinc/33/57/12/629335712.db2.gz YFOUTMMBBTVLGL-GJBLVYBDSA-N 0 3 284.407 2.850 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CC[C@H](O)C(C)(C)C2)cc1 ZINC000835046119 629343786 /nfs/dbraw/zinc/34/37/86/629343786.db2.gz STVWTBHUSALPSK-OSJSJHBBSA-N 0 3 288.435 2.859 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCC1CC(F)(F)C1 ZINC000835059582 629362481 /nfs/dbraw/zinc/36/24/81/629362481.db2.gz CGSIELXTYUYMAP-UHFFFAOYSA-N 0 3 271.307 2.926 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C(C)(C)CN(C)C)c1[O-] ZINC000835068649 629369462 /nfs/dbraw/zinc/36/94/62/629369462.db2.gz HHQVUYIYGUUBFX-UHFFFAOYSA-N 0 3 270.804 2.784 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC000793250059 629514448 /nfs/dbraw/zinc/51/44/48/629514448.db2.gz JDXFNCPUEBLIDZ-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@](C)(O)CC2)c([O-])c1 ZINC000793250059 629514450 /nfs/dbraw/zinc/51/44/50/629514450.db2.gz JDXFNCPUEBLIDZ-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794797641 629687147 /nfs/dbraw/zinc/68/71/47/629687147.db2.gz OZJMSCGGQAPRKW-CQSZACIVSA-N 0 3 278.396 2.658 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000794809293 629688520 /nfs/dbraw/zinc/68/85/20/629688520.db2.gz FROOEFUELONKGI-JSGCOSHPSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C[S@](C)=O)c1ccc(C)cc1[O-] ZINC000794813565 629689765 /nfs/dbraw/zinc/68/97/65/629689765.db2.gz AYMOZJXCLBODEJ-FNFWKMNBSA-N 0 3 269.410 2.508 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CC(=O)N(C2CC2)C1)c1ccc(C)cc1[O-] ZINC000794817795 629690558 /nfs/dbraw/zinc/69/05/58/629690558.db2.gz QWNNLIVAMFEVCX-IUODEOHRSA-N 0 3 288.391 2.505 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCO)C1CC1)c1ccc(C)cc1[O-] ZINC000794818677 629690586 /nfs/dbraw/zinc/69/05/86/629690586.db2.gz UVOCLAHKRPLFAZ-LSDHHAIUSA-N 0 3 263.381 2.902 20 10 CFCDHN COC(=O)N1CCC(C[NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000797093740 630015735 /nfs/dbraw/zinc/01/57/35/630015735.db2.gz KJLJBVBEUNMBCY-LBPRGKRZSA-N 0 3 292.379 2.521 20 10 CFCDHN CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000797114938 630020266 /nfs/dbraw/zinc/02/02/66/630020266.db2.gz SAMVOIPLSLHQSE-KBPBESRZSA-N 0 3 262.397 2.917 20 10 CFCDHN CCCCN(CC(=O)NCC(C)C)Cc1ccccc1O ZINC000801597816 630461851 /nfs/dbraw/zinc/46/18/51/630461851.db2.gz OYFCNUOFGHTQJJ-UHFFFAOYSA-N 0 3 292.423 2.767 20 10 CFCDHN CCCC[N@H+](Cc1cn[nH]c1)Cc1ccccc1[O-] ZINC000802657412 630536976 /nfs/dbraw/zinc/53/69/76/630536976.db2.gz CKMZBQGEXPTDQL-UHFFFAOYSA-N 0 3 259.353 2.918 20 10 CFCDHN CCCC[N@@H+](Cc1cn[nH]c1)Cc1ccccc1[O-] ZINC000802657412 630536977 /nfs/dbraw/zinc/53/69/77/630536977.db2.gz CKMZBQGEXPTDQL-UHFFFAOYSA-N 0 3 259.353 2.918 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC(=O)NC(C)C)c1[O-] ZINC000808673200 631026766 /nfs/dbraw/zinc/02/67/66/631026766.db2.gz ZYILXGKFFDFGNG-JTQLQIEISA-N 0 3 284.787 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2cnn(C)c2)c1[O-] ZINC000808678521 631027318 /nfs/dbraw/zinc/02/73/18/631027318.db2.gz SMMUZSTXXBSZBG-NSHDSACASA-N 0 3 293.798 2.981 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c1[O-] ZINC000808703092 631030714 /nfs/dbraw/zinc/03/07/14/631030714.db2.gz HZXVSSCBMBQNQP-NTZNESFSSA-N 0 3 281.783 2.942 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCC(=O)N(C)C2)c1[O-] ZINC000808697281 631030881 /nfs/dbraw/zinc/03/08/81/631030881.db2.gz BGADVGVXHDRZSH-CMPLNLGQSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCCNC2=O)c1[O-] ZINC000840825872 631232180 /nfs/dbraw/zinc/23/21/80/631232180.db2.gz CCAFWGUMGFVEDU-GHMZBOCLSA-N 0 3 296.798 2.531 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC(F)(F)[C@H]2O)c([O-])c1 ZINC000840886546 631251913 /nfs/dbraw/zinc/25/19/13/631251913.db2.gz GRFYQKRAYOWRDG-SUHUHFCYSA-N 0 3 285.334 2.900 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CCCC(F)(F)[C@@H]1O)CC2 ZINC000840886538 631252208 /nfs/dbraw/zinc/25/22/08/631252208.db2.gz GPCCDYSTCUBHCJ-COPLHBTASA-N 0 3 283.318 2.518 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1c2ccccc2C[C@H]1O ZINC000840935764 631268408 /nfs/dbraw/zinc/26/84/08/631268408.db2.gz CSOTYSPGEWIYSE-RTBURBONSA-N 0 3 296.414 2.809 20 10 CFCDHN C[C@@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763868 631283936 /nfs/dbraw/zinc/28/39/36/631283936.db2.gz AMYYGWSDTOFCPK-RISCZKNCSA-N 0 3 282.815 2.818 20 10 CFCDHN C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763868 631283940 /nfs/dbraw/zinc/28/39/40/631283940.db2.gz AMYYGWSDTOFCPK-RISCZKNCSA-N 0 3 282.815 2.818 20 10 CFCDHN C[C@@]1(CNCc2c([O-])ccc(Cl)c2F)CCC[NH2+]C1 ZINC000841057466 631324720 /nfs/dbraw/zinc/32/47/20/631324720.db2.gz NLVLXNQIPXXUCZ-CQSZACIVSA-N 0 3 286.778 2.664 20 10 CFCDHN CC1(C)CNCC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000841073445 631330210 /nfs/dbraw/zinc/33/02/10/631330210.db2.gz UGMIJVKKAMUXBB-LBPRGKRZSA-N 0 3 286.778 2.662 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1ccccc1[O-] ZINC000155227969 650013923 /nfs/dbraw/zinc/01/39/23/650013923.db2.gz UDFKYIPSAFDSJD-CABCVRRESA-N 0 3 262.397 2.773 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1=O)c1cc(F)ccc1[O-] ZINC000842886453 631772943 /nfs/dbraw/zinc/77/29/43/631772943.db2.gz SAJKDYRLGCDNJF-ZWNOBZJWSA-N 0 3 294.370 2.581 20 10 CFCDHN NCC[N@H+](CCc1ccccc1)Cc1cccc(F)c1[O-] ZINC000843121350 631842121 /nfs/dbraw/zinc/84/21/21/631842121.db2.gz FHRPHPPCQKXLFM-UHFFFAOYSA-N 0 3 288.366 2.535 20 10 CFCDHN NCC[N@@H+](CCc1ccccc1)Cc1cccc(F)c1[O-] ZINC000843121350 631842128 /nfs/dbraw/zinc/84/21/28/631842128.db2.gz FHRPHPPCQKXLFM-UHFFFAOYSA-N 0 3 288.366 2.535 20 10 CFCDHN [NH3+]CCN(CCc1ccccc1)Cc1cccc(F)c1[O-] ZINC000843121350 631842137 /nfs/dbraw/zinc/84/21/37/631842137.db2.gz FHRPHPPCQKXLFM-UHFFFAOYSA-N 0 3 288.366 2.535 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CO[C@H](C)C2)c1[O-] ZINC000843433450 631958376 /nfs/dbraw/zinc/95/83/76/631958376.db2.gz ZYHCCUWXGAPSJP-SKDRFNHKSA-N 0 3 255.745 2.621 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CO[C@@H](C)C2)c1[O-] ZINC000843433446 631958908 /nfs/dbraw/zinc/95/89/08/631958908.db2.gz ZYHCCUWXGAPSJP-CABZTGNLSA-N 0 3 255.745 2.621 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000156067883 650042686 /nfs/dbraw/zinc/04/26/86/650042686.db2.gz HQASCMCKARNLCL-ZDUSSCGKSA-N 0 3 268.788 2.572 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000815081763 632198118 /nfs/dbraw/zinc/19/81/18/632198118.db2.gz NRTJNFUNRARYOA-WFASDCNBSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1cc(CN2CC[C@H](OC(F)F)C2)ccc1N(C)C ZINC000815112344 632203233 /nfs/dbraw/zinc/20/32/33/632203233.db2.gz OTRBRFPCVMXWOC-ZDUSSCGKSA-N 0 3 284.350 2.875 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CNc2ccccc2C1 ZINC000844907376 632333184 /nfs/dbraw/zinc/33/31/84/632333184.db2.gz ISAKDYBDHFDACI-ZDUSSCGKSA-N 0 3 284.359 2.527 20 10 CFCDHN [O-]c1c(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)ccc2ccccc21 ZINC000816512680 632475254 /nfs/dbraw/zinc/47/52/54/632475254.db2.gz QQQACGPKBQNYEJ-GASCZTMLSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1c(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc2ccccc21 ZINC000816512680 632475255 /nfs/dbraw/zinc/47/52/55/632475255.db2.gz QQQACGPKBQNYEJ-GASCZTMLSA-N 0 3 269.344 2.909 20 10 CFCDHN Cc1cc(C[NH2+]Cc2ccc3ccccc3c2[O-])ncn1 ZINC000816559394 632484163 /nfs/dbraw/zinc/48/41/63/632484163.db2.gz IYVVQBHSDMIFNT-UHFFFAOYSA-N 0 3 279.343 2.934 20 10 CFCDHN Cc1cccc(CN2C[C@@]3(CCCO3)[C@H]2C2CC2)c1O ZINC000816666280 632508969 /nfs/dbraw/zinc/50/89/69/632508969.db2.gz JIOPHGPEUZNIFS-SJORKVTESA-N 0 3 273.376 2.844 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000816675512 632510391 /nfs/dbraw/zinc/51/03/91/632510391.db2.gz CMRLELNRAIFUCZ-INIZCTEOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000816675512 632510393 /nfs/dbraw/zinc/51/03/93/632510393.db2.gz CMRLELNRAIFUCZ-INIZCTEOSA-N 0 3 279.380 2.648 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000846015353 632614613 /nfs/dbraw/zinc/61/46/13/632614613.db2.gz CEYHCLMUDXYWMN-WFASDCNBSA-N 0 3 281.396 2.678 20 10 CFCDHN CO[C@@H]1[C@@H](C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000817407982 632621565 /nfs/dbraw/zinc/62/15/65/632621565.db2.gz BQZZUAWVYHRCER-QCZZGDTMSA-N 0 3 267.344 2.680 20 10 CFCDHN COc1cccc([C@H](C)N[C@@H](CO)c2ccsc2)c1O ZINC000846164332 632650736 /nfs/dbraw/zinc/65/07/36/632650736.db2.gz NZTGEKDFVZFXJW-GWCFXTLKSA-N 0 3 293.388 2.847 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1ccccc1[O-] ZINC000846180113 632655179 /nfs/dbraw/zinc/65/51/79/632655179.db2.gz SAEBMUYMDOSIIQ-AUUYWEPGSA-N 0 3 297.398 2.919 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[C@H](C(N)=O)CC2)c([O-])c1 ZINC000817585702 632671523 /nfs/dbraw/zinc/67/15/23/632671523.db2.gz GZCMSSGITAEWPN-MGPQQGTHSA-N 0 3 290.407 2.643 20 10 CFCDHN C[C@H](N[C@H]1CC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817944546 632747234 /nfs/dbraw/zinc/74/72/34/632747234.db2.gz GSKKCWFXNYMFLN-AAEUAGOBSA-N 0 3 256.349 2.558 20 10 CFCDHN CC[NH2+]CCN[C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817951574 632751718 /nfs/dbraw/zinc/75/17/18/632751718.db2.gz GPNXVLGQCDNKOL-VIFPVBQESA-N 0 3 276.302 2.671 20 10 CFCDHN CCNCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817951574 632751719 /nfs/dbraw/zinc/75/17/19/632751719.db2.gz GPNXVLGQCDNKOL-VIFPVBQESA-N 0 3 276.302 2.671 20 10 CFCDHN C[C@H]([NH2+][C@H](CN)C1CC1)c1ccc(Br)cc1[O-] ZINC000817959760 632758198 /nfs/dbraw/zinc/75/81/98/632758198.db2.gz IJTCZIRCFZGXCQ-QPUJVOFHSA-N 0 3 299.212 2.543 20 10 CFCDHN CCCC[C@@H](CN)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000817961880 632761458 /nfs/dbraw/zinc/76/14/58/632761458.db2.gz FTBORAAFNRNWER-JQWIXIFHSA-N 0 3 254.349 2.699 20 10 CFCDHN C[C@@H](N)C[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817971731 632770680 /nfs/dbraw/zinc/77/06/80/632770680.db2.gz GOXGQJCBEHCAJY-RQJHMYQMSA-N 0 3 263.168 2.697 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)N)c1cc(Cl)c(Cl)cc1[O-] ZINC000817971726 632771093 /nfs/dbraw/zinc/77/10/93/632771093.db2.gz GOXGQJCBEHCAJY-NKWVEPMBSA-N 0 3 263.168 2.697 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1[O-])[C@H](C)N ZINC000817978002 632775463 /nfs/dbraw/zinc/77/54/63/632775463.db2.gz SUHSKYNDGKQXIA-YIZRAAEISA-N 0 3 287.201 2.541 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CN)C1CCCC1)c1ccc(F)cc1[O-] ZINC000817981453 632777856 /nfs/dbraw/zinc/77/78/56/632777856.db2.gz KBMUAKDIHLEARP-YGRLFVJLSA-N 0 3 266.360 2.699 20 10 CFCDHN CC[C@H](N[C@@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 ZINC000817981080 632777877 /nfs/dbraw/zinc/77/78/77/632777877.db2.gz PSRMXUNYKPQOBD-LSDHHAIUSA-N 0 3 297.393 2.791 20 10 CFCDHN CC[C@@H](C)N1CCN(c2ccc(OC)cc2OC)CC1 ZINC000846745948 632782051 /nfs/dbraw/zinc/78/20/51/632782051.db2.gz PKYKRKXQMLCGGS-CYBMUJFWSA-N 0 3 278.396 2.624 20 10 CFCDHN CC[C@H]([NH2+]CCCCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000818351177 632836163 /nfs/dbraw/zinc/83/61/63/632836163.db2.gz PFXIPFSTDKNUOS-AWEZNQCLSA-N 0 3 299.436 2.566 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(F)cc1[O-] ZINC000818614550 632879627 /nfs/dbraw/zinc/87/96/27/632879627.db2.gz BYYCBUFTSQPZAA-HZSPNIEDSA-N 0 3 266.360 2.842 20 10 CFCDHN c1csc(SCCCN[C@H]2CCCn3ccnc32)n1 ZINC000848529819 633278737 /nfs/dbraw/zinc/27/87/37/633278737.db2.gz YGBLOPIWTAVJJT-NSHDSACASA-N 0 3 294.449 2.947 20 10 CFCDHN CCCNC(=O)CN(CCC)Cc1cccc(CC)c1O ZINC000848882740 633359018 /nfs/dbraw/zinc/35/90/18/633359018.db2.gz ZTZCPEAZQOENEG-UHFFFAOYSA-N 0 3 292.423 2.693 20 10 CFCDHN CCc1cccc(CNCc2cccc3c2OCO3)c1O ZINC000848893444 633379788 /nfs/dbraw/zinc/37/97/88/633379788.db2.gz CTRJUPBSZFCRJF-UHFFFAOYSA-N 0 3 285.343 2.973 20 10 CFCDHN CCc1cccc(C[NH2+][C@H](CC)C[C@H](C)CO)c1[O-] ZINC000848898034 633386959 /nfs/dbraw/zinc/38/69/59/633386959.db2.gz OQJUWAVCVPVTDO-SWLSCSKDSA-N 0 3 265.397 2.841 20 10 CFCDHN CCc1cccc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000848914251 633399154 /nfs/dbraw/zinc/39/91/54/633399154.db2.gz GHIHYVLJXKEFSB-HNNXBMFYSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1cccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000848914251 633399159 /nfs/dbraw/zinc/39/91/59/633399159.db2.gz GHIHYVLJXKEFSB-HNNXBMFYSA-N 0 3 277.408 2.938 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](C1CC1)[C@H]1CCCCO1 ZINC000848921967 633403817 /nfs/dbraw/zinc/40/38/17/633403817.db2.gz KMAUTBCYHCTKHI-HZPDHXFCSA-N 0 3 279.355 2.969 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@]1(C)CC1(F)F ZINC000850378930 633964352 /nfs/dbraw/zinc/96/43/52/633964352.db2.gz BDCWIWPMWQLZTG-GFCCVEGCSA-N 0 3 257.280 2.536 20 10 CFCDHN CN(C)c1ccc(CNC[C@]23OCCC[C@H]2C3(F)F)cc1 ZINC000850377408 633965725 /nfs/dbraw/zinc/96/57/25/633965725.db2.gz GJEPHJCRBUGUDS-CABCVRRESA-N 0 3 296.361 2.657 20 10 CFCDHN COC[C@H](CC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F)OC ZINC000850486004 634014276 /nfs/dbraw/zinc/01/42/76/634014276.db2.gz QDZCHAWXYQMQOK-GVXVVHGQSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@@H]([NH2+][C@H]1Cc2ccccc2N(C)C1=O)c1ccccc1[O-] ZINC000850500741 634020565 /nfs/dbraw/zinc/02/05/65/634020565.db2.gz IYWHATVVVPMUFQ-DOMZBBRYSA-N 0 3 296.370 2.631 20 10 CFCDHN CC[C@H]([NH2+][C@H]1C[C@H](O)C12CCC2)c1ccccc1[O-] ZINC000850544877 634046330 /nfs/dbraw/zinc/04/63/30/634046330.db2.gz BSAXNXMYNOFKNP-QEJZJMRPSA-N 0 3 261.365 2.736 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](O)C23CCC3)c2c1c(F)ccc2[O-] ZINC000850545408 634046564 /nfs/dbraw/zinc/04/65/64/634046564.db2.gz GVTXNIABALXGLK-DGFQIJBJSA-N 0 3 291.366 2.973 20 10 CFCDHN CC[C@H]([NH2+]CCOCCF)c1ccc(C)cc1[O-] ZINC000853238840 634948338 /nfs/dbraw/zinc/94/83/38/634948338.db2.gz SNEAZKSNNXBRPD-ZDUSSCGKSA-N 0 3 255.333 2.727 20 10 CFCDHN C[NH2+]C[C@H](C)N[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000854230891 635267756 /nfs/dbraw/zinc/26/77/56/635267756.db2.gz BGRVQPDQKBCJPZ-JGVFFNPUSA-N 0 3 277.195 2.958 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2ccco2)cc1F ZINC000858087727 636121619 /nfs/dbraw/zinc/12/16/19/636121619.db2.gz RZQRVKLRFHZZRE-UHFFFAOYSA-N 0 3 280.318 2.956 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2CCOC2(C)C)cc1F ZINC000858170381 636146515 /nfs/dbraw/zinc/14/65/15/636146515.db2.gz GBQDFBWHAJEJAZ-AWEZNQCLSA-N 0 3 284.350 2.688 20 10 CFCDHN CCO[C@H]1C[C@H](NCc2cc(F)c(N(C)C)cc2F)C1 ZINC000858189588 636151459 /nfs/dbraw/zinc/15/14/59/636151459.db2.gz SSFPXEVLUWECNT-HAQNSBGRSA-N 0 3 284.350 2.688 20 10 CFCDHN CC(C)N1CC[C@@H](C[NH2+]Cc2cccc(Cl)c2[O-])C1 ZINC000158731968 650235079 /nfs/dbraw/zinc/23/50/79/650235079.db2.gz URYHJKPYFBVLHU-LBPRGKRZSA-N 0 3 282.815 2.866 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2COC3(CCC3)C2)cc1F ZINC000858189963 636153334 /nfs/dbraw/zinc/15/33/34/636153334.db2.gz WOSGXRAYEGGJLC-GFCCVEGCSA-N 0 3 296.361 2.832 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1NCc1ccc(N(C)C)c(F)c1 ZINC000858257080 636168576 /nfs/dbraw/zinc/16/85/76/636168576.db2.gz HNCNXBQHMXTBSB-CABCVRRESA-N 0 3 266.360 2.549 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCN1CC(F)F)CC2 ZINC000858479238 636264663 /nfs/dbraw/zinc/26/46/63/636264663.db2.gz MGGBDZAROSKWNY-STQMWFEESA-N 0 3 296.361 2.699 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000858486567 636269084 /nfs/dbraw/zinc/26/90/84/636269084.db2.gz VSBGWEAZERTNJE-KGLIPLIRSA-N 0 3 263.381 2.766 20 10 CFCDHN CC[C@H]([NH2+]CCOC1CCOCC1)c1ccccc1[O-] ZINC000859232547 636517574 /nfs/dbraw/zinc/51/75/74/636517574.db2.gz LZABSHJMLWCCJY-HNNXBMFYSA-N 0 3 279.380 2.629 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccnc(F)c2)c1 ZINC000859232555 636518095 /nfs/dbraw/zinc/51/80/95/636518095.db2.gz MCGZVAFKYZURCE-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN CCN(C)c1ccc(CN2CCN(CCCF)CC2)cc1 ZINC000860008152 636759712 /nfs/dbraw/zinc/75/97/12/636759712.db2.gz PAPCORHKRDBNJT-UHFFFAOYSA-N 0 3 293.430 2.620 20 10 CFCDHN Cc1c(F)nccc1CN(C)Cc1ccccc1O ZINC000862228167 637292100 /nfs/dbraw/zinc/29/21/00/637292100.db2.gz MGHQQRLSHCEMKG-UHFFFAOYSA-N 0 3 260.312 2.867 20 10 CFCDHN Cc1cccc(CNCc2c(C(F)(F)F)cnn2C)c1O ZINC000862436026 637376695 /nfs/dbraw/zinc/37/66/95/637376695.db2.gz ULTLTPRVYQGMRR-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN Cc1ccc(O)c(CNCc2cc(C3CC3)nn2C)c1 ZINC000862478567 637395948 /nfs/dbraw/zinc/39/59/48/637395948.db2.gz JWOSZYZMHWVXDB-UHFFFAOYSA-N 0 3 271.364 2.601 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCN(C)CC(F)F)c1[O-] ZINC000862549585 637422091 /nfs/dbraw/zinc/42/20/91/637422091.db2.gz ASBQYHUUNRASFV-UHFFFAOYSA-N 0 3 292.757 2.641 20 10 CFCDHN COc1cnccc1[C@H](C)NCc1cc(F)ccc1O ZINC000189010888 650356411 /nfs/dbraw/zinc/35/64/11/650356411.db2.gz DJUADLRJAQAOKY-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN O=c1[nH]c2c(cc1C[NH2+]Cc1ccccc1[O-])CCCC2 ZINC000865879324 638639727 /nfs/dbraw/zinc/63/97/27/638639727.db2.gz MEESBNPXTLICFF-UHFFFAOYSA-N 0 3 284.359 2.661 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2[C@@H]3OC[C@@H]4C[C@H]2C[C@@H]43)c([O-])c1 ZINC000866444011 638822296 /nfs/dbraw/zinc/82/22/96/638822296.db2.gz BRBCKQRAPBBDFP-VTHUWITOSA-N 0 3 273.376 2.775 20 10 CFCDHN CC1(C)CC[C@@H](O)[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000866452585 638824875 /nfs/dbraw/zinc/82/48/75/638824875.db2.gz JXXJORHPVHAEDR-MGPQQGTHSA-N 0 3 275.392 2.909 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCC[C@@H]2O)c1[O-] ZINC000866489124 638829865 /nfs/dbraw/zinc/82/98/65/638829865.db2.gz DQBCQTANSOQNGP-XDTLVQLUSA-N 0 3 269.772 2.918 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@H]2CCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866489459 638829968 /nfs/dbraw/zinc/82/99/68/638829968.db2.gz OBUFMYOSWUTKKO-IXLVHKGHSA-N 0 3 265.328 2.583 20 10 CFCDHN CC[C@@H]([NH2+]CCCO[C@H]1CCOC1)c1ccccc1[O-] ZINC000121093030 638832834 /nfs/dbraw/zinc/83/28/34/638832834.db2.gz YVQGMINKRZNJMK-DZGCQCFKSA-N 0 3 279.380 2.629 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCn2nccc21)c1cc(F)ccc1[O-] ZINC000866634311 638858342 /nfs/dbraw/zinc/85/83/42/638858342.db2.gz QDQYBZYUAORVFD-GWCFXTLKSA-N 0 3 275.327 2.914 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@H](O)C1CCCC1)CC2 ZINC000866638433 638859506 /nfs/dbraw/zinc/85/95/06/638859506.db2.gz HTESZALNKXEJFD-GJZGRUSLSA-N 0 3 275.392 2.910 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CC[C@@](O)(C(F)(F)F)C2)c1 ZINC000191437999 650498650 /nfs/dbraw/zinc/49/86/50/650498650.db2.gz LDOINZVIPAKFSU-ZDUSSCGKSA-N 0 3 289.297 2.508 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1C[C@H]3CCC[C@@H]3O1)CC2 ZINC000872106935 641638632 /nfs/dbraw/zinc/63/86/32/641638632.db2.gz JBQPUUYXKPQLGC-CTASWTNQSA-N 0 3 273.376 2.927 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(OC(C)C)CCC1 ZINC000873167714 642046685 /nfs/dbraw/zinc/04/66/85/642046685.db2.gz YWPHFQFHWRBINW-UHFFFAOYSA-N 0 3 279.380 2.838 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](O)Cc1cccc(Cl)c1 ZINC000873179138 642050680 /nfs/dbraw/zinc/05/06/80/642050680.db2.gz DXAPCLUEXRTOQU-HNNXBMFYSA-N 0 3 291.778 2.739 20 10 CFCDHN CCCN1CCC([NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000020189675 642317044 /nfs/dbraw/zinc/31/70/44/642317044.db2.gz GSOOLJXOLHGHLN-CYBMUJFWSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](CCC(N)=O)Cc1ccccc1 ZINC000876552479 642918496 /nfs/dbraw/zinc/91/84/96/642918496.db2.gz ADSPQTMHLSVVPG-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](CCC(N)=O)Cc1ccccc1 ZINC000876552479 642918498 /nfs/dbraw/zinc/91/84/98/642918498.db2.gz ADSPQTMHLSVVPG-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1noc([C@H]2CCC[N@H+](Cc3ccc(C)cc3[O-])C2)n1 ZINC000876612721 642944518 /nfs/dbraw/zinc/94/45/18/642944518.db2.gz VFJGCEOSAYDSME-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(C)cc3[O-])C2)n1 ZINC000876612721 642944520 /nfs/dbraw/zinc/94/45/20/642944520.db2.gz VFJGCEOSAYDSME-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN CC[C@@H](C)[C@@H](C[N@H+](C)Cc1ccccc1[O-])OC ZINC000876615410 642945659 /nfs/dbraw/zinc/94/56/59/642945659.db2.gz DTODTETUHWTWBM-IUODEOHRSA-N 0 3 251.370 2.885 20 10 CFCDHN CC[C@@H](C)[C@@H](C[N@@H+](C)Cc1ccccc1[O-])OC ZINC000876615410 642945662 /nfs/dbraw/zinc/94/56/62/642945662.db2.gz DTODTETUHWTWBM-IUODEOHRSA-N 0 3 251.370 2.885 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876807330 643018848 /nfs/dbraw/zinc/01/88/48/643018848.db2.gz BJYHAMGRIGZCKN-ZBFHGGJFSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876807330 643018852 /nfs/dbraw/zinc/01/88/52/643018852.db2.gz BJYHAMGRIGZCKN-ZBFHGGJFSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)c1ccc(F)cc1 ZINC000876879563 643047201 /nfs/dbraw/zinc/04/72/01/643047201.db2.gz BVUUBAPXMAMGLH-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2ccc(F)cc2)c([O-])c1 ZINC000876879907 643047461 /nfs/dbraw/zinc/04/74/61/643047461.db2.gz DWUSFCGHQHIKTK-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(CN[C@@H](CO)c2ccc(F)cc2)c(O)c1 ZINC000877041945 643117577 /nfs/dbraw/zinc/11/75/77/643117577.db2.gz PLMHHTYBJSJYAU-HNNXBMFYSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@@H](C)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877066405 643131616 /nfs/dbraw/zinc/13/16/16/643131616.db2.gz LAMVMJVLBFUXKA-GFCCVEGCSA-N 0 3 287.407 2.772 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)c2ccc(F)cc2)c([O-])c1 ZINC000877127470 643165637 /nfs/dbraw/zinc/16/56/37/643165637.db2.gz HQHAERUZYDBCCJ-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN CCC1(O)CCC([NH2+]Cc2c(C)cccc2[O-])CC1 ZINC000877134663 643169655 /nfs/dbraw/zinc/16/96/55/643169655.db2.gz DRHHVGFKQSIRNH-UHFFFAOYSA-N 0 3 263.381 2.874 20 10 CFCDHN Cc1ccc(CN2CCC(O)(C(F)(F)F)CC2)c(O)c1 ZINC000877170097 643186324 /nfs/dbraw/zinc/18/63/24/643186324.db2.gz IKRDVJUKEGLCOD-UHFFFAOYSA-N 0 3 289.297 2.590 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000877308938 643231068 /nfs/dbraw/zinc/23/10/68/643231068.db2.gz DRGBTPLJTZHXJK-KBPBESRZSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCc1ccncc1 ZINC000877318555 643235180 /nfs/dbraw/zinc/23/51/80/643235180.db2.gz HONCABKPIRVJFN-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCc1ccncc1 ZINC000877318555 643235185 /nfs/dbraw/zinc/23/51/85/643235185.db2.gz HONCABKPIRVJFN-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(C)cc2[O-])[C@@]12CCCO2 ZINC000877345423 643244476 /nfs/dbraw/zinc/24/44/76/643244476.db2.gz CSXWLHIKIMGDOM-BBWFWOEESA-N 0 3 291.391 2.517 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2c(C)cccc2[O-])[C@]12CCCO2 ZINC000877346758 643245395 /nfs/dbraw/zinc/24/53/95/643245395.db2.gz MWSOEBUZDGDJLZ-GVDBMIGSSA-N 0 3 291.391 2.517 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2c(C)cccc2[O-])[C@@]12CCCO2 ZINC000877346760 643245420 /nfs/dbraw/zinc/24/54/20/643245420.db2.gz MWSOEBUZDGDJLZ-ZACQAIPSSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@@H](C3CC3)C2)c([O-])c1 ZINC000877374550 643250244 /nfs/dbraw/zinc/25/02/44/643250244.db2.gz CXOKXTNURXAIHW-GOEBONIOSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCO[C@H](C2CC2)C1 ZINC000877375126 643250349 /nfs/dbraw/zinc/25/03/49/643250349.db2.gz OPGNTNPSLRNDHC-BBRMVZONSA-N 0 3 261.365 2.748 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877396168 643258449 /nfs/dbraw/zinc/25/84/49/643258449.db2.gz SXBFBYGGJFUQNO-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877396168 643258454 /nfs/dbraw/zinc/25/84/54/643258454.db2.gz SXBFBYGGJFUQNO-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2nn(C)c3ccccc23)c([O-])c1 ZINC000877408558 643263106 /nfs/dbraw/zinc/26/31/06/643263106.db2.gz OXBOPFORXXUSDI-UHFFFAOYSA-N 0 3 295.386 2.920 20 10 CFCDHN CCC(O)(CC)CC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877470935 643289580 /nfs/dbraw/zinc/28/95/80/643289580.db2.gz MRGYODWJKHBPLV-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(CO)CC3(CCC3)C2)c([O-])c1 ZINC000877484423 643300672 /nfs/dbraw/zinc/30/06/72/643300672.db2.gz GFMSWZGYMXHOOD-UHFFFAOYSA-N 0 3 275.392 2.733 20 10 CFCDHN Cc1ccc(CN(CCO)Cc2ccc(C)cc2O)o1 ZINC000877492686 643305770 /nfs/dbraw/zinc/30/57/70/643305770.db2.gz OYPRGZXUBZZUPT-UHFFFAOYSA-N 0 3 275.348 2.597 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](O)C23CCCC3)c([O-])c1 ZINC000877548941 643349087 /nfs/dbraw/zinc/34/90/87/643349087.db2.gz CWBDEBVGZZRLMO-OAHLLOKOSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c([O-])c1 ZINC000877548941 643349095 /nfs/dbraw/zinc/34/90/95/643349095.db2.gz CWBDEBVGZZRLMO-OAHLLOKOSA-N 0 3 261.365 2.580 20 10 CFCDHN CCc1noc(C)c1CNCc1ccc(C)cc1O ZINC000877550638 643350703 /nfs/dbraw/zinc/35/07/03/643350703.db2.gz KVHRJVFZWFQALJ-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN C[N@@H+]1CCC[C@]2(CCN(Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551699 643353048 /nfs/dbraw/zinc/35/30/48/643353048.db2.gz KBKGEEMRWPHLJL-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN C[N@H+]1CCC[C@]2(CCN(Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551699 643353051 /nfs/dbraw/zinc/35/30/51/643353051.db2.gz KBKGEEMRWPHLJL-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@]2(CC[N@H+](Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551699 643353053 /nfs/dbraw/zinc/35/30/53/643353053.db2.gz KBKGEEMRWPHLJL-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@]2(CC[N@@H+](Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551699 643353055 /nfs/dbraw/zinc/35/30/55/643353055.db2.gz KBKGEEMRWPHLJL-INIZCTEOSA-N 0 3 296.361 2.588 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)Cc2cccc(F)c2)c([O-])c1 ZINC000877556982 643358894 /nfs/dbraw/zinc/35/88/94/643358894.db2.gz MCCKVABYMBLING-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([O-])c1 ZINC000877563337 643362644 /nfs/dbraw/zinc/36/26/44/643362644.db2.gz JOFZNWBAIBQZRR-OAGGEKHMSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([O-])c1 ZINC000877563337 643362648 /nfs/dbraw/zinc/36/26/48/643362648.db2.gz JOFZNWBAIBQZRR-OAGGEKHMSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877570871 643369187 /nfs/dbraw/zinc/36/91/87/643369187.db2.gz OSKXQQDHKWUDDU-CQSZACIVSA-N 0 3 265.397 2.930 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877570871 643369191 /nfs/dbraw/zinc/36/91/91/643369191.db2.gz OSKXQQDHKWUDDU-CQSZACIVSA-N 0 3 265.397 2.930 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)C(C)(C)O)c([O-])c1 ZINC000877575199 643372957 /nfs/dbraw/zinc/37/29/57/643372957.db2.gz KGHDUXSFIYYWOB-UHFFFAOYSA-N 0 3 251.370 2.587 20 10 CFCDHN CC[C@@H]([NH2+]Cc1c(C)cccc1[O-])[C@@H](O)C(C)C ZINC000877591460 643384978 /nfs/dbraw/zinc/38/49/78/643384978.db2.gz ULSBSULEFPGJFE-HIFRSBDPSA-N 0 3 251.370 2.586 20 10 CFCDHN CC[C@H]([NH2+]Cc1c(C)cccc1[O-])[C@@H](O)C(C)C ZINC000877591462 643385249 /nfs/dbraw/zinc/38/52/49/643385249.db2.gz ULSBSULEFPGJFE-ZFWWWQNUSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](C)Cc1ccccn1 ZINC000877617959 643403397 /nfs/dbraw/zinc/40/33/97/643403397.db2.gz AVEDKUQXBDRRII-CYBMUJFWSA-N 0 3 256.349 2.816 20 10 CFCDHN Cc1cccc(O)c1CNCc1cnc(C(F)(F)F)nc1 ZINC000877620707 643406525 /nfs/dbraw/zinc/40/65/25/643406525.db2.gz LWVAPZZPZUNZJX-UHFFFAOYSA-N 0 3 297.280 2.799 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])C1CCCC1 ZINC000877638426 643423145 /nfs/dbraw/zinc/42/31/45/643423145.db2.gz GKEHIGVNMUEVOZ-INIZCTEOSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(CC(N)=O)CCCCC2)c([O-])c1 ZINC000877640584 643425231 /nfs/dbraw/zinc/42/52/31/643425231.db2.gz PNPYVSJHCHLBQZ-UHFFFAOYSA-N 0 3 290.407 2.616 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCCCCCNC(=O)CC1 ZINC000877684900 643453762 /nfs/dbraw/zinc/45/37/62/643453762.db2.gz CEWHSWKNFAGCRE-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCCCCCNC(=O)CC1 ZINC000877684900 643453766 /nfs/dbraw/zinc/45/37/66/643453766.db2.gz CEWHSWKNFAGCRE-UHFFFAOYSA-N 0 3 290.407 2.583 20 10 CFCDHN COC(=O)c1oc(CNCc2ccc(C)cc2O)cc1C ZINC000877693068 643458135 /nfs/dbraw/zinc/45/81/35/643458135.db2.gz AGQUFXOOHMOAHH-UHFFFAOYSA-N 0 3 289.331 2.678 20 10 CFCDHN CC[C@H]1C[C@H](C[N@@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702542 643466954 /nfs/dbraw/zinc/46/69/54/643466954.db2.gz AOYJCZOAZWDLPE-OCCSQVGLSA-N 0 3 261.365 2.913 20 10 CFCDHN CC[C@H]1C[C@H](C[N@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702542 643466959 /nfs/dbraw/zinc/46/69/59/643466959.db2.gz AOYJCZOAZWDLPE-OCCSQVGLSA-N 0 3 261.365 2.913 20 10 CFCDHN CC[C@@H]1C[C@H](C[N@@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702543 643467611 /nfs/dbraw/zinc/46/76/11/643467611.db2.gz AOYJCZOAZWDLPE-TZMCWYRMSA-N 0 3 261.365 2.913 20 10 CFCDHN CC[C@@H]1C[C@H](C[N@H+]2Cc3cccc([O-])c3C2)CCO1 ZINC000877702543 643467613 /nfs/dbraw/zinc/46/76/13/643467613.db2.gz AOYJCZOAZWDLPE-TZMCWYRMSA-N 0 3 261.365 2.913 20 10 CFCDHN CCOC(=O)C1CCC([NH2+]Cc2c(C)cccc2[O-])CC1 ZINC000877717768 643481001 /nfs/dbraw/zinc/48/10/01/643481001.db2.gz QACUIDGPUOINTD-UHFFFAOYSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2c3ccccc3CN2C)c([O-])c1 ZINC000877732979 643493185 /nfs/dbraw/zinc/49/31/85/643493185.db2.gz MENNFFSFAPYPOG-QGZVFWFLSA-N 0 3 282.387 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877736852 643497550 /nfs/dbraw/zinc/49/75/50/643497550.db2.gz DNNUHKNCTLADAH-ZYHUDNBSSA-N 0 3 267.369 2.716 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877736852 643497555 /nfs/dbraw/zinc/49/75/55/643497555.db2.gz DNNUHKNCTLADAH-ZYHUDNBSSA-N 0 3 267.369 2.716 20 10 CFCDHN COC(=O)c1cc(CN[C@H](C)c2ccccc2O)c(C)o1 ZINC000877755818 643535937 /nfs/dbraw/zinc/53/59/37/643535937.db2.gz OAQPIFALFDPDMV-SNVBAGLBSA-N 0 3 289.331 2.931 20 10 CFCDHN COC(=O)c1cc(C[NH2+][C@H](C)c2ccccc2[O-])c(C)o1 ZINC000877755818 643535940 /nfs/dbraw/zinc/53/59/40/643535940.db2.gz OAQPIFALFDPDMV-SNVBAGLBSA-N 0 3 289.331 2.931 20 10 CFCDHN COC(=O)c1ccc(CN[C@H](C)c2ccccc2O)o1 ZINC000877756511 643536720 /nfs/dbraw/zinc/53/67/20/643536720.db2.gz OHMKVMRMJVZFON-SNVBAGLBSA-N 0 3 275.304 2.623 20 10 CFCDHN COc1cc(C)nc(CN[C@@H](C)c2ccccc2O)c1 ZINC000877757391 643537297 /nfs/dbraw/zinc/53/72/97/643537297.db2.gz WXPDOLIOIIFTTB-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000877806165 643568297 /nfs/dbraw/zinc/56/82/97/643568297.db2.gz OAWOWLURNBTDOW-DGFSRKRXSA-N 0 3 265.328 2.579 20 10 CFCDHN CCc1cccc(CN[C@@H](C)c2nccnc2C)c1O ZINC000877828032 643593885 /nfs/dbraw/zinc/59/38/85/643593885.db2.gz DFTJNSAMESCQJD-LBPRGKRZSA-N 0 3 271.364 2.904 20 10 CFCDHN C[C@@H]([NH2+]CC1(Br)CC1)c1ccccc1[O-] ZINC000879649452 644363250 /nfs/dbraw/zinc/36/32/50/644363250.db2.gz UFERPUUMNBRDGY-SECBINFHSA-N 0 3 270.170 2.970 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2ccccc2O)nc(C)n1 ZINC000879650235 644364249 /nfs/dbraw/zinc/36/42/49/644364249.db2.gz QUBQKEGBWKPLID-NSHDSACASA-N 0 3 257.337 2.650 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000248480573 650935952 /nfs/dbraw/zinc/93/59/52/650935952.db2.gz APQSWZBLOCXNCK-QWHCGFSZSA-N 0 3 280.387 2.914 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)C[C@H]1CCC[N@@H+]1C ZINC000211595205 644970088 /nfs/dbraw/zinc/97/00/88/644970088.db2.gz LCKFOFHQHLALNA-LLVKDONJSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)C[C@H]1CCC[N@H+]1C ZINC000211595205 644970092 /nfs/dbraw/zinc/97/00/92/644970092.db2.gz LCKFOFHQHLALNA-LLVKDONJSA-N 0 3 268.788 2.572 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886064421 646850975 /nfs/dbraw/zinc/85/09/75/646850975.db2.gz DJZJMVJAFJHUBR-ZBFHGGJFSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886064421 646850977 /nfs/dbraw/zinc/85/09/77/646850977.db2.gz DJZJMVJAFJHUBR-ZBFHGGJFSA-N 0 3 261.365 2.782 20 10 CFCDHN Cc1ccc(O)c(CN2CCC(O)(C(F)(F)F)CC2)c1 ZINC000136855820 646869467 /nfs/dbraw/zinc/86/94/67/646869467.db2.gz NQRUUWPNLIQUFX-UHFFFAOYSA-N 0 3 289.297 2.590 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@H](C)c2ccccc2[O-])nc1 ZINC000927073908 648698391 /nfs/dbraw/zinc/69/83/91/648698391.db2.gz VDXKXUTXTSUDQI-CYBMUJFWSA-N 0 3 271.364 2.858 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@H](C)c2cc(F)ccc2[O-])nc1 ZINC000927073100 648698654 /nfs/dbraw/zinc/69/86/54/648698654.db2.gz IPFVVPZHSVVNJV-GFCCVEGCSA-N 0 3 289.354 2.997 20 10 CFCDHN Cc1cccc([C@H](O)C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000929975686 649158703 /nfs/dbraw/zinc/15/87/03/649158703.db2.gz IEZLSZBTYCOXGO-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cccc([C@H](O)C[N@H+](C)Cc2ccccc2[O-])c1 ZINC000929975686 649158704 /nfs/dbraw/zinc/15/87/04/649158704.db2.gz IEZLSZBTYCOXGO-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN CC[C@@](O)(C[NH2+][C@@H](C)c1ccccc1[O-])C(F)(F)F ZINC000931554374 649452949 /nfs/dbraw/zinc/45/29/49/649452949.db2.gz ORBJGMMTDPZGGE-JOYOIKCWSA-N 0 3 277.286 2.746 20 10 CFCDHN Cc1cc(CN2CC[C@H]2CO)ccc1N1CCCCC1 ZINC000934017207 649742059 /nfs/dbraw/zinc/74/20/59/649742059.db2.gz FVAUOJACDYSCJT-INIZCTEOSA-N 0 3 274.408 2.552 20 10 CFCDHN CC1(C)OCC[C@@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000693070697 770216282 /nfs/dbraw/zinc/21/62/82/770216282.db2.gz IIEOUQWRCVMBGG-OLZOCXBDSA-N 0 3 261.365 2.784 20 10 CFCDHN CC1(C[N@@H+]2CCc3cccc([O-])c3C2)CCOCC1 ZINC001208077486 769850294 /nfs/dbraw/zinc/85/02/94/769850294.db2.gz USBYLQVCFFLIFO-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN CC1(C[N@H+]2CCc3cccc([O-])c3C2)CCOCC1 ZINC001208077486 769850308 /nfs/dbraw/zinc/85/03/08/769850308.db2.gz USBYLQVCFFLIFO-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN COc1ccc(C[NH2+]C[C@@H](OC)C2CCCC2)c([O-])c1 ZINC000692973103 769944121 /nfs/dbraw/zinc/94/41/21/769944121.db2.gz HHLDBMCJKWOUAI-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccccc1[O-] ZINC000693890349 775231221 /nfs/dbraw/zinc/23/12/21/775231221.db2.gz PQHQJAYFRKJEDB-CHWSQXEVSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C[C@H](C)O1 ZINC000694800643 775579014 /nfs/dbraw/zinc/57/90/14/775579014.db2.gz MSCMZBDKGPDBHT-ZMJPVWNMSA-N 0 3 261.365 2.925 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001140948215 775684737 /nfs/dbraw/zinc/68/47/37/775684737.db2.gz YJDFXXXBYOXLFY-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001140948215 775684744 /nfs/dbraw/zinc/68/47/44/775684744.db2.gz YJDFXXXBYOXLFY-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])Cc1ccccc1O ZINC000179942671 775840549 /nfs/dbraw/zinc/84/05/49/775840549.db2.gz HYFXVMHGTNEXKX-UHFFFAOYSA-N 0 3 261.296 2.869 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])Cc1ccccc1O ZINC000179942671 775840558 /nfs/dbraw/zinc/84/05/58/775840558.db2.gz HYFXVMHGTNEXKX-UHFFFAOYSA-N 0 3 261.296 2.869 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@H]1CCCC3(CC3)C1)OCO2 ZINC000695691333 775941203 /nfs/dbraw/zinc/94/12/03/775941203.db2.gz SCQTXOUTROWSDN-LBPRGKRZSA-N 0 3 275.348 2.933 20 10 CFCDHN CC[N@H+](Cc1ccccc1[O-])Cc1cc(O)ccc1O ZINC001141161836 775968391 /nfs/dbraw/zinc/96/83/91/775968391.db2.gz ZQLVVZGLVIBNQC-UHFFFAOYSA-N 0 3 273.332 2.826 20 10 CFCDHN CC[N@@H+](Cc1ccccc1[O-])Cc1cc(O)ccc1O ZINC001141161836 775968397 /nfs/dbraw/zinc/96/83/97/775968397.db2.gz ZQLVVZGLVIBNQC-UHFFFAOYSA-N 0 3 273.332 2.826 20 10 CFCDHN C[C@@H]([NH2+]CC1SCCS1)c1cc(F)ccc1[O-] ZINC000692910337 776650354 /nfs/dbraw/zinc/65/03/54/776650354.db2.gz PKHKKEUDKJDAGQ-MRVPVSSYSA-N 0 3 273.398 2.988 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1O ZINC001231586520 777268663 /nfs/dbraw/zinc/26/86/63/777268663.db2.gz IVHCHKJDPFBLMP-PXAZEXFGSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1O ZINC001231586520 777268668 /nfs/dbraw/zinc/26/86/68/777268668.db2.gz IVHCHKJDPFBLMP-PXAZEXFGSA-N 0 3 271.360 2.748 20 10 CFCDHN CCCNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1O ZINC001231592028 777271307 /nfs/dbraw/zinc/27/13/07/777271307.db2.gz FNBLPEIRJNMKDC-HNNXBMFYSA-N 0 3 290.407 2.581 20 10 CFCDHN CCOC(=O)CC[N@H+](C)Cc1c([O-])ccc2ccccc21 ZINC001231590374 777271598 /nfs/dbraw/zinc/27/15/98/777271598.db2.gz WZXYJGQQLZFHOW-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CCOC(=O)CC[N@@H+](C)Cc1c([O-])ccc2ccccc21 ZINC001231590374 777271606 /nfs/dbraw/zinc/27/16/06/777271606.db2.gz WZXYJGQQLZFHOW-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001231842789 777346309 /nfs/dbraw/zinc/34/63/09/777346309.db2.gz PTMYZBNOXDMAEK-WMLDXEAASA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001231842789 777346316 /nfs/dbraw/zinc/34/63/16/777346316.db2.gz PTMYZBNOXDMAEK-WMLDXEAASA-N 0 3 277.408 2.992 20 10 CFCDHN [O-]c1c(C[N@H+]2C[C@H](F)C[C@@H](CO)C2)ccc2ccccc12 ZINC001231879618 777363158 /nfs/dbraw/zinc/36/31/58/777363158.db2.gz KWJLIOHSYHSTRS-IUODEOHRSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1c(C[N@@H+]2C[C@H](F)C[C@@H](CO)C2)ccc2ccccc12 ZINC001231879618 777363166 /nfs/dbraw/zinc/36/31/66/777363166.db2.gz KWJLIOHSYHSTRS-IUODEOHRSA-N 0 3 289.350 2.698 20 10 CFCDHN CN1CC[C@@H]([N@H+](C)Cc2ccc3ccccc3c2[O-])C1 ZINC001231881716 777365409 /nfs/dbraw/zinc/36/54/09/777365409.db2.gz HAUHPZCMULACHP-OAHLLOKOSA-N 0 3 270.376 2.681 20 10 CFCDHN CN1CC[C@@H]([N@@H+](C)Cc2ccc3ccccc3c2[O-])C1 ZINC001231881716 777365413 /nfs/dbraw/zinc/36/54/13/777365413.db2.gz HAUHPZCMULACHP-OAHLLOKOSA-N 0 3 270.376 2.681 20 10 CFCDHN CN(Cc1cc(F)ccc1N)Cc1ccccc1O ZINC001232510785 777588972 /nfs/dbraw/zinc/58/89/72/777588972.db2.gz FIYWYVPJHORALF-UHFFFAOYSA-N 0 3 260.312 2.746 20 10 CFCDHN CCOC(=O)c1c(CN2CCCC2)c2ccccc2n1C ZINC001233270437 777856264 /nfs/dbraw/zinc/85/62/64/777856264.db2.gz NSDSXODZOYFZGW-UHFFFAOYSA-N 0 3 286.375 2.951 20 10 CFCDHN C[N@H+](Cc1cccc2c1CCO2)Cc1ccccc1[O-] ZINC001233277464 777861782 /nfs/dbraw/zinc/86/17/82/777861782.db2.gz DHFNDTBEUUCIQS-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN C[N@@H+](Cc1cccc2c1CCO2)Cc1ccccc1[O-] ZINC001233277464 777861791 /nfs/dbraw/zinc/86/17/91/777861791.db2.gz DHFNDTBEUUCIQS-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@H]3OC[C@@H](C)[C@H]3C2)c1O ZINC001233290112 777869248 /nfs/dbraw/zinc/86/92/48/777869248.db2.gz JVIONRPXZQZLKI-GAJTVXKRSA-N 0 3 297.782 2.521 20 10 CFCDHN CC(C)C[NH+](Cc1cc(O)c(O)cc1[O-])CC(C)C ZINC001233482460 777962043 /nfs/dbraw/zinc/96/20/43/777962043.db2.gz OLHYGDNJZKTTFX-UHFFFAOYSA-N 0 3 267.369 2.917 20 10 CFCDHN C[N@H+](Cc1cccc(OC(F)(F)F)c1[O-])C1CC1 ZINC001233728370 778056179 /nfs/dbraw/zinc/05/61/79/778056179.db2.gz WHVNFUQWOQUGQP-UHFFFAOYSA-N 0 3 261.243 2.885 20 10 CFCDHN C[N@@H+](Cc1cccc(OC(F)(F)F)c1[O-])C1CC1 ZINC001233728370 778056189 /nfs/dbraw/zinc/05/61/89/778056189.db2.gz WHVNFUQWOQUGQP-UHFFFAOYSA-N 0 3 261.243 2.885 20 10 CFCDHN Oc1c(CN2CCSCC2)cccc1OC(F)(F)F ZINC001233736032 778060246 /nfs/dbraw/zinc/06/02/46/778060246.db2.gz BISWXZFUEGROQP-UHFFFAOYSA-N 0 3 293.310 2.840 20 10 CFCDHN COC[C@H]1CCN1Cc1cccc(OC(F)(F)F)c1O ZINC001233776442 778074191 /nfs/dbraw/zinc/07/41/91/778074191.db2.gz SJQMPYIMINDNRC-SNVBAGLBSA-N 0 3 291.269 2.512 20 10 CFCDHN CCN1CCN(c2ccc(O[C@@H]3C=CCC3)cc2)CC1 ZINC001234661941 778282154 /nfs/dbraw/zinc/28/21/54/778282154.db2.gz XQOQEAUKJKHOOD-MRXNPFEDSA-N 0 3 272.392 2.926 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@](C)(O)C2)c([O-])c1 ZINC001235674592 778532952 /nfs/dbraw/zinc/53/29/52/778532952.db2.gz GWQMEFMSTBHPCU-MRXNPFEDSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@](C)(O)C2)c([O-])c1 ZINC001235674592 778532956 /nfs/dbraw/zinc/53/29/56/778532956.db2.gz GWQMEFMSTBHPCU-MRXNPFEDSA-N 0 3 263.381 2.646 20 10 CFCDHN CCCCCCN1CCN(Cc2ccc(N)cc2)CC1 ZINC001235691443 778538151 /nfs/dbraw/zinc/53/81/51/778538151.db2.gz LBIXBKUDGKPQQP-UHFFFAOYSA-N 0 3 275.440 2.967 20 10 CFCDHN CC[C@@H]1CNCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235772855 778556195 /nfs/dbraw/zinc/55/61/95/778556195.db2.gz LVYORINBRMPRET-CQSZACIVSA-N 0 3 270.376 2.729 20 10 CFCDHN CC[C@@H]1CNCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235772855 778556199 /nfs/dbraw/zinc/55/61/99/778556199.db2.gz LVYORINBRMPRET-CQSZACIVSA-N 0 3 270.376 2.729 20 10 CFCDHN CCN(Cc1cc(Cl)c(C)cc1[O-])[C@@H]1CC[NH2+]C1 ZINC001235969347 778632160 /nfs/dbraw/zinc/63/21/60/778632160.db2.gz CASYLROOOZVEDA-GFCCVEGCSA-N 0 3 268.788 2.538 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)C[C@@H]([NH3+])C2)cc1Cl ZINC001236050959 778668737 /nfs/dbraw/zinc/66/87/37/778668737.db2.gz VEIDVZJIZILJFC-BXKDBHETSA-N 0 3 268.788 2.523 20 10 CFCDHN CN(Cc1cc(F)c(Cl)cc1[O-])[C@H]1CCCC[C@@H]1[NH3+] ZINC001236217012 778740938 /nfs/dbraw/zinc/74/09/38/778740938.db2.gz MQJUNJCKANWKHX-STQMWFEESA-N 0 3 286.778 2.886 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](O)[C@@H](C)C2)c([O-])c1 ZINC001236782878 778933418 /nfs/dbraw/zinc/93/34/18/778933418.db2.gz GGASGXJDLJGZHE-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c([O-])c1 ZINC001236782878 778933420 /nfs/dbraw/zinc/93/34/20/778933420.db2.gz GGASGXJDLJGZHE-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236786624 778935173 /nfs/dbraw/zinc/93/51/73/778935173.db2.gz DDAVSYJFNBNFDR-UKRRQHHQSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236786624 778935177 /nfs/dbraw/zinc/93/51/77/778935177.db2.gz DDAVSYJFNBNFDR-UKRRQHHQSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(N3CC(F)C3)CC2)c([O-])c1 ZINC001236789621 778937194 /nfs/dbraw/zinc/93/71/94/778937194.db2.gz BUZGQJLFCCTSRY-UHFFFAOYSA-N 0 3 292.398 2.573 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@]3(CCO3)C2)c([O-])c1 ZINC001236787259 778937672 /nfs/dbraw/zinc/93/76/72/778937672.db2.gz AQOSAWIKTOJPNT-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@]3(CCO3)C2)c([O-])c1 ZINC001236787259 778937677 /nfs/dbraw/zinc/93/76/77/778937677.db2.gz AQOSAWIKTOJPNT-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCc3c(cc[nH]c3=O)C2)c([O-])c1 ZINC001236792308 778938461 /nfs/dbraw/zinc/93/84/61/778938461.db2.gz OOYYJAUDIXKDHQ-UHFFFAOYSA-N 0 3 284.359 2.614 20 10 CFCDHN CCc1ccc(C[N@H+]2CCc3c(cc[nH]c3=O)C2)c([O-])c1 ZINC001236792308 778938465 /nfs/dbraw/zinc/93/84/65/778938465.db2.gz OOYYJAUDIXKDHQ-UHFFFAOYSA-N 0 3 284.359 2.614 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001236793831 778938489 /nfs/dbraw/zinc/93/84/89/778938489.db2.gz FPMMXQXXVOQFJX-CQSZACIVSA-N 0 3 261.365 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001236793831 778938492 /nfs/dbraw/zinc/93/84/92/778938492.db2.gz FPMMXQXXVOQFJX-CQSZACIVSA-N 0 3 261.365 2.756 20 10 CFCDHN COc1cc(C)c(CN2CC[C@@H](C)[C@H](F)C2)c(O)c1 ZINC001236808034 778949509 /nfs/dbraw/zinc/94/95/09/778949509.db2.gz KQTGCAPAQIWKHI-QMTHXVAHSA-N 0 3 267.344 2.889 20 10 CFCDHN COc1cc(C)c(CN2CC3(C2)CC(F)(F)C3)c(O)c1 ZINC001236817187 778951869 /nfs/dbraw/zinc/95/18/69/778951869.db2.gz DUFHJGQDWBWFCJ-UHFFFAOYSA-N 0 3 283.318 2.940 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827126 778955054 /nfs/dbraw/zinc/95/50/54/778955054.db2.gz PPAFDCKRWMSBBL-DOMZBBRYSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236827126 778955060 /nfs/dbraw/zinc/95/50/60/778955060.db2.gz PPAFDCKRWMSBBL-DOMZBBRYSA-N 0 3 271.360 2.748 20 10 CFCDHN COC(=O)[C@H]1CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236825728 778955137 /nfs/dbraw/zinc/95/51/37/778955137.db2.gz FAYXLGDUBFSFBK-HNNXBMFYSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@H]1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236825728 778955141 /nfs/dbraw/zinc/95/51/41/778955141.db2.gz FAYXLGDUBFSFBK-HNNXBMFYSA-N 0 3 299.370 2.930 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@@H](O)[C@@H](F)CC1 ZINC001236827542 778956593 /nfs/dbraw/zinc/95/65/93/778956593.db2.gz UYUCORUMYQTNNI-JKSUJKDBSA-N 0 3 289.350 2.840 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@@H](O)[C@@H](F)CC1 ZINC001236827542 778956594 /nfs/dbraw/zinc/95/65/94/778956594.db2.gz UYUCORUMYQTNNI-JKSUJKDBSA-N 0 3 289.350 2.840 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCN2CCC1CC2 ZINC001236831047 778958116 /nfs/dbraw/zinc/95/81/16/778958116.db2.gz DRFVCHXHJBTKQM-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCN2CCC1CC2 ZINC001236831047 778958119 /nfs/dbraw/zinc/95/81/19/778958119.db2.gz DRFVCHXHJBTKQM-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3=O)c([O-])c1 ZINC001237047995 778998939 /nfs/dbraw/zinc/99/89/39/778998939.db2.gz BKAHGTSDXYFOSC-GASCZTMLSA-N 0 3 273.376 2.927 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3=O)c([O-])c1 ZINC001237047995 778998944 /nfs/dbraw/zinc/99/89/44/778998944.db2.gz BKAHGTSDXYFOSC-GASCZTMLSA-N 0 3 273.376 2.927 20 10 CFCDHN C[N@H+](Cc1ccc(OCC(F)(F)F)cc1[O-])C1CC1 ZINC001237053431 779000026 /nfs/dbraw/zinc/00/00/26/779000026.db2.gz LETPMULKSPVAJC-UHFFFAOYSA-N 0 3 275.270 2.928 20 10 CFCDHN C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1[O-])C1CC1 ZINC001237053431 779000031 /nfs/dbraw/zinc/00/00/31/779000031.db2.gz LETPMULKSPVAJC-UHFFFAOYSA-N 0 3 275.270 2.928 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)C[C@@H]2C)c([O-])c1 ZINC001237050210 779000076 /nfs/dbraw/zinc/00/00/76/779000076.db2.gz YYVJJPHOIOFFOA-SWLSCSKDSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)C[C@@H]2C)c([O-])c1 ZINC001237050210 779000079 /nfs/dbraw/zinc/00/00/79/779000079.db2.gz YYVJJPHOIOFFOA-SWLSCSKDSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c([O-])c1 ZINC001237050211 779000092 /nfs/dbraw/zinc/00/00/92/779000092.db2.gz YYVJJPHOIOFFOA-WFASDCNBSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2C)c([O-])c1 ZINC001237050211 779000099 /nfs/dbraw/zinc/00/00/99/779000099.db2.gz YYVJJPHOIOFFOA-WFASDCNBSA-N 0 3 263.381 2.861 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001237050605 779000367 /nfs/dbraw/zinc/00/03/67/779000367.db2.gz SDPUYLSWVJGKRK-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001237050605 779000373 /nfs/dbraw/zinc/00/03/73/779000373.db2.gz SDPUYLSWVJGKRK-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN [O-]c1cc(OCC(F)(F)F)ccc1C[NH+]1CC=CC1 ZINC001237054061 779000892 /nfs/dbraw/zinc/00/08/92/779000892.db2.gz UQYHDMDKWANOKY-UHFFFAOYSA-N 0 3 273.254 2.705 20 10 CFCDHN COC(=O)CC[N@H+](C)Cc1ccc(C(C)C)cc1[O-] ZINC001237054959 779002539 /nfs/dbraw/zinc/00/25/39/779002539.db2.gz JQZRAASUWGLKEV-UHFFFAOYSA-N 0 3 265.353 2.511 20 10 CFCDHN COC(=O)CC[N@@H+](C)Cc1ccc(C(C)C)cc1[O-] ZINC001237054959 779002542 /nfs/dbraw/zinc/00/25/42/779002542.db2.gz JQZRAASUWGLKEV-UHFFFAOYSA-N 0 3 265.353 2.511 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237405482 779099163 /nfs/dbraw/zinc/09/91/63/779099163.db2.gz QTADSORATFSDOU-BXUZGUMPSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC001237482532 779117730 /nfs/dbraw/zinc/11/77/30/779117730.db2.gz LKWYRIQUMAEUPI-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC001237482532 779117733 /nfs/dbraw/zinc/11/77/33/779117733.db2.gz LKWYRIQUMAEUPI-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237686854 779160880 /nfs/dbraw/zinc/16/08/80/779160880.db2.gz QJGLBYXEVTVYFW-NSHDSACASA-N 0 3 297.782 2.739 20 10 CFCDHN CCOC(=O)[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237686854 779160882 /nfs/dbraw/zinc/16/08/82/779160882.db2.gz QJGLBYXEVTVYFW-NSHDSACASA-N 0 3 297.782 2.739 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC(N3CCCC3)C2)c1O ZINC001237686332 779161729 /nfs/dbraw/zinc/16/17/29/779161729.db2.gz HVOKRVKRSZTGDE-UHFFFAOYSA-N 0 3 280.799 2.634 20 10 CFCDHN C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1cccc(O)c1[O-] ZINC001168465900 779219573 /nfs/dbraw/zinc/21/95/73/779219573.db2.gz ZQBJLLHJHINGCR-NSHDSACASA-N 0 3 275.323 2.958 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC001238055779 779241059 /nfs/dbraw/zinc/24/10/59/779241059.db2.gz DFSPKWMXGHESPX-IUODEOHRSA-N 0 3 279.355 2.841 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1[O-] ZINC001238055779 779241063 /nfs/dbraw/zinc/24/10/63/779241063.db2.gz DFSPKWMXGHESPX-IUODEOHRSA-N 0 3 279.355 2.841 20 10 CFCDHN COCC[N@H+](Cc1cc(F)cc(C)c1[O-])C(C)C ZINC001238061375 779242059 /nfs/dbraw/zinc/24/20/59/779242059.db2.gz HHHFGUYADZRFTN-UHFFFAOYSA-N 0 3 255.333 2.697 20 10 CFCDHN COCC[N@@H+](Cc1cc(F)cc(C)c1[O-])C(C)C ZINC001238061375 779242063 /nfs/dbraw/zinc/24/20/63/779242063.db2.gz HHHFGUYADZRFTN-UHFFFAOYSA-N 0 3 255.333 2.697 20 10 CFCDHN CCOC(=O)C1CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238063952 779242906 /nfs/dbraw/zinc/24/29/06/779242906.db2.gz NBLHAFHFLRQGFB-UHFFFAOYSA-N 0 3 295.354 2.615 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001238059442 779243214 /nfs/dbraw/zinc/24/32/14/779243214.db2.gz CUCNUNKKMZOPIR-MLGOLLRUSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(O)[C@H](C)C2)c1[O-] ZINC001238059442 779243217 /nfs/dbraw/zinc/24/32/17/779243217.db2.gz CUCNUNKKMZOPIR-MLGOLLRUSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC(n3cccn3)CC2)c1[O-] ZINC001238065802 779243751 /nfs/dbraw/zinc/24/37/51/779243751.db2.gz BEUOIPUNRYCQBP-UHFFFAOYSA-N 0 3 289.354 2.873 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@]3(CCCO3)C2)c1[O-] ZINC001238065282 779244516 /nfs/dbraw/zinc/24/45/16/779244516.db2.gz SWNVLGXFFTXIIL-HNNXBMFYSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@]3(CCCO3)C2)c1[O-] ZINC001238065282 779244519 /nfs/dbraw/zinc/24/45/19/779244519.db2.gz SWNVLGXFFTXIIL-HNNXBMFYSA-N 0 3 265.328 2.595 20 10 CFCDHN Cc1cc([O-])c(CN2CCCC3(C[NH2+]C3)C2)cc1Cl ZINC001235713715 779369424 /nfs/dbraw/zinc/36/94/24/779369424.db2.gz NTVFCAGCSZPWPW-UHFFFAOYSA-N 0 3 280.799 2.539 20 10 CFCDHN CC[N@H+](CCn1ccnc1)Cc1c([O-])ccc(F)c1Cl ZINC001237127578 779664417 /nfs/dbraw/zinc/66/44/17/779664417.db2.gz HPKCSWHEGXENDB-UHFFFAOYSA-N 0 3 297.761 2.903 20 10 CFCDHN CC[N@@H+](CCn1ccnc1)Cc1c([O-])ccc(F)c1Cl ZINC001237127578 779664420 /nfs/dbraw/zinc/66/44/20/779664420.db2.gz HPKCSWHEGXENDB-UHFFFAOYSA-N 0 3 297.761 2.903 20 10 CFCDHN CC1(O)CCC([NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000703544499 781027425 /nfs/dbraw/zinc/02/74/25/781027425.db2.gz OTTKAPCKZIOFFO-MFOWVQHXSA-N 0 3 261.365 2.663 20 10 CFCDHN CCc1cccc(CN2CCOC[C@]2(C)CC)c1O ZINC000707696056 781260824 /nfs/dbraw/zinc/26/08/24/781260824.db2.gz ZEUHAGWXUNSBAV-INIZCTEOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1cccc(C[NH2+]CC(C)(C)C[C@@H](C)O)c1[O-] ZINC000709430819 781310787 /nfs/dbraw/zinc/31/07/87/781310787.db2.gz KNZKYNDOVJKWSR-GFCCVEGCSA-N 0 3 265.397 2.841 20 10 CFCDHN COC(C)(C)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000711884844 781485724 /nfs/dbraw/zinc/48/57/24/781485724.db2.gz ACKHTMDBWLHHND-JTQLQIEISA-N 0 3 255.333 2.997 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)CCCCO)c1[O-] ZINC000295012774 199299860 /nfs/dbraw/zinc/29/98/60/199299860.db2.gz JQVIBMBWOCGUTA-NSHDSACASA-N 0 3 271.788 2.995 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@H](O)[C@@H]2C)c([O-])c1 ZINC000295029957 199308392 /nfs/dbraw/zinc/30/83/92/199308392.db2.gz NWKXTVOZMBPBEM-WFASDCNBSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@H](O)[C@@H]2C)c([O-])c1 ZINC000295029957 199308394 /nfs/dbraw/zinc/30/83/94/199308394.db2.gz NWKXTVOZMBPBEM-WFASDCNBSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)CC(C)(C)O)c1[O-] ZINC000295077230 199333049 /nfs/dbraw/zinc/33/30/49/199333049.db2.gz PWSGGMWQWHYINH-SNVBAGLBSA-N 0 3 271.788 2.993 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)CCCCO)c1[O-] ZINC000295137155 199365750 /nfs/dbraw/zinc/36/57/50/199365750.db2.gz YXRNADMJPXHBBY-JTQLQIEISA-N 0 3 287.787 2.695 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@@H]3CCC[C@@H]32)cc1C ZINC000057100723 346619406 /nfs/dbraw/zinc/61/94/06/346619406.db2.gz FMXOGUNQSOYNAC-GOEBONIOSA-N 0 3 261.365 2.762 20 10 CFCDHN COc1ccc(N2CCCN(Cc3cccnc3)CC2)cc1 ZINC000077234945 347179295 /nfs/dbraw/zinc/17/92/95/347179295.db2.gz GRKNEVPFJPJYMA-UHFFFAOYSA-N 0 3 297.402 2.803 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC(C)(C)CO)c1[O-] ZINC000294826710 348363491 /nfs/dbraw/zinc/36/34/91/348363491.db2.gz PNAHDWUYHGOBHJ-UHFFFAOYSA-N 0 3 287.787 2.552 20 10 CFCDHN CN(CCO)Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000294538199 199077119 /nfs/dbraw/zinc/07/71/19/199077119.db2.gz IDMDMLCWXSUHDS-UHFFFAOYSA-N 0 3 290.432 2.809 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)CCCO)c1ccccc1[O-] ZINC000294759329 199170307 /nfs/dbraw/zinc/17/03/07/199170307.db2.gz IXADLFUUGAASEP-TZMCWYRMSA-N 0 3 251.370 2.842 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CC(C)(C)CO)c([O-])c1 ZINC000294756222 199167515 /nfs/dbraw/zinc/16/75/15/199167515.db2.gz IQJGDXYZRMQVGD-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CC(C)(C)CO)c([O-])c1 ZINC000294756222 199167517 /nfs/dbraw/zinc/16/75/17/199167517.db2.gz IQJGDXYZRMQVGD-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC(C)(C)CO)c1[O-] ZINC000294754773 199167811 /nfs/dbraw/zinc/16/78/11/199167811.db2.gz IMOIWDLYSJHBKX-UHFFFAOYSA-N 0 3 271.788 2.852 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CCCO)c([O-])c1 ZINC000296440753 199893059 /nfs/dbraw/zinc/89/30/59/199893059.db2.gz MGZKXJCQKZLYML-STQMWFEESA-N 0 3 251.370 2.760 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296753489 199985611 /nfs/dbraw/zinc/98/56/11/199985611.db2.gz JUNIILVHZQPWBT-CYBMUJFWSA-N 0 3 263.381 2.768 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)Cc1ccccc1)CC2 ZINC000297161748 200102243 /nfs/dbraw/zinc/10/22/43/200102243.db2.gz CWGCZJCPVDDQAP-HZPDHXFCSA-N 0 3 283.371 2.573 20 10 CFCDHN CC(C)(CCCO)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297076562 200078916 /nfs/dbraw/zinc/07/89/16/200078916.db2.gz WOBVOJJTWAFJEF-CYBMUJFWSA-N 0 3 263.381 2.768 20 10 CFCDHN CCOc1cccc(CN2CC(C)(CCOC)C2)c1O ZINC000297466728 200200714 /nfs/dbraw/zinc/20/07/14/200200714.db2.gz SBGZBDSKSKCYRN-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CO)c1ccccc1)CC2 ZINC000297568325 200230352 /nfs/dbraw/zinc/23/03/52/200230352.db2.gz GLKHEWCDAQDPET-LSDHHAIUSA-N 0 3 269.344 2.703 20 10 CFCDHN CC(C)(CO)CCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297818122 200286728 /nfs/dbraw/zinc/28/67/28/200286728.db2.gz RGDLOINAHVQBCY-ZDUSSCGKSA-N 0 3 263.381 2.768 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](CO)c1ccccc1)CC2 ZINC000297938616 200306616 /nfs/dbraw/zinc/30/66/16/200306616.db2.gz YAPIVFRMFGDQSH-HZPDHXFCSA-N 0 3 283.371 2.745 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCN1CC)c1ccccc1[O-] ZINC000019960441 372216085 /nfs/dbraw/zinc/21/60/85/372216085.db2.gz QKHDDYWIPPPXHV-ZFWWWQNUSA-N 0 3 262.397 2.917 20 10 CFCDHN CC(C)N(CC[NH2+]Cc1ccccc1[O-])C(C)C ZINC000019900996 372203563 /nfs/dbraw/zinc/20/35/63/372203563.db2.gz HMWJZSYRHQPXDA-UHFFFAOYSA-N 0 3 250.386 2.601 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@H]12)c1ccccc1[O-] ZINC000036996987 372624805 /nfs/dbraw/zinc/62/48/05/372624805.db2.gz BPYFCLXCAUKXSE-AEGPPILISA-N 0 3 260.381 2.670 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000038014011 372768197 /nfs/dbraw/zinc/76/81/97/372768197.db2.gz JLFAFHFXZNIKRF-CHWSQXEVSA-N 0 3 278.396 2.656 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000038014010 372768498 /nfs/dbraw/zinc/76/84/98/372768498.db2.gz JLFAFHFXZNIKRF-STQMWFEESA-N 0 3 278.396 2.656 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCCCO2)c1 ZINC000042812487 372958383 /nfs/dbraw/zinc/95/83/83/372958383.db2.gz KZXZODTWLCKMKH-WCQYABFASA-N 0 3 265.353 2.621 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCCOC(C)C)c1[O-] ZINC000076274280 374543610 /nfs/dbraw/zinc/54/36/10/374543610.db2.gz GCRUPUGCAGDQOM-UHFFFAOYSA-N 0 3 287.787 2.959 20 10 CFCDHN Cc1cccc(CN[C@@H](CO)c2ccccc2)c1O ZINC000083421629 374744398 /nfs/dbraw/zinc/74/43/98/374744398.db2.gz LNVPQVOJAZOLPU-HNNXBMFYSA-N 0 3 257.333 2.524 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000089726079 374942003 /nfs/dbraw/zinc/94/20/03/374942003.db2.gz ZVKKIFVFPKVBAM-CQSZACIVSA-N 0 3 279.380 2.837 20 10 CFCDHN CCC[N@H+](Cc1cn(C)nc1C)Cc1ccccc1[O-] ZINC000092704950 375139569 /nfs/dbraw/zinc/13/95/69/375139569.db2.gz MYMDGJXVOOERLO-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN CCC[N@@H+](Cc1cn(C)nc1C)Cc1ccccc1[O-] ZINC000092704950 375139574 /nfs/dbraw/zinc/13/95/74/375139574.db2.gz MYMDGJXVOOERLO-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN COc1ccc2c(c1)CN(Cc1cccc(OC)c1O)CC2 ZINC000092507704 375117505 /nfs/dbraw/zinc/11/75/05/375117505.db2.gz QADGMNVLHKSJMC-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000093609808 375271937 /nfs/dbraw/zinc/27/19/37/375271937.db2.gz ULRREWDOIPWLCL-WQVCFCJDSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000093609808 375271940 /nfs/dbraw/zinc/27/19/40/375271940.db2.gz ULRREWDOIPWLCL-WQVCFCJDSA-N 0 3 291.391 2.646 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](O)C(CC)CC)c1[O-] ZINC000111404446 375844801 /nfs/dbraw/zinc/84/48/01/375844801.db2.gz LSFCDDKKIYHUJI-CQSZACIVSA-N 0 3 281.396 2.678 20 10 CFCDHN CS[C@@H]1CCC[C@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000117394442 376241225 /nfs/dbraw/zinc/24/12/25/376241225.db2.gz RCACWVLSQUYYDH-NWDGAFQWSA-N 0 3 295.404 2.885 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC000121266557 376794043 /nfs/dbraw/zinc/79/40/43/376794043.db2.gz PDTLEFSYXBZGSP-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC000121266557 376794048 /nfs/dbraw/zinc/79/40/48/376794048.db2.gz PDTLEFSYXBZGSP-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H]2CCSC2)cc1C ZINC000125143904 377121076 /nfs/dbraw/zinc/12/10/76/377121076.db2.gz NTOODMADOBRFAA-CYBMUJFWSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H]2CCSC2)cc1C ZINC000125143904 377121088 /nfs/dbraw/zinc/12/10/88/377121088.db2.gz NTOODMADOBRFAA-CYBMUJFWSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H]2CCSC2)cc1C ZINC000125144140 377122403 /nfs/dbraw/zinc/12/24/03/377122403.db2.gz NTOODMADOBRFAA-ZDUSSCGKSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H]2CCSC2)cc1C ZINC000125144140 377122411 /nfs/dbraw/zinc/12/24/11/377122411.db2.gz NTOODMADOBRFAA-ZDUSSCGKSA-N 0 3 251.395 2.946 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000124712687 377079394 /nfs/dbraw/zinc/07/93/94/377079394.db2.gz PMXMBPVGVNZNBF-QWHCGFSZSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000124712687 377079395 /nfs/dbraw/zinc/07/93/95/377079395.db2.gz PMXMBPVGVNZNBF-QWHCGFSZSA-N 0 3 280.799 2.762 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2cc(C)c(C)cc2[O-])C1 ZINC000125729811 377187524 /nfs/dbraw/zinc/18/75/24/377187524.db2.gz OKRMDFHAGDFCQA-HIFRSBDPSA-N 0 3 291.391 2.830 20 10 CFCDHN CN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCOC1 ZINC000132035848 377793975 /nfs/dbraw/zinc/79/39/75/377793975.db2.gz BIJPHVYZNSOHAL-KRWDZBQOSA-N 0 3 274.408 2.898 20 10 CFCDHN COc1cc(C[NH2+]Cc2ccccc2[O-])cc(OC)c1 ZINC000133891450 377966079 /nfs/dbraw/zinc/96/60/79/377966079.db2.gz ODEVVJJFSISOCT-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCF)C[C@H]1CCCO1 ZINC000137266636 378222236 /nfs/dbraw/zinc/22/22/36/378222236.db2.gz ODNOBKJDWJTFHA-CQSZACIVSA-N 0 3 267.344 2.733 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCF)C[C@H]1CCCO1 ZINC000137266636 378222243 /nfs/dbraw/zinc/22/22/43/378222243.db2.gz ODNOBKJDWJTFHA-CQSZACIVSA-N 0 3 267.344 2.733 20 10 CFCDHN CC[C@@H]([NH2+]C1CCN(CCOC)CC1)c1ccccc1[O-] ZINC000155317368 378622423 /nfs/dbraw/zinc/62/24/23/378622423.db2.gz HWFHPINEBNDGKD-MRXNPFEDSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1ccc(O)c(CN2CC(Cc3ccco3)C2)c1 ZINC000529649260 383741802 /nfs/dbraw/zinc/74/18/02/383741802.db2.gz PFGOWTWPQICNAE-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN CSCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000176798505 380274133 /nfs/dbraw/zinc/27/41/33/380274133.db2.gz HKQMGNWBEDQAHY-AWEZNQCLSA-N 0 3 281.421 2.736 20 10 CFCDHN CSCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000176798505 380274138 /nfs/dbraw/zinc/27/41/38/380274138.db2.gz HKQMGNWBEDQAHY-AWEZNQCLSA-N 0 3 281.421 2.736 20 10 CFCDHN C[C@@H]([N@H+](C)Cc1cc2c(cc1[O-])OCO2)C1(C)CC1 ZINC000176834390 380277300 /nfs/dbraw/zinc/27/73/00/380277300.db2.gz SPOBEOQRGGXMPV-SNVBAGLBSA-N 0 3 263.337 2.741 20 10 CFCDHN C[C@@H]([N@@H+](C)Cc1cc2c(cc1[O-])OCO2)C1(C)CC1 ZINC000176834390 380277304 /nfs/dbraw/zinc/27/73/04/380277304.db2.gz SPOBEOQRGGXMPV-SNVBAGLBSA-N 0 3 263.337 2.741 20 10 CFCDHN Cc1cccc(C[N@H+](C[C@H]2CCOC2)C2CC2)c1[O-] ZINC000179678432 380570107 /nfs/dbraw/zinc/57/01/07/380570107.db2.gz XPHINFICBKRAQP-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c1[O-] ZINC000179678432 380570114 /nfs/dbraw/zinc/57/01/14/380570114.db2.gz XPHINFICBKRAQP-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000180206275 380634592 /nfs/dbraw/zinc/63/45/92/380634592.db2.gz SNTBMRHLPZGBMI-OAHLLOKOSA-N 0 3 288.322 2.580 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000180206275 380634600 /nfs/dbraw/zinc/63/46/00/380634600.db2.gz SNTBMRHLPZGBMI-OAHLLOKOSA-N 0 3 288.322 2.580 20 10 CFCDHN CCOC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180158947 380626535 /nfs/dbraw/zinc/62/65/35/380626535.db2.gz BJFOCRIEHDGYNN-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN CCOC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000180158947 380626539 /nfs/dbraw/zinc/62/65/39/380626539.db2.gz BJFOCRIEHDGYNN-GFCCVEGCSA-N 0 3 267.344 2.780 20 10 CFCDHN C[N@H+](CCC1CCOCC1)Cc1cc(F)ccc1[O-] ZINC000180186425 380629404 /nfs/dbraw/zinc/62/94/04/380629404.db2.gz GDJIZSNRMRCJFZ-UHFFFAOYSA-N 0 3 267.344 2.780 20 10 CFCDHN C[N@@H+](CCC1CCOCC1)Cc1cc(F)ccc1[O-] ZINC000180186425 380629407 /nfs/dbraw/zinc/62/94/07/380629407.db2.gz GDJIZSNRMRCJFZ-UHFFFAOYSA-N 0 3 267.344 2.780 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H]2CSC)c1 ZINC000180534829 380672482 /nfs/dbraw/zinc/67/24/82/380672482.db2.gz JZSHVHYZBBSQKM-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H]2CSC)c1 ZINC000180534829 380672488 /nfs/dbraw/zinc/67/24/88/380672488.db2.gz JZSHVHYZBBSQKM-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)CCC2CCOCC2)c1 ZINC000180379804 380649398 /nfs/dbraw/zinc/64/93/98/380649398.db2.gz NSGPQECRGQKEFV-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)CCC2CCOCC2)c1 ZINC000180379804 380649402 /nfs/dbraw/zinc/64/94/02/380649402.db2.gz NSGPQECRGQKEFV-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCN1CC[C@@H]([N@H+](C)Cc2cccc(C)c2[O-])[C@H](C)C1 ZINC000180415414 380655570 /nfs/dbraw/zinc/65/55/70/380655570.db2.gz OAEDDICGDOKFFR-GDBMZVCRSA-N 0 3 276.424 2.863 20 10 CFCDHN CCN1CC[C@@H]([N@@H+](C)Cc2cccc(C)c2[O-])[C@H](C)C1 ZINC000180415414 380655574 /nfs/dbraw/zinc/65/55/74/380655574.db2.gz OAEDDICGDOKFFR-GDBMZVCRSA-N 0 3 276.424 2.863 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCOC[C@H]2C)c1 ZINC000287426373 380829562 /nfs/dbraw/zinc/82/95/62/380829562.db2.gz KJYNJJZRGILAFS-FRRDWIJNSA-N 0 3 279.380 2.724 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c1 ZINC000368100901 380924725 /nfs/dbraw/zinc/92/47/25/380924725.db2.gz IXXZJZWVKOKMDQ-NWDGAFQWSA-N 0 3 271.364 2.632 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@@H](C)c2ccccn2)c1 ZINC000182064667 380980899 /nfs/dbraw/zinc/98/08/99/380980899.db2.gz GSFPBECAMGSXQX-LBPRGKRZSA-N 0 3 272.348 2.989 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H]2COc3ccccc32)c1[O-] ZINC000288488309 381013175 /nfs/dbraw/zinc/01/31/75/381013175.db2.gz HAPLRMMFNJJMHU-ZDUSSCGKSA-N 0 3 285.343 2.667 20 10 CFCDHN Cc1nc(CC[NH2+][C@H]2CCc3cccc([O-])c32)cs1 ZINC000295861552 381122112 /nfs/dbraw/zinc/12/21/12/381122112.db2.gz GOBYHUFMOKJPDG-ZDUSSCGKSA-N 0 3 274.389 2.977 20 10 CFCDHN CCC[N@H+](CCCn1ccnc1)Cc1ccccc1[O-] ZINC000182803859 381161011 /nfs/dbraw/zinc/16/10/11/381161011.db2.gz YTZNCBNWJGRNNH-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN CCC[N@@H+](CCCn1ccnc1)Cc1ccccc1[O-] ZINC000182803859 381161016 /nfs/dbraw/zinc/16/10/16/381161016.db2.gz YTZNCBNWJGRNNH-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1[O-] ZINC000183453136 381273444 /nfs/dbraw/zinc/27/34/44/381273444.db2.gz BAGZFNAMLHIIKW-ZIAGYGMSSA-N 0 3 296.370 2.848 20 10 CFCDHN C[C@H]([NH2+][C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1[O-] ZINC000183453152 381273615 /nfs/dbraw/zinc/27/36/15/381273615.db2.gz BAGZFNAMLHIIKW-KBPBESRZSA-N 0 3 296.370 2.848 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CCc2ccncc2)c1 ZINC000183757965 381314957 /nfs/dbraw/zinc/31/49/57/381314957.db2.gz DKEDDWFXIYVDGZ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CCc2ccncc2)c1 ZINC000183757965 381314963 /nfs/dbraw/zinc/31/49/63/381314963.db2.gz DKEDDWFXIYVDGZ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN C[C@@H]([NH2+]CCC(C)(C)CO)c1cc(F)ccc1[O-] ZINC000296353064 381358032 /nfs/dbraw/zinc/35/80/32/381358032.db2.gz IKLHBVHBEQBPEF-SNVBAGLBSA-N 0 3 255.333 2.591 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@@H](C)C[S@](C)=O)cc1 ZINC000184290178 381397178 /nfs/dbraw/zinc/39/71/78/381397178.db2.gz HHEWJZLWTMGKGN-QUJCMNEKSA-N 0 3 282.453 2.560 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCC(C)(C)CO)c1 ZINC000296440581 381397823 /nfs/dbraw/zinc/39/78/23/381397823.db2.gz MGKPKJJGHYBBTG-GFCCVEGCSA-N 0 3 251.370 2.760 20 10 CFCDHN CCCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000185112315 381537198 /nfs/dbraw/zinc/53/71/98/381537198.db2.gz CFWUYZLINZKXLJ-STQMWFEESA-N 0 3 280.387 2.914 20 10 CFCDHN CC1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000297005478 381548548 /nfs/dbraw/zinc/54/85/48/381548548.db2.gz SWKYZFZNQIZKPB-ZDUSSCGKSA-N 0 3 261.365 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCc1ccccn1)CC2 ZINC000297103606 381551773 /nfs/dbraw/zinc/55/17/73/381551773.db2.gz XTHKOMXTLCCPFV-OAHLLOKOSA-N 0 3 268.360 2.997 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCN(c3ccccn3)C1)CC2 ZINC000297144848 381553639 /nfs/dbraw/zinc/55/36/39/381553639.db2.gz ZRLPZHHHYPYUFT-CABCVRRESA-N 0 3 295.386 2.643 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c1 ZINC000185368776 381613339 /nfs/dbraw/zinc/61/33/39/381613339.db2.gz URCWCPYHCQKPPN-NWDGAFQWSA-N 0 3 278.396 2.534 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000185370571 381614719 /nfs/dbraw/zinc/61/47/19/381614719.db2.gz XPGYNTNBHNHVDZ-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@@H]2Cn2cccn2)c1[O-] ZINC000371426324 381623617 /nfs/dbraw/zinc/62/36/17/381623617.db2.gz PHAMHNFWKKLTNN-MRXNPFEDSA-N 0 3 285.391 2.952 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@@H]2Cn2cccn2)c1[O-] ZINC000371426324 381623623 /nfs/dbraw/zinc/62/36/23/381623623.db2.gz PHAMHNFWKKLTNN-MRXNPFEDSA-N 0 3 285.391 2.952 20 10 CFCDHN CC[C@@H](C)[C@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185439499 381632788 /nfs/dbraw/zinc/63/27/88/381632788.db2.gz ODQNKYGDVUFTLX-ISTVAULSSA-N 0 3 255.333 2.589 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000185534523 381660099 /nfs/dbraw/zinc/66/00/99/381660099.db2.gz WNDMTYPBJJYHHM-LVLWZLKYSA-N 0 3 291.391 2.865 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCC(C)(C)CO)c1 ZINC000185537331 381660167 /nfs/dbraw/zinc/66/01/67/381660167.db2.gz PNAMLWVENNVIBV-LBPRGKRZSA-N 0 3 281.396 2.850 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c1 ZINC000185736006 381719632 /nfs/dbraw/zinc/71/96/32/381719632.db2.gz MMIYNRXJHBUQBX-UPJWGTAASA-N 0 3 279.380 2.603 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCc3n[nH]cc3C2)c1 ZINC000186114971 381826963 /nfs/dbraw/zinc/82/69/63/381826963.db2.gz WIGPCWXEPXEZLR-WCQYABFASA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])[nH]n1 ZINC000186131661 381830120 /nfs/dbraw/zinc/83/01/20/381830120.db2.gz ZBPPQMHBZPDLPM-MWLCHTKSSA-N 0 3 277.343 2.845 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])n[nH]1 ZINC000186131661 381830124 /nfs/dbraw/zinc/83/01/24/381830124.db2.gz ZBPPQMHBZPDLPM-MWLCHTKSSA-N 0 3 277.343 2.845 20 10 CFCDHN C[N@@H+]1CC[C@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000292865142 381872788 /nfs/dbraw/zinc/87/27/88/381872788.db2.gz VRSOUTMLYOPBFF-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000292865142 381872790 /nfs/dbraw/zinc/87/27/90/381872790.db2.gz VRSOUTMLYOPBFF-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000373229276 381955732 /nfs/dbraw/zinc/95/57/32/381955732.db2.gz PXFYPCLAIWRBRO-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000373229276 381955736 /nfs/dbraw/zinc/95/57/36/381955736.db2.gz PXFYPCLAIWRBRO-LBPRGKRZSA-N 0 3 273.332 2.983 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](n3cccn3)C2)c1[O-] ZINC000373220243 381953467 /nfs/dbraw/zinc/95/34/67/381953467.db2.gz ZDJROJGWXXGIFX-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](n3cccn3)C2)c1[O-] ZINC000373220243 381953476 /nfs/dbraw/zinc/95/34/76/381953476.db2.gz ZDJROJGWXXGIFX-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC([C@H]3CCOC3)CC2)c1 ZINC000374931882 382061308 /nfs/dbraw/zinc/06/13/08/382061308.db2.gz PLRNLXDQHUOFQK-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN COc1cccc(CN2CCC[C@@H](OCC3CC3)C2)c1O ZINC000373530261 382018326 /nfs/dbraw/zinc/01/83/26/382018326.db2.gz AFTCNLCREYEKES-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1[O-] ZINC000373530261 382018329 /nfs/dbraw/zinc/01/83/29/382018329.db2.gz AFTCNLCREYEKES-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1[O-] ZINC000373530261 382018331 /nfs/dbraw/zinc/01/83/31/382018331.db2.gz AFTCNLCREYEKES-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1(C2CC2)CCOCC1 ZINC000376381794 382132595 /nfs/dbraw/zinc/13/25/95/382132595.db2.gz BNQRESIPVWQTJQ-UHFFFAOYSA-N 0 3 265.328 2.580 20 10 CFCDHN Cc1cc(O)c(CNCc2cnc3n2CCCC3)cc1C ZINC000376765863 382173173 /nfs/dbraw/zinc/17/31/73/382173173.db2.gz BRVLKAQATCWNPJ-UHFFFAOYSA-N 0 3 285.391 2.832 20 10 CFCDHN Cc1cc(Cl)cc(CN(C)[C@H](C)C[S@](C)=O)c1O ZINC000187828758 382279197 /nfs/dbraw/zinc/27/91/97/382279197.db2.gz FSUFVVHBEMOGCX-MGNBDDOMSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])C2 ZINC000363854652 382248939 /nfs/dbraw/zinc/24/89/39/382248939.db2.gz MLHJXMVRKLOKQX-ZIAGYGMSSA-N 0 3 285.391 2.871 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2cc(OC)ccc2[O-])C1 ZINC000187978664 382314902 /nfs/dbraw/zinc/31/49/02/382314902.db2.gz MNRDKQMAORYKMS-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCOC(C)(C)C2)c1[O-] ZINC000378348754 382444684 /nfs/dbraw/zinc/44/46/84/382444684.db2.gz ZPIMUXZAUYBZOQ-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCOC(C)(C)C2)c1[O-] ZINC000378348754 382444686 /nfs/dbraw/zinc/44/46/86/382444686.db2.gz ZPIMUXZAUYBZOQ-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@H+](Cc3cc(C)ccc3[O-])C2)no1 ZINC000378351307 382446668 /nfs/dbraw/zinc/44/66/68/382446668.db2.gz STNHWVGYBPVKCO-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nc([C@@H]2CCC[N@@H+](Cc3cc(C)ccc3[O-])C2)no1 ZINC000378351307 382446674 /nfs/dbraw/zinc/44/66/74/382446674.db2.gz STNHWVGYBPVKCO-CYBMUJFWSA-N 0 3 287.363 2.772 20 10 CFCDHN CCOc1cccc(CN2CCC[C@H]3OCC[C@H]32)c1O ZINC000366266853 382494836 /nfs/dbraw/zinc/49/48/36/382494836.db2.gz IOZREKKOAUADBJ-ZIAGYGMSSA-N 0 3 277.364 2.544 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cccc(OC)c1[O-])OC ZINC000294241781 382474965 /nfs/dbraw/zinc/47/49/65/382474965.db2.gz PGEJEHKGYVDSEP-SMDDNHRTSA-N 0 3 267.369 2.552 20 10 CFCDHN CCCN(Cc1ccnc(OC)n1)Cc1ccccc1O ZINC000294965309 382555168 /nfs/dbraw/zinc/55/51/68/382555168.db2.gz WLRGNWZWJDNLRI-UHFFFAOYSA-N 0 3 287.363 2.603 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)[C@](C)(C(=O)OC)C1 ZINC000367317559 382564384 /nfs/dbraw/zinc/56/43/84/382564384.db2.gz LKGVSVNBNVNLIA-HACGYAERSA-N 0 3 291.391 2.974 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)[C@](C)(C(=O)OC)C1 ZINC000367317559 382564391 /nfs/dbraw/zinc/56/43/91/382564391.db2.gz LKGVSVNBNVNLIA-HACGYAERSA-N 0 3 291.391 2.974 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CC(C)(C)O)C2CC2)c1 ZINC000189946009 382646510 /nfs/dbraw/zinc/64/65/10/382646510.db2.gz BWBCOTQLIOVTRI-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CC(C)(C)O)C2CC2)c1 ZINC000189946009 382646512 /nfs/dbraw/zinc/64/65/12/382646512.db2.gz BWBCOTQLIOVTRI-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCC(=O)CC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000190294552 382661034 /nfs/dbraw/zinc/66/10/34/382661034.db2.gz HHIKRQCEDZDELY-INIZCTEOSA-N 0 3 291.391 2.742 20 10 CFCDHN CCC(=O)CC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000190294552 382661035 /nfs/dbraw/zinc/66/10/35/382661035.db2.gz HHIKRQCEDZDELY-INIZCTEOSA-N 0 3 291.391 2.742 20 10 CFCDHN COC(=O)c1ccc(CNCc2ccc(N(C)C)cc2)cc1 ZINC000237226568 382954041 /nfs/dbraw/zinc/95/40/41/382954041.db2.gz JDELSRBEAKSNSD-UHFFFAOYSA-N 0 3 298.386 2.829 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c([O-])c1 ZINC000249577689 383351698 /nfs/dbraw/zinc/35/16/98/383351698.db2.gz AKWQWURUGGNZMA-DCDXPUDHSA-N 0 3 261.365 2.919 20 10 CFCDHN CC[C@H](NC[C@@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000268825494 384670572 /nfs/dbraw/zinc/67/05/72/384670572.db2.gz IZUPQKIEDYGREB-QWHCGFSZSA-N 0 3 290.329 2.717 20 10 CFCDHN CC[C@@H](NC[C@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000268825493 384670674 /nfs/dbraw/zinc/67/06/74/384670674.db2.gz IZUPQKIEDYGREB-OLZOCXBDSA-N 0 3 290.329 2.717 20 10 CFCDHN CCOc1ccc(O)c(CN[C@H]2CCCc3c[nH]nc32)c1 ZINC000268830067 384671243 /nfs/dbraw/zinc/67/12/43/384671243.db2.gz KCSWCQZLVHQBQY-AWEZNQCLSA-N 0 3 287.363 2.681 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2CCCc3c[nH]nc32)c1 ZINC000268867160 384678908 /nfs/dbraw/zinc/67/89/08/384678908.db2.gz UHFNFYQUAPYNMO-ZDUSSCGKSA-N 0 3 257.337 2.591 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1[O-] ZINC000268970327 384704456 /nfs/dbraw/zinc/70/44/56/384704456.db2.gz MTSXPKYDRDGDKF-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN CN(C)c1ccc(CN(CCn2ccnc2)C2CC2)cc1 ZINC000270697723 385195015 /nfs/dbraw/zinc/19/50/15/385195015.db2.gz ZNHHBBGRIKQKKP-UHFFFAOYSA-N 0 3 284.407 2.614 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c1 ZINC000282390055 385299836 /nfs/dbraw/zinc/29/98/36/385299836.db2.gz RCUUKPCZMPFTOP-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](OC)C[C@H]2C)c1 ZINC000282390055 385299838 /nfs/dbraw/zinc/29/98/38/385299838.db2.gz RCUUKPCZMPFTOP-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN C[C@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000271083468 385332568 /nfs/dbraw/zinc/33/25/68/385332568.db2.gz XVOKEKWCHDIKGY-LBPRGKRZSA-N 0 3 257.333 2.530 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)c1[O-] ZINC000271778621 385391251 /nfs/dbraw/zinc/39/12/51/385391251.db2.gz DAOCRWJDVQOLNJ-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN CCC[N@H+](Cc1cc(OCC)ccc1[O-])CC(C)(C)O ZINC000271174880 385362527 /nfs/dbraw/zinc/36/25/27/385362527.db2.gz SSFAJJYEXMYKOF-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CCC[N@@H+](Cc1cc(OCC)ccc1[O-])CC(C)(C)O ZINC000271174880 385362532 /nfs/dbraw/zinc/36/25/32/385362532.db2.gz SSFAJJYEXMYKOF-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC(O)(CC)CC2)c([O-])c1 ZINC000271200290 385373567 /nfs/dbraw/zinc/37/35/67/385373567.db2.gz PIOQDMOCDFGVAY-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC3(CCOCC3)C2)c1[O-] ZINC000271213945 385378067 /nfs/dbraw/zinc/37/80/67/385378067.db2.gz ZXEMKDUENDVQKN-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC3(CCOCC3)C2)c1[O-] ZINC000271213945 385378069 /nfs/dbraw/zinc/37/80/69/385378069.db2.gz ZXEMKDUENDVQKN-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N(C)C1CCCCC1)c1ccccc1[O-] ZINC000271684063 385387905 /nfs/dbraw/zinc/38/79/05/385387905.db2.gz PZYXTPPDMDDMIJ-ZDUSSCGKSA-N 0 3 290.407 2.834 20 10 CFCDHN COC[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271760704 385391489 /nfs/dbraw/zinc/39/14/89/385391489.db2.gz YLWPQUAUVNLNAG-LLVKDONJSA-N 0 3 269.772 2.822 20 10 CFCDHN COC[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271760704 385391493 /nfs/dbraw/zinc/39/14/93/385391493.db2.gz YLWPQUAUVNLNAG-LLVKDONJSA-N 0 3 269.772 2.822 20 10 CFCDHN C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1[O-] ZINC000282959326 385416360 /nfs/dbraw/zinc/41/63/60/385416360.db2.gz HTGRGEBAUGOOJG-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1[O-] ZINC000282959326 385416363 /nfs/dbraw/zinc/41/63/63/385416363.db2.gz HTGRGEBAUGOOJG-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN Cc1cc(C)cc([C@@H](O)C[NH2+]Cc2ccccc2[O-])c1 ZINC000283129302 385439163 /nfs/dbraw/zinc/43/91/63/385439163.db2.gz ZPNFVYWRXKKIDX-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC2(O)CCC2)c([O-])c1 ZINC000283866839 385509277 /nfs/dbraw/zinc/50/92/77/385509277.db2.gz DZNWHAXZSJSGCH-CYBMUJFWSA-N 0 3 263.381 2.965 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCn2ccnc2)c([O-])c1 ZINC000284197349 385546256 /nfs/dbraw/zinc/54/62/56/385546256.db2.gz RXUYOAFVEICQBR-CYBMUJFWSA-N 0 3 259.353 2.556 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284301649 385547167 /nfs/dbraw/zinc/54/71/67/385547167.db2.gz BPKUHTSWIVBOIC-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284301649 385547169 /nfs/dbraw/zinc/54/71/69/385547169.db2.gz BPKUHTSWIVBOIC-WBVHZDCISA-N 0 3 291.391 2.934 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000272393376 385526739 /nfs/dbraw/zinc/52/67/39/385526739.db2.gz HQSIIBYFWVWQHV-GOEBONIOSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000272393376 385526741 /nfs/dbraw/zinc/52/67/41/385526741.db2.gz HQSIIBYFWVWQHV-GOEBONIOSA-N 0 3 293.407 2.630 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCO[C@@H]2c2cccnc2)c1 ZINC000284883378 385550407 /nfs/dbraw/zinc/55/04/07/385550407.db2.gz GRHDZZHDLHACEW-DOTOQJQBSA-N 0 3 284.359 2.715 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000284996149 385551017 /nfs/dbraw/zinc/55/10/17/385551017.db2.gz JELYYTZCNZKJNT-KBPBESRZSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000284996149 385551020 /nfs/dbraw/zinc/55/10/20/385551020.db2.gz JELYYTZCNZKJNT-KBPBESRZSA-N 0 3 277.364 2.544 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000284980251 385551323 /nfs/dbraw/zinc/55/13/23/385551323.db2.gz IOSCBJPUHFOZTC-UHFFFAOYSA-N 0 3 261.365 2.785 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000285236376 385552876 /nfs/dbraw/zinc/55/28/76/385552876.db2.gz SIKFZEGDUHUGKK-ZFWWWQNUSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000285236376 385552880 /nfs/dbraw/zinc/55/28/80/385552880.db2.gz SIKFZEGDUHUGKK-ZFWWWQNUSA-N 0 3 265.328 2.675 20 10 CFCDHN CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cccc(C)c1[O-] ZINC000285159616 385553017 /nfs/dbraw/zinc/55/30/17/385553017.db2.gz PHHXJUPVZNAIRY-HNNXBMFYSA-N 0 3 290.407 2.581 20 10 CFCDHN CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1[O-] ZINC000285159616 385553024 /nfs/dbraw/zinc/55/30/24/385553024.db2.gz PHHXJUPVZNAIRY-HNNXBMFYSA-N 0 3 290.407 2.581 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccc(F)cc1[O-] ZINC000285680869 385557039 /nfs/dbraw/zinc/55/70/39/385557039.db2.gz NWDFHXHJQDDOIZ-DOMZBBRYSA-N 0 3 280.387 2.914 20 10 CFCDHN COCC[C@@H](NCc1cc(OC)ccc1O)c1ccco1 ZINC000272525929 385558150 /nfs/dbraw/zinc/55/81/50/385558150.db2.gz LYYVJMQBKNCARE-CQSZACIVSA-N 0 3 291.347 2.861 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](O)CCc2ccccc2)c1 ZINC000273184069 385673060 /nfs/dbraw/zinc/67/30/60/385673060.db2.gz YBVHJUKOJIYSFY-KRWDZBQOSA-N 0 3 285.387 2.784 20 10 CFCDHN COC(=O)N1CCC([NH2+][C@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273296538 385675737 /nfs/dbraw/zinc/67/57/37/385675737.db2.gz AGCCUUWTUJEDBO-GFCCVEGCSA-N 0 3 292.379 2.582 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1C ZINC000273306115 385677357 /nfs/dbraw/zinc/67/73/57/385677357.db2.gz CWUBEXZBBXBXBP-CYBMUJFWSA-N 0 3 298.386 2.959 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]Cc2cccn2C)c1 ZINC000273364330 385678296 /nfs/dbraw/zinc/67/82/96/385678296.db2.gz BDXMIIRWERUKNI-NSHDSACASA-N 0 3 260.337 2.590 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccn2C)c1 ZINC000273364330 385678300 /nfs/dbraw/zinc/67/83/00/385678300.db2.gz BDXMIIRWERUKNI-NSHDSACASA-N 0 3 260.337 2.590 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cn2ccnc2)c([O-])c1C ZINC000273375775 385679608 /nfs/dbraw/zinc/67/96/08/385679608.db2.gz HCNUGUDFFZPZDP-TZMCWYRMSA-N 0 3 273.380 2.945 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CN(C3CC3)C[C@H]2C)c([O-])c1 ZINC000273368890 385679749 /nfs/dbraw/zinc/67/97/49/385679749.db2.gz CANHCWJABDTMPK-WWGRRREGSA-N 0 3 274.408 2.834 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCOC1)c1cc2c(cc1[O-])CCCC2 ZINC000273384851 385680908 /nfs/dbraw/zinc/68/09/08/385680908.db2.gz JCRJZLYGDIKXOU-OLZOCXBDSA-N 0 3 275.392 2.958 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(N(C)C)nc1)c1cc(F)ccc1[O-] ZINC000273437675 385683168 /nfs/dbraw/zinc/68/31/68/385683168.db2.gz XPADKGQBANSQHG-NSHDSACASA-N 0 3 289.354 2.843 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c1 ZINC000273460457 385685150 /nfs/dbraw/zinc/68/51/50/385685150.db2.gz IASSKXRXXZJUIK-SKDRFNHKSA-N 0 3 277.286 2.665 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2([C@@H](O)C(C)C)CC2)c1 ZINC000273510291 385685851 /nfs/dbraw/zinc/68/58/51/385685851.db2.gz ROJAZSDBADFFPM-WBMJQRKESA-N 0 3 293.407 2.849 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CC(=O)N(C(C)C)C2)c([O-])c1C ZINC000273497417 385686363 /nfs/dbraw/zinc/68/63/63/385686363.db2.gz PMAHDTMTKLJNDA-ZIAGYGMSSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)N[C@H](C)c2cnn(C)c2)c1 ZINC000273554473 385688262 /nfs/dbraw/zinc/68/82/62/385688262.db2.gz GOPLWFDJIBJUIP-VXGBXAGGSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2)c1 ZINC000273554473 385688264 /nfs/dbraw/zinc/68/82/64/385688264.db2.gz GOPLWFDJIBJUIP-VXGBXAGGSA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)N(C)C)c1cc2c(cc1[O-])CCCC2 ZINC000273568675 385689143 /nfs/dbraw/zinc/68/91/43/385689143.db2.gz KDUSNTFEQWBCEO-QWHCGFSZSA-N 0 3 276.424 2.872 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2O)c([O-])c1C ZINC000273574748 385689300 /nfs/dbraw/zinc/68/93/00/385689300.db2.gz LPLTZFXUXDOQPH-QEJZJMRPSA-N 0 3 263.381 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCNc2ccccn2)c1 ZINC000273582402 385689640 /nfs/dbraw/zinc/68/96/40/385689640.db2.gz MXFRREHPVRNYLE-GFCCVEGCSA-N 0 3 287.363 2.559 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCSCCCO)c([O-])c1C ZINC000273585155 385690164 /nfs/dbraw/zinc/69/01/64/385690164.db2.gz NOSJZRNVBUHCGU-CYBMUJFWSA-N 0 3 283.437 2.775 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C)N(C)C)c([O-])c1C ZINC000273602728 385691722 /nfs/dbraw/zinc/69/17/22/385691722.db2.gz SHWXYHXPNZBABU-YPMHNXCESA-N 0 3 250.386 2.610 20 10 CFCDHN CCC[C@@H](O)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273619987 385692773 /nfs/dbraw/zinc/69/27/73/385692773.db2.gz YSYUZZAPGNKUFQ-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN CN(C)c1ccc(CN[C@@]2(C)CCO[C@H]2C2CC2)cc1F ZINC000273044978 385669904 /nfs/dbraw/zinc/66/99/04/385669904.db2.gz BIOFSGWQARAFEM-IRXDYDNUSA-N 0 3 292.398 2.939 20 10 CFCDHN CN(C)c1ccc(CN[C@]2(C)CCO[C@H]2C2CC2)cc1F ZINC000273044971 385670509 /nfs/dbraw/zinc/67/05/09/385670509.db2.gz BIOFSGWQARAFEM-DLBZAZTESA-N 0 3 292.398 2.939 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CN(C)C)c([O-])c1C ZINC000286895823 385733637 /nfs/dbraw/zinc/73/36/37/385733637.db2.gz DGXVAJMXLVELHO-WCQYABFASA-N 0 3 250.386 2.610 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H](c2nnc[nH]2)C1 ZINC000372598863 393452876 /nfs/dbraw/zinc/45/28/76/393452876.db2.gz IOAGOQJLJHSASC-OCCSQVGLSA-N 0 3 286.379 2.841 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@H](c2nnc[nH]2)C1 ZINC000372598863 393452879 /nfs/dbraw/zinc/45/28/79/393452879.db2.gz IOAGOQJLJHSASC-OCCSQVGLSA-N 0 3 286.379 2.841 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000179944398 393472242 /nfs/dbraw/zinc/47/22/42/393472242.db2.gz GBDGCKYADQDQMD-LLVKDONJSA-N 0 3 275.327 2.634 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000179944398 393472246 /nfs/dbraw/zinc/47/22/46/393472246.db2.gz GBDGCKYADQDQMD-LLVKDONJSA-N 0 3 275.327 2.634 20 10 CFCDHN CN(C)c1ccc(CN2CCCN(C3CC3)CC2)cc1F ZINC000374310237 393492794 /nfs/dbraw/zinc/49/27/94/393492794.db2.gz PFGHMHSDWIMCOA-UHFFFAOYSA-N 0 3 291.414 2.562 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCSC3(CCOCC3)C2)c1 ZINC000186501437 393545970 /nfs/dbraw/zinc/54/59/70/393545970.db2.gz PMQCCOWUCRGNEJ-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCSC3(CCOCC3)C2)c1 ZINC000186501437 393545974 /nfs/dbraw/zinc/54/59/74/393545974.db2.gz PMQCCOWUCRGNEJ-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN C[C@H](NCC1(C)OCCCO1)c1ccc(N(C)C)cc1 ZINC000190661238 393582753 /nfs/dbraw/zinc/58/27/53/393582753.db2.gz GNMNBNYYSJDFSM-ZDUSSCGKSA-N 0 3 278.396 2.556 20 10 CFCDHN Cc1cccc(C[NH2+]CCCNC(=O)OC(C)(C)C)c1[O-] ZINC000224795138 393767666 /nfs/dbraw/zinc/76/76/66/393767666.db2.gz IYCNDSCNRFASCB-UHFFFAOYSA-N 0 3 294.395 2.705 20 10 CFCDHN CNC(=O)c1ccc(CN(C)Cc2cc(C)ccc2O)cc1 ZINC000121175251 393950238 /nfs/dbraw/zinc/95/02/38/393950238.db2.gz OHYDKDQJYGWIOO-UHFFFAOYSA-N 0 3 298.386 2.692 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@H](C)c2ccccc2[O-])CC1 ZINC000272835552 394031177 /nfs/dbraw/zinc/03/11/77/394031177.db2.gz IQVIBLXSBYHMJD-IUODEOHRSA-N 0 3 263.381 2.840 20 10 CFCDHN Cc1cn[nH]c1CN(Cc1ccc(N(C)C)cc1)C1CC1 ZINC000290549810 394231080 /nfs/dbraw/zinc/23/10/80/394231080.db2.gz WRCHFWXBFQCOKX-UHFFFAOYSA-N 0 3 284.407 2.949 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1[O-] ZINC000527804462 394409757 /nfs/dbraw/zinc/40/97/57/394409757.db2.gz PVCCUVZJYUFASZ-ASHKBJFXSA-N 0 3 279.380 2.692 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1[O-] ZINC000529668158 394418661 /nfs/dbraw/zinc/41/86/61/394418661.db2.gz DMBRFBAPABTOOP-JIXVBMEVSA-N 0 3 299.798 2.956 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCc2c[nH]nc2C1)c1ccccc1[O-] ZINC000372346512 397536307 /nfs/dbraw/zinc/53/63/07/397536307.db2.gz KLTVYIDPBMGJCK-GXTWGEPZSA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2c[nH]nc2C1)c1ccccc1[O-] ZINC000372346515 397536314 /nfs/dbraw/zinc/53/63/14/397536314.db2.gz KLTVYIDPBMGJCK-JSGCOSHPSA-N 0 3 271.364 2.714 20 10 CFCDHN [O-]c1ccc(Cl)cc1C[NH2+]CCCN1CCCC1 ZINC000020129072 171016469 /nfs/dbraw/zinc/01/64/69/171016469.db2.gz FWHLHMUAVZLSDB-UHFFFAOYSA-N 0 3 268.788 2.621 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])cnn1C ZINC000037167842 260073073 /nfs/dbraw/zinc/07/30/73/260073073.db2.gz QACMEJCNNVVLTJ-QWRGUYRKSA-N 0 3 259.353 2.846 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3c(c2)CCO3)cc1 ZINC000037362867 260094915 /nfs/dbraw/zinc/09/49/15/260094915.db2.gz PLCQIMNUQLZDHP-UHFFFAOYSA-N 0 3 282.387 2.977 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000374255806 260252035 /nfs/dbraw/zinc/25/20/35/260252035.db2.gz SPINTTGEUUOGSR-KGLIPLIRSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c1[O-] ZINC000374255806 260252038 /nfs/dbraw/zinc/25/20/38/260252038.db2.gz SPINTTGEUUOGSR-KGLIPLIRSA-N 0 3 277.364 2.544 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCO[C@H]2CCC[C@H]21 ZINC000371527820 261295207 /nfs/dbraw/zinc/29/52/07/261295207.db2.gz JDBIWHSUVXRTCF-HIFRSBDPSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCO[C@H]2CCC[C@H]21 ZINC000371527820 261295209 /nfs/dbraw/zinc/29/52/09/261295209.db2.gz JDBIWHSUVXRTCF-HIFRSBDPSA-N 0 3 265.328 2.675 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(O)Cc3ccccc3C2)c([O-])c1 ZINC000363867924 261983530 /nfs/dbraw/zinc/98/35/30/261983530.db2.gz QRGZZFYMEPKCOA-AWEZNQCLSA-N 0 3 297.398 2.881 20 10 CFCDHN Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccccc1[O-] ZINC000368588996 262109079 /nfs/dbraw/zinc/10/90/79/262109079.db2.gz HHABYVDSFCBTOX-OAHLLOKOSA-N 0 3 271.364 2.771 20 10 CFCDHN Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccccc1[O-] ZINC000368588996 262109080 /nfs/dbraw/zinc/10/90/80/262109080.db2.gz HHABYVDSFCBTOX-OAHLLOKOSA-N 0 3 271.364 2.771 20 10 CFCDHN COc1cccc(CN2CC(C)(C)O[C@@H]3CCC[C@H]32)c1O ZINC000367253046 266252592 /nfs/dbraw/zinc/25/25/92/266252592.db2.gz SXMQJOBIXJPQFR-ZIAGYGMSSA-N 0 3 291.391 2.933 20 10 CFCDHN COc1cccc(C[NH2+]C2CC(c3ccccn3)C2)c1[O-] ZINC000367716720 267112916 /nfs/dbraw/zinc/11/29/16/267112916.db2.gz BHCARTVAIPCCDE-UHFFFAOYSA-N 0 3 284.359 2.832 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCN(c2ccncn2)C1)c1ccccc1[O-] ZINC000367829696 267120564 /nfs/dbraw/zinc/12/05/64/267120564.db2.gz BWUZADREADQHBA-UONOGXRCSA-N 0 3 298.390 2.502 20 10 CFCDHN CN1Cc2ccccc2[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000368023636 267135768 /nfs/dbraw/zinc/13/57/68/267135768.db2.gz XPMIJQHBCPOSOB-MRXNPFEDSA-N 0 3 286.350 2.808 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CC[S@](=O)C[C@H](C)C1 ZINC000368038972 267140176 /nfs/dbraw/zinc/14/01/76/267140176.db2.gz QFIOOAYFRYWXNC-TVZGQMOCSA-N 0 3 281.421 2.544 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCC23CCOCC3)c1 ZINC000368046094 267142135 /nfs/dbraw/zinc/14/21/35/267142135.db2.gz XIYXLVZGXXQHPG-LBPRGKRZSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCC23CCOCC3)c1 ZINC000368046094 267142139 /nfs/dbraw/zinc/14/21/39/267142139.db2.gz XIYXLVZGXXQHPG-LBPRGKRZSA-N 0 3 277.364 2.717 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000368229522 267153453 /nfs/dbraw/zinc/15/34/53/267153453.db2.gz SZBTWRAKLYLKAT-ZDUSSCGKSA-N 0 3 293.370 2.916 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000368229522 267153458 /nfs/dbraw/zinc/15/34/58/267153458.db2.gz SZBTWRAKLYLKAT-ZDUSSCGKSA-N 0 3 293.370 2.916 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC23CCOCC3)c1[O-] ZINC000369327701 267236690 /nfs/dbraw/zinc/23/66/90/267236690.db2.gz VHJWGZBXSHNUJJ-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC23CCOCC3)c1[O-] ZINC000369327701 267236692 /nfs/dbraw/zinc/23/66/92/267236692.db2.gz VHJWGZBXSHNUJJ-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)c1[O-] ZINC000369676124 267259792 /nfs/dbraw/zinc/25/97/92/267259792.db2.gz MELKDQVTEPNOPG-SMDDNHRTSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c1[O-] ZINC000369676124 267259796 /nfs/dbraw/zinc/25/97/96/267259796.db2.gz MELKDQVTEPNOPG-SMDDNHRTSA-N 0 3 281.783 2.965 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000369930660 267276912 /nfs/dbraw/zinc/27/69/12/267276912.db2.gz NUXZRSTVBBGRQI-GDBMZVCRSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000369930660 267276913 /nfs/dbraw/zinc/27/69/13/267276913.db2.gz NUXZRSTVBBGRQI-GDBMZVCRSA-N 0 3 261.365 2.954 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CCc3c[nH]nc3C2)c1[O-] ZINC000370364126 267312094 /nfs/dbraw/zinc/31/20/94/267312094.db2.gz CQDBHOMNFOVVNP-ZDUSSCGKSA-N 0 3 291.782 2.724 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCO[C@H]2C2CC2)cc1C ZINC000372864406 267611560 /nfs/dbraw/zinc/61/15/60/267611560.db2.gz VVZGYHAQWSJTBU-HOCLYGCPSA-N 0 3 261.365 2.666 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@@]3(CCOC3)C2)c1 ZINC000376301254 267958256 /nfs/dbraw/zinc/95/82/56/267958256.db2.gz HCYVQBRNIBMWMW-ZQIUZPCESA-N 0 3 291.391 2.689 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccccc1[O-] ZINC000377121140 278384154 /nfs/dbraw/zinc/38/41/54/278384154.db2.gz SNDFINURUGAIII-RISCZKNCSA-N 0 3 271.364 2.854 20 10 CFCDHN C[C@H]([NH2+][C@H]1CC(=O)N(C(C)(C)C)C1)c1cc(F)ccc1[O-] ZINC000186086612 279531194 /nfs/dbraw/zinc/53/11/94/279531194.db2.gz WRKHDYNHHGFTBT-JQWIXIFHSA-N 0 3 294.370 2.581 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C(=O)N(C)CC)c1ccc(C)cc1[O-] ZINC000280014682 280948700 /nfs/dbraw/zinc/94/87/00/280948700.db2.gz GXBDPXCNPAWZHV-JSGCOSHPSA-N 0 3 278.396 2.608 20 10 CFCDHN Cc1cccc(C[N@H+]2CCN(C3CC3)C[C@@H](C)C2)c1[O-] ZINC000295956799 281216249 /nfs/dbraw/zinc/21/62/49/281216249.db2.gz HOTJXWIMTCQYJG-ZDUSSCGKSA-N 0 3 274.408 2.617 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCN(C3CC3)C[C@@H](C)C2)c1[O-] ZINC000295956799 281216251 /nfs/dbraw/zinc/21/62/51/281216251.db2.gz HOTJXWIMTCQYJG-ZDUSSCGKSA-N 0 3 274.408 2.617 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672205 295168549 /nfs/dbraw/zinc/16/85/49/295168549.db2.gz GYXVUFZSAMXEHD-RWMBFGLXSA-N 0 3 290.407 2.677 20 10 CFCDHN CC(C)(C)C[C@@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296242277 327091532 /nfs/dbraw/zinc/09/15/32/327091532.db2.gz AWJCHCKHGJKRAV-QWHCGFSZSA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@H](N[C@@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1[O-] ZINC000530216073 328716746 /nfs/dbraw/zinc/71/67/46/328716746.db2.gz MHVMHLNUPKELPO-QMTHXVAHSA-N 0 3 280.799 2.981 20 10 CFCDHN Cc1cc(O)c(CN[C@@H]2Cc3ccccc3NC2=O)cc1C ZINC000527801077 330284137 /nfs/dbraw/zinc/28/41/37/330284137.db2.gz QEOQIGMNVQLUAT-MRXNPFEDSA-N 0 3 296.370 2.662 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](CC)C(C)(C)O)c([O-])c1 ZINC000292916070 520371703 /nfs/dbraw/zinc/37/17/03/520371703.db2.gz FVCHDUCSHQAHPR-HNNXBMFYSA-N 0 3 281.396 2.820 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000087014937 521657325 /nfs/dbraw/zinc/65/73/25/521657325.db2.gz CNGWEEVXKPLDCT-LBPRGKRZSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H](C)C[N@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000160171989 521971159 /nfs/dbraw/zinc/97/11/59/521971159.db2.gz PLBQFNKYYBFLGH-LLVKDONJSA-N 0 3 267.369 2.887 20 10 CFCDHN CC[C@@H](C)C[N@@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000160171989 521971171 /nfs/dbraw/zinc/97/11/71/521971171.db2.gz PLBQFNKYYBFLGH-LLVKDONJSA-N 0 3 267.369 2.887 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H](C)OC)c1[O-] ZINC000291047537 522539809 /nfs/dbraw/zinc/53/98/09/522539809.db2.gz ZQJHOYAHWWVZKS-BDAKNGLRSA-N 0 3 273.760 2.567 20 10 CFCDHN CC(C)=CCN(C)Cc1ccc(N2CCOCC2)cc1 ZINC000071124126 519423705 /nfs/dbraw/zinc/42/37/05/519423705.db2.gz VBADLEIVOYRHKA-UHFFFAOYSA-N 0 3 274.408 2.921 20 10 CFCDHN CC(C)OCCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094616987 519764562 /nfs/dbraw/zinc/76/45/62/519764562.db2.gz UQDREFOIDSRABP-NSHDSACASA-N 0 3 255.333 2.997 20 10 CFCDHN CC(C)[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 ZINC000173476202 519826939 /nfs/dbraw/zinc/82/69/39/519826939.db2.gz LRDOUATUAIONFR-OAHLLOKOSA-N 0 3 295.404 2.694 20 10 CFCDHN CCOCc1cc(CNC[C@H](CC)OC)ccc1OC ZINC000289907396 520186359 /nfs/dbraw/zinc/18/63/59/520186359.db2.gz ULVZAAJNRMIRLK-HNNXBMFYSA-N 0 3 281.396 2.746 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC000314483712 520349737 /nfs/dbraw/zinc/34/97/37/520349737.db2.gz CKBCTOOHNOMYKW-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC000314483712 520349744 /nfs/dbraw/zinc/34/97/44/520349744.db2.gz CKBCTOOHNOMYKW-KRWDZBQOSA-N 0 3 291.391 2.936 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@H](COC)C2)c([O-])c1 ZINC000211435567 520353300 /nfs/dbraw/zinc/35/33/00/520353300.db2.gz FURBEIFUCVAOFF-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@H](COC)C2)c([O-])c1 ZINC000211435567 520353304 /nfs/dbraw/zinc/35/33/04/520353304.db2.gz FURBEIFUCVAOFF-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CC1(C)CN(Cc2ccc(N3CCCCC3)cc2)C[C@@H]1O ZINC000280470054 520479524 /nfs/dbraw/zinc/47/95/24/520479524.db2.gz MZDKWEBGMUNBPE-KRWDZBQOSA-N 0 3 288.435 2.880 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280457832 521143093 /nfs/dbraw/zinc/14/30/93/521143093.db2.gz LZJSYYRZPFUSIC-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000280457832 521143097 /nfs/dbraw/zinc/14/30/97/521143097.db2.gz LZJSYYRZPFUSIC-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCN(Cc1ccc(CO)o1)Cc1ccc(N(C)C)cc1 ZINC000156843546 521308796 /nfs/dbraw/zinc/30/87/96/521308796.db2.gz UDNSROKGZXCFTM-UHFFFAOYSA-N 0 3 288.391 2.860 20 10 CFCDHN CCOc1cccc(C[N@H+](C(C)C)[C@@H]2CCOC2)c1[O-] ZINC000291184185 521330108 /nfs/dbraw/zinc/33/01/08/521330108.db2.gz FXBFCYAJCHDGCB-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@@H+](C(C)C)[C@@H]2CCOC2)c1[O-] ZINC000291184185 521330116 /nfs/dbraw/zinc/33/01/16/521330116.db2.gz FXBFCYAJCHDGCB-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H]2CCO[C@H](C)C2)c1[O-] ZINC000271591061 521365326 /nfs/dbraw/zinc/36/53/26/521365326.db2.gz ZUQNTENNXRIMCI-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(CNCc2occc2C)c1O ZINC000291680294 521367450 /nfs/dbraw/zinc/36/74/50/521367450.db2.gz HOOMTCUPPDCGDC-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H]2CCCSC2)c1[O-] ZINC000135700608 521376032 /nfs/dbraw/zinc/37/60/32/521376032.db2.gz YAAZNCUFBOUQCQ-LBPRGKRZSA-N 0 3 267.394 2.776 20 10 CFCDHN CCN(Cc1cnn(C)c1)Cc1ccc(N(C)C)c(C)c1 ZINC000293221081 521438828 /nfs/dbraw/zinc/43/88/28/521438828.db2.gz VMWKEDNIRCAXSD-UHFFFAOYSA-N 0 3 286.423 2.817 20 10 CFCDHN CCCN(CC(=O)N[C@@H](C)CC)Cc1ccccc1O ZINC000170779345 521548247 /nfs/dbraw/zinc/54/82/47/521548247.db2.gz MYZOAFOBHBHVMN-ZDUSSCGKSA-N 0 3 278.396 2.519 20 10 CFCDHN CCC[N@H+](CCC(=O)NC(C)C)Cc1ccccc1[O-] ZINC000075829153 521628883 /nfs/dbraw/zinc/62/88/83/521628883.db2.gz UMKCCFDSDQUXSN-UHFFFAOYSA-N 0 3 278.396 2.519 20 10 CFCDHN CCC[N@@H+](CCC(=O)NC(C)C)Cc1ccccc1[O-] ZINC000075829153 521628886 /nfs/dbraw/zinc/62/88/86/521628886.db2.gz UMKCCFDSDQUXSN-UHFFFAOYSA-N 0 3 278.396 2.519 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cccc(OC)c1[O-] ZINC000288592934 521669224 /nfs/dbraw/zinc/66/92/24/521669224.db2.gz OWYIUOLKMONJKL-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000245916303 521717916 /nfs/dbraw/zinc/71/79/16/521717916.db2.gz YKSOLVQLMLLCKU-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CCC1 ZINC000277114051 521733425 /nfs/dbraw/zinc/73/34/25/521733425.db2.gz IGEHHJAMZVHOSQ-ZDUSSCGKSA-N 0 3 290.407 2.658 20 10 CFCDHN CN(C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1cccs1 ZINC000226619023 522087304 /nfs/dbraw/zinc/08/73/04/522087304.db2.gz NLHZZTMIZQTTIO-CYBMUJFWSA-N 0 3 294.395 2.985 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCc3nn(C)cc32)cc1 ZINC000280272499 522211181 /nfs/dbraw/zinc/21/11/81/522211181.db2.gz XYOXNZDDWJDHHG-INIZCTEOSA-N 0 3 284.407 2.653 20 10 CFCDHN CN(C)c1ccccc1C[NH2+]Cc1cc(F)ccc1[O-] ZINC000272555269 522291447 /nfs/dbraw/zinc/29/14/47/522291447.db2.gz DIKMYZIXHLPLGY-UHFFFAOYSA-N 0 3 274.339 2.887 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@@H](O)C(C)(C)C2)c1O ZINC000275996526 522535996 /nfs/dbraw/zinc/53/59/96/522535996.db2.gz OFDQTSQIOGGELI-CYBMUJFWSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@@H](C)OC)c1[O-] ZINC000273746476 522539667 /nfs/dbraw/zinc/53/96/67/522539667.db2.gz MVBFFZSFTZHNEP-SECBINFHSA-N 0 3 273.760 2.569 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H](C)OC)c1[O-] ZINC000191695743 522542034 /nfs/dbraw/zinc/54/20/34/522542034.db2.gz ZQJHOYAHWWVZKS-DTWKUNHWSA-N 0 3 273.760 2.567 20 10 CFCDHN CC[C@H]([NH2+]CCCNC(=O)C1CCC1)c1ccccc1[O-] ZINC000156693359 522582968 /nfs/dbraw/zinc/58/29/68/522582968.db2.gz IGLKLELPKLPCDC-HNNXBMFYSA-N 0 3 290.407 2.739 20 10 CFCDHN CC[C@H]([NH2+]CCCO[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000279981389 522587202 /nfs/dbraw/zinc/58/72/02/522587202.db2.gz DQNYRTXHRHOJOU-HOCLYGCPSA-N 0 3 293.407 2.937 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCSC[C@@H](C)C2)cc1OC ZINC000192178808 522778428 /nfs/dbraw/zinc/77/84/28/522778428.db2.gz WYKYJSBTLMZOCF-NSHDSACASA-N 0 3 297.420 2.594 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCSC[C@@H](C)C2)cc1OC ZINC000192178808 522778436 /nfs/dbraw/zinc/77/84/36/522778436.db2.gz WYKYJSBTLMZOCF-NSHDSACASA-N 0 3 297.420 2.594 20 10 CFCDHN CC[C@@H]([NH2+]CCCN(C)CCOC)c1ccc(C)cc1[O-] ZINC000280065953 522826243 /nfs/dbraw/zinc/82/62/43/522826243.db2.gz KSGYNSDWXGCKQI-MRXNPFEDSA-N 0 3 294.439 2.710 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649234 522855847 /nfs/dbraw/zinc/85/58/47/522855847.db2.gz JRAAACJKTCWZNW-XJKSGUPXSA-N 0 3 274.408 2.917 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000279007707 522867714 /nfs/dbraw/zinc/86/77/14/522867714.db2.gz SMPBJELHQIAFFD-UKRRQHHQSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)C(C)C)c1ccc(C)cc1[O-] ZINC000280182582 522943416 /nfs/dbraw/zinc/94/34/16/522943416.db2.gz RSQYRGIVTKNLDE-ZIAGYGMSSA-N 0 3 251.370 2.758 20 10 CFCDHN Cn1c2ccccc2nc1CC[N@H+](C)Cc1ccccc1[O-] ZINC000265518642 522983463 /nfs/dbraw/zinc/98/34/63/522983463.db2.gz QZEZOBQEDILTBS-UHFFFAOYSA-N 0 3 295.386 2.953 20 10 CFCDHN Cn1c2ccccc2nc1CC[N@@H+](C)Cc1ccccc1[O-] ZINC000265518642 522983472 /nfs/dbraw/zinc/98/34/72/522983472.db2.gz QZEZOBQEDILTBS-UHFFFAOYSA-N 0 3 295.386 2.953 20 10 CFCDHN COCc1cccc(C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000226584936 523052795 /nfs/dbraw/zinc/05/27/95/523052795.db2.gz XEKAQYGMNHMKGD-UHFFFAOYSA-N 0 3 275.323 2.968 20 10 CFCDHN COCCCCCN1CCN(c2ccc(OC)cc2)CC1 ZINC000103225611 523111099 /nfs/dbraw/zinc/11/10/99/523111099.db2.gz XRQZKZPSHZMEMW-UHFFFAOYSA-N 0 3 292.423 2.634 20 10 CFCDHN CN(Cc1ccccc1O)[C@@H]1CCc2ccccc2NC1=O ZINC000192102772 523387885 /nfs/dbraw/zinc/38/78/85/523387885.db2.gz NZWARFBLXBETQD-MRXNPFEDSA-N 0 3 296.370 2.778 20 10 CFCDHN CO[C@@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 ZINC000292983376 523597716 /nfs/dbraw/zinc/59/77/16/523597716.db2.gz FMCONWTZIQCWLW-OAHLLOKOSA-N 0 3 262.397 2.672 20 10 CFCDHN COCC[N@@H+](Cc1cc(OC)c(OC)cc1[O-])CC(C)C ZINC000159772727 523739436 /nfs/dbraw/zinc/73/94/36/523739436.db2.gz DGFVTFMHSXTHTH-UHFFFAOYSA-N 0 3 297.395 2.514 20 10 CFCDHN COCC[N@H+](Cc1cc(OC)c(OC)cc1[O-])CC(C)C ZINC000159772727 523739441 /nfs/dbraw/zinc/73/94/41/523739441.db2.gz DGFVTFMHSXTHTH-UHFFFAOYSA-N 0 3 297.395 2.514 20 10 CFCDHN CO[C@@](C)(C[NH2+]Cc1cc(C)c(C)cc1[O-])C1CC1 ZINC000291038613 523798504 /nfs/dbraw/zinc/79/85/04/523798504.db2.gz KINGJAKHJPEQRM-INIZCTEOSA-N 0 3 263.381 2.914 20 10 CFCDHN COc1ccc(CNCc2cccc(CO)c2)cc1C ZINC000222113627 524072820 /nfs/dbraw/zinc/07/28/20/524072820.db2.gz YQJWOQRZIIAESE-UHFFFAOYSA-N 0 3 271.360 2.786 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](O)c2ccc(F)cc2)c1[O-] ZINC000278569167 524433706 /nfs/dbraw/zinc/43/37/06/524433706.db2.gz BWADJNRVNHPEIA-OAHLLOKOSA-N 0 3 275.323 2.663 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1[O-])CN1CCCC1 ZINC000062748559 524499711 /nfs/dbraw/zinc/49/97/11/524499711.db2.gz QPFCQIYJYHDKRH-CHWSQXEVSA-N 0 3 280.387 2.914 20 10 CFCDHN Cc1ccc(CN[C@H](C)c2ccc(N(C)C)cc2)c(=O)n1C ZINC000279584522 524604059 /nfs/dbraw/zinc/60/40/59/524604059.db2.gz UWTIMYUSOXKYCJ-CQSZACIVSA-N 0 3 299.418 2.611 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c1 ZINC000291635056 524736562 /nfs/dbraw/zinc/73/65/62/524736562.db2.gz SQRCEOJOFCUALK-HOTGVXAUSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280361673 524738503 /nfs/dbraw/zinc/73/85/03/524738503.db2.gz CUJTVCJNZJGRRA-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000280361673 524738507 /nfs/dbraw/zinc/73/85/07/524738507.db2.gz CUJTVCJNZJGRRA-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H]2COc3ccccc32)c1 ZINC000290110402 524752969 /nfs/dbraw/zinc/75/29/69/524752969.db2.gz IHMHDCYFWCEFCZ-ZDUSSCGKSA-N 0 3 285.343 2.667 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H]2CCCSC2)c1 ZINC000290190823 524753372 /nfs/dbraw/zinc/75/33/72/524753372.db2.gz OOXUUVVKIYAFEP-LLVKDONJSA-N 0 3 267.394 2.634 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCCSC2)c1 ZINC000168816019 524767593 /nfs/dbraw/zinc/76/75/93/524767593.db2.gz MMFDPCFUXMQVPF-MNOVXSKESA-N 0 3 267.394 2.947 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)SC)c1 ZINC000168851057 524768545 /nfs/dbraw/zinc/76/85/45/524768545.db2.gz OSKAUDJWFCPLHN-ZJUUUORDSA-N 0 3 255.383 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCOC[C@H]2C)c1[O-] ZINC000277662628 524873057 /nfs/dbraw/zinc/87/30/57/524873057.db2.gz ZXPXDCWZNHGYTO-ZWNOBZJWSA-N 0 3 269.772 2.869 20 10 CFCDHN COc1ncccc1CN[C@@H](C)c1ccccc1O ZINC000037650396 525060567 /nfs/dbraw/zinc/06/05/67/525060567.db2.gz UKTTZJPXJWPONT-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN C[C@H]([NH2+]CC1(C)COC1)c1cc2c(cc1[O-])CCCC2 ZINC000185441821 525316902 /nfs/dbraw/zinc/31/69/02/525316902.db2.gz IAUBFIVYWMMNRA-LBPRGKRZSA-N 0 3 275.392 2.958 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@H](C3CC3)C2)cc1C ZINC000364424023 525320001 /nfs/dbraw/zinc/32/00/01/525320001.db2.gz YTMLLEMTHDJYKI-INIZCTEOSA-N 0 3 261.365 2.620 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC2(N(C)C)CCC2)cc1C ZINC000275600584 525323570 /nfs/dbraw/zinc/32/35/70/525323570.db2.gz KPFLZNRQZBOIDJ-UHFFFAOYSA-N 0 3 262.397 2.583 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCC1)c1cc(F)ccc1[O-] ZINC000094616881 525335355 /nfs/dbraw/zinc/33/53/55/525335355.db2.gz JBKFAMFGUBDRIT-LBPRGKRZSA-N 0 3 266.360 2.668 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@](C)(O)c2cccs2)c1 ZINC000265766851 525348180 /nfs/dbraw/zinc/34/81/80/525348180.db2.gz LCHWDWLEGUUYKA-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H]2CCCCN2C2CC2)c1 ZINC000277428550 525349420 /nfs/dbraw/zinc/34/94/20/525349420.db2.gz BVLPXXYJPNDYFD-INIZCTEOSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)Cc2ccccc2)c1 ZINC000063218537 525362529 /nfs/dbraw/zinc/36/25/29/525362529.db2.gz PMVGSAKCFOAVMA-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)Cn2ccnc2)c1 ZINC000037158368 525362978 /nfs/dbraw/zinc/36/29/78/525362978.db2.gz SQJAZNMFIPFFSL-QWHCGFSZSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2COc3ccccc3[C@H]2O)c1 ZINC000290300948 525364075 /nfs/dbraw/zinc/36/40/75/525364075.db2.gz NPNJNCYEAKUFDH-XLWVJDPXSA-N 0 3 299.370 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)c1 ZINC000037649020 525365486 /nfs/dbraw/zinc/36/54/86/525365486.db2.gz UQVBBUDVRYXAIR-KBPBESRZSA-N 0 3 274.408 2.836 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094616948 525438484 /nfs/dbraw/zinc/43/84/84/525438484.db2.gz LBNZOBSQWWKTBX-TZMCWYRMSA-N 0 3 297.370 2.768 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCCN2C)c1cn[nH]c1 ZINC000229630628 525450690 /nfs/dbraw/zinc/45/06/90/525450690.db2.gz JDQSCPFILMTQAO-LBPRGKRZSA-N 0 3 270.380 2.643 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cn[nH]c1 ZINC000229630619 525531888 /nfs/dbraw/zinc/53/18/88/525531888.db2.gz JDQSCPFILMTQAO-GFCCVEGCSA-N 0 3 270.380 2.643 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1ccccc1 ZINC000288432341 525537915 /nfs/dbraw/zinc/53/79/15/525537915.db2.gz BTQWBOUPYWEAGY-MLGOLLRUSA-N 0 3 257.333 2.604 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCOC[C@H]1C)c1cc(F)ccc1[O-] ZINC000278456367 525622879 /nfs/dbraw/zinc/62/28/79/525622879.db2.gz ITQWNUBWRWGFSZ-NRUUGDAUSA-N 0 3 253.317 2.607 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@H](C)CO)c([O-])c1 ZINC000230669775 525724218 /nfs/dbraw/zinc/72/42/18/525724218.db2.gz MJYXNSFTGGOCRW-QWHCGFSZSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@H](C)O)c([O-])c1C ZINC000278893896 525726399 /nfs/dbraw/zinc/72/63/99/525726399.db2.gz UIIRHONUOPFMLU-WCQYABFASA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)n(C)c2=O)c([O-])c1 ZINC000279400812 525733170 /nfs/dbraw/zinc/73/31/70/525733170.db2.gz CUAYYFKRUWIGBC-CYBMUJFWSA-N 0 3 286.375 2.559 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2cc(C)ccc2[O-])cc1 ZINC000278547003 525780266 /nfs/dbraw/zinc/78/02/66/525780266.db2.gz YIUQJQDFINTRMW-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000280415665 525822105 /nfs/dbraw/zinc/82/21/05/525822105.db2.gz IHFORCZWUZGMAB-RISCZKNCSA-N 0 3 267.344 2.657 20 10 CFCDHN C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000280415665 525822110 /nfs/dbraw/zinc/82/21/10/525822110.db2.gz IHFORCZWUZGMAB-RISCZKNCSA-N 0 3 267.344 2.657 20 10 CFCDHN COc1cccc(C[N@H+](C)CCCSC)c1[O-] ZINC000281225511 525913985 /nfs/dbraw/zinc/91/39/85/525913985.db2.gz KRSFYVPVFPLFMF-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCCSC)c1[O-] ZINC000281225511 525913999 /nfs/dbraw/zinc/91/39/99/525913999.db2.gz KRSFYVPVFPLFMF-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cn[nH]c2)c([O-])c1C ZINC000289997204 525923448 /nfs/dbraw/zinc/92/34/48/525923448.db2.gz YWDFDNXXRQPXNE-LBPRGKRZSA-N 0 3 259.353 2.625 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)CC2CCC2)c([O-])c1 ZINC000280886058 525943428 /nfs/dbraw/zinc/94/34/28/525943428.db2.gz DSJYHARSQGNSCO-JSGCOSHPSA-N 0 3 263.381 2.902 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C1CCC3(CC3)CC1)OCO2 ZINC000277529076 526336467 /nfs/dbraw/zinc/33/64/67/526336467.db2.gz USINFZHCLATJOR-UHFFFAOYSA-N 0 3 275.348 2.933 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCCc1ccccc1)OCO2 ZINC000042879401 526337155 /nfs/dbraw/zinc/33/71/55/526337155.db2.gz NEXBPZIQJNQHJG-UHFFFAOYSA-N 0 3 285.343 2.843 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000287768528 526373874 /nfs/dbraw/zinc/37/38/74/526373874.db2.gz RJOGJBBMGPWDAF-ZYHUDNBSSA-N 0 3 275.270 2.592 20 10 CFCDHN Cc1n[nH]c(CC[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])n1 ZINC000273422617 526827005 /nfs/dbraw/zinc/82/70/05/526827005.db2.gz JSHDJTNNMXIISL-NSHDSACASA-N 0 3 296.374 2.865 20 10 CFCDHN Cc1nc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])n[nH]1 ZINC000273422617 526827009 /nfs/dbraw/zinc/82/70/09/526827009.db2.gz JSHDJTNNMXIISL-NSHDSACASA-N 0 3 296.374 2.865 20 10 CFCDHN Cc1nnc(CC[NH2+][C@@H](C)c2ccc3ccccc3c2[O-])[nH]1 ZINC000273422617 526827015 /nfs/dbraw/zinc/82/70/15/526827015.db2.gz JSHDJTNNMXIISL-NSHDSACASA-N 0 3 296.374 2.865 20 10 CFCDHN Cc1nc(F)ccc1CNCc1ccc(N(C)C)cc1 ZINC000278332635 526946614 /nfs/dbraw/zinc/94/66/14/526946614.db2.gz GMAUCJKGYOIQAC-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN Cc1ncc(CNCc2ccc3c(c2)CCN3C)s1 ZINC000050286802 527273395 /nfs/dbraw/zinc/27/33/95/527273395.db2.gz QWZUBWLGKFQPCO-UHFFFAOYSA-N 0 3 273.405 2.734 20 10 CFCDHN OC[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000364435028 527622501 /nfs/dbraw/zinc/62/25/01/527622501.db2.gz JPRJNOHSGZMPSY-QAPCUYQASA-N 0 3 295.382 2.932 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)Cc2ccoc2)c([O-])c1 ZINC000754045308 574065288 /nfs/dbraw/zinc/06/52/88/574065288.db2.gz FFFQWRYULBJOFZ-NSHDSACASA-N 0 3 261.321 2.715 20 10 CFCDHN COc1ccc(N2CCN(C[C@H]3C[C@H]3C)CC2)cc1F ZINC000754127157 574076151 /nfs/dbraw/zinc/07/61/51/574076151.db2.gz SOXRALRTMXFTCV-CHWSQXEVSA-N 0 3 278.371 2.612 20 10 CFCDHN COc1ccc(N2CCN(C[C@H]3C[C@@H]3C)CC2)cc1F ZINC000754127168 574076392 /nfs/dbraw/zinc/07/63/92/574076392.db2.gz SOXRALRTMXFTCV-QWHCGFSZSA-N 0 3 278.371 2.612 20 10 CFCDHN C[C@@H]1C[C@H]1CN(C)c1ccc(OCCN(C)C)cc1 ZINC000754147659 574077598 /nfs/dbraw/zinc/07/75/98/574077598.db2.gz DMUZTYVHOLEACN-KGLIPLIRSA-N 0 3 262.397 2.719 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCO2)c2c1c(F)ccc2[O-] ZINC000756356076 574097263 /nfs/dbraw/zinc/09/72/63/574097263.db2.gz ZZODYIJGOLAOBZ-JFGNBEQYSA-N 0 3 265.328 2.848 20 10 CFCDHN COCCOCCC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756356983 574097543 /nfs/dbraw/zinc/09/75/43/574097543.db2.gz AOEMULOKIMQOJA-YPMHNXCESA-N 0 3 297.370 2.722 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H]2CCCN(C)C2)c2c1c(F)ccc2[O-] ZINC000756445247 574117086 /nfs/dbraw/zinc/11/70/86/574117086.db2.gz MKOMOYVEOOTECS-NTZNESFSSA-N 0 3 278.371 2.763 20 10 CFCDHN CCN(C)C(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000732204173 574146385 /nfs/dbraw/zinc/14/63/85/574146385.db2.gz FCCYAZNCJSFFHM-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN CCN(C)C(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000732204173 574146387 /nfs/dbraw/zinc/14/63/87/574146387.db2.gz FCCYAZNCJSFFHM-UHFFFAOYSA-N 0 3 290.407 2.615 20 10 CFCDHN CCN(CC[NH2+]Cc1ccccc1[O-])CCC(F)(F)F ZINC000755221539 574146687 /nfs/dbraw/zinc/14/66/87/574146687.db2.gz ZSLIDZKLMKPJBA-UHFFFAOYSA-N 0 3 290.329 2.756 20 10 CFCDHN CCCN(CCC)c1ccc(CN[C@H](C)CC(N)=O)cc1 ZINC000746476171 574150780 /nfs/dbraw/zinc/15/07/80/574150780.db2.gz SHRSOSNCKHRWBU-CQSZACIVSA-N 0 3 291.439 2.667 20 10 CFCDHN CC(C)[C@@H]1CN(C)CC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000738285122 574163252 /nfs/dbraw/zinc/16/32/52/574163252.db2.gz GEJJXOVAECKZKT-KRWDZBQOSA-N 0 3 288.435 2.653 20 10 CFCDHN CC(C)[C@@H]1CN(C)CC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000738285122 574163253 /nfs/dbraw/zinc/16/32/53/574163253.db2.gz GEJJXOVAECKZKT-KRWDZBQOSA-N 0 3 288.435 2.653 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000738548215 574172862 /nfs/dbraw/zinc/17/28/62/574172862.db2.gz JZTRSZXYHIPCIH-LBPRGKRZSA-N 0 3 294.420 2.544 20 10 CFCDHN COC[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756339756 574226571 /nfs/dbraw/zinc/22/65/71/574226571.db2.gz FYMPKTKJFPFAGR-QXEWZRGKSA-N 0 3 253.317 2.704 20 10 CFCDHN COC[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756339758 574226719 /nfs/dbraw/zinc/22/67/19/574226719.db2.gz FYMPKTKJFPFAGR-WCABBAIRSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCN2CCCC2)c2c1c(F)ccc2[O-] ZINC000756355512 574228844 /nfs/dbraw/zinc/22/88/44/574228844.db2.gz PLMVQGLYHLFRIR-AAEUAGOBSA-N 0 3 278.371 2.765 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccco2)c([O-])c1 ZINC000756379731 574231431 /nfs/dbraw/zinc/23/14/31/574231431.db2.gz AVFFQPNHPVPKHD-BXUZGUMPSA-N 0 3 261.321 2.678 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]Cc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000756401392 574234104 /nfs/dbraw/zinc/23/41/04/574234104.db2.gz OYQCEIDIQUCNBS-BXKDBHETSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417174 574235372 /nfs/dbraw/zinc/23/53/72/574235372.db2.gz KLKYBXRXXFHMAY-WCFLWFBJSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417174 574235375 /nfs/dbraw/zinc/23/53/75/574235375.db2.gz KLKYBXRXXFHMAY-WCFLWFBJSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417174 574235378 /nfs/dbraw/zinc/23/53/78/574235378.db2.gz KLKYBXRXXFHMAY-WCFLWFBJSA-N 0 3 296.361 2.948 20 10 CFCDHN CCOCC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756418029 574235422 /nfs/dbraw/zinc/23/54/22/574235422.db2.gz NTYFSOQJDDGHCY-ONGXEEELSA-N 0 3 253.317 2.706 20 10 CFCDHN CCOCC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756418026 574235572 /nfs/dbraw/zinc/23/55/72/574235572.db2.gz NTYFSOQJDDGHCY-GXSJLCMTSA-N 0 3 253.317 2.706 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C2CCOCC2)c2c1c(F)ccc2[O-] ZINC000756432215 574236582 /nfs/dbraw/zinc/23/65/82/574236582.db2.gz IKFQJIBHJFOXQH-SKDRFNHKSA-N 0 3 265.328 2.848 20 10 CFCDHN COC(=O)N1CCC[C@@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000756526874 574243807 /nfs/dbraw/zinc/24/38/07/574243807.db2.gz HXTUJOJYZOSIOP-CHWSQXEVSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C)C1)c1cc2c(cc1[O-])CCCC2 ZINC000756536318 574244481 /nfs/dbraw/zinc/24/44/81/574244481.db2.gz UWHPCZKWGPFUFL-WFASDCNBSA-N 0 3 274.408 2.626 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c1 ZINC000756548593 574245639 /nfs/dbraw/zinc/24/56/39/574245639.db2.gz AJZJZZGGBPQANH-JSGCOSHPSA-N 0 3 290.407 2.536 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCN(CC3CC3)C2)c1 ZINC000756555767 574246848 /nfs/dbraw/zinc/24/68/48/574246848.db2.gz VOHDYEARGDDSGK-UKRRQHHQSA-N 0 3 274.408 2.836 20 10 CFCDHN CCCCN(C)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756574625 574249575 /nfs/dbraw/zinc/24/95/75/574249575.db2.gz DRQHTRJJLQRNLH-GFCCVEGCSA-N 0 3 268.376 2.914 20 10 CFCDHN CCCCN(C)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000756576800 574250123 /nfs/dbraw/zinc/25/01/23/574250123.db2.gz OYDPMODPDXQUDV-ZDUSSCGKSA-N 0 3 280.412 2.783 20 10 CFCDHN CC(C)[C@H](O)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756584824 574250543 /nfs/dbraw/zinc/25/05/43/574250543.db2.gz GWBBUNAUQYBHPC-SUZMYJTESA-N 0 3 267.344 2.686 20 10 CFCDHN C[C@H](C[C@@H]1CCOC1)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756645056 574254987 /nfs/dbraw/zinc/25/49/87/574254987.db2.gz DLMKKVKCKOEGAQ-UTUOFQBUSA-N 0 3 267.344 2.997 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CO)c([O-])c1C ZINC000756762336 574261336 /nfs/dbraw/zinc/26/13/36/574261336.db2.gz XVIFRACOSBXSNW-GFCCVEGCSA-N 0 3 251.370 2.678 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](C)c2ccncc2)c1 ZINC000749293166 574288514 /nfs/dbraw/zinc/28/85/14/574288514.db2.gz BTZZYTDBZCELFI-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000743500269 574307499 /nfs/dbraw/zinc/30/74/99/574307499.db2.gz VGPAJCXCSWEBEK-IAQYHMDHSA-N 0 3 265.397 2.896 20 10 CFCDHN CN(C)c1ccc(CNCCC(=O)OC(C)(C)C)cc1F ZINC000742372646 574325504 /nfs/dbraw/zinc/32/55/04/574325504.db2.gz RGODULGWEKJFIJ-UHFFFAOYSA-N 0 3 296.386 2.713 20 10 CFCDHN Oc1ccccc1CN1CCC[C@H](OCC(F)(F)F)C1 ZINC000725847305 574328247 /nfs/dbraw/zinc/32/82/47/574328247.db2.gz ZJCQIWPZOAMTPY-LBPRGKRZSA-N 0 3 289.297 2.936 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1ccccc1[O-] ZINC000743870106 574374942 /nfs/dbraw/zinc/37/49/42/574374942.db2.gz HFLHRLSNVWXGBZ-UHFFFAOYSA-N 0 3 250.386 2.556 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1ccccc1[O-] ZINC000743870106 574374943 /nfs/dbraw/zinc/37/49/43/574374943.db2.gz HFLHRLSNVWXGBZ-UHFFFAOYSA-N 0 3 250.386 2.556 20 10 CFCDHN C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811012 574395521 /nfs/dbraw/zinc/39/55/21/574395521.db2.gz KITHDHSXYNNHAT-WBMJQRKESA-N 0 3 275.392 2.616 20 10 CFCDHN C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000752811012 574395522 /nfs/dbraw/zinc/39/55/22/574395522.db2.gz KITHDHSXYNNHAT-WBMJQRKESA-N 0 3 275.392 2.616 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2C[C@H](OC)C2(C)C)c([O-])c1 ZINC000753372448 574401825 /nfs/dbraw/zinc/40/18/25/574401825.db2.gz FJLXNDMLMFMKRD-CABCVRRESA-N 0 3 279.380 2.694 20 10 CFCDHN C[C@H]([NH2+]CCOCC(F)(F)F)c1ccccc1[O-] ZINC000104431111 617741509 /nfs/dbraw/zinc/74/15/09/617741509.db2.gz BQRHVGFEQFLTMZ-VIFPVBQESA-N 0 3 263.259 2.622 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000300417643 617797432 /nfs/dbraw/zinc/79/74/32/617797432.db2.gz WOSAPHVIJKYJLB-CABCVRRESA-N 0 3 278.371 2.638 20 10 CFCDHN CC(C)[C@@H](CO)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000806170257 617816240 /nfs/dbraw/zinc/81/62/40/617816240.db2.gz YMBVSEGXMOINSQ-NQBHXWOUSA-N 0 3 281.371 2.934 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000806660217 617883722 /nfs/dbraw/zinc/88/37/22/617883722.db2.gz ALLIJQBASXQTAI-JBLDHEPKSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@@H](NC1CC1)c1ccc(N2CCOCC2)cc1Cl ZINC000132666610 618022229 /nfs/dbraw/zinc/02/22/29/618022229.db2.gz ATBIHAITKAEIJK-LLVKDONJSA-N 0 3 280.799 2.990 20 10 CFCDHN COc1cccc(CNCc2ccc(F)c(F)c2)c1O ZINC000049577283 618058361 /nfs/dbraw/zinc/05/83/61/618058361.db2.gz FAENQWSAEMUUMH-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN CCOC(CN[C@@H](C)c1ccc(N(C)C)cc1)OCC ZINC000093446865 618193708 /nfs/dbraw/zinc/19/37/08/618193708.db2.gz AGYPAOSZTYUEIO-ZDUSSCGKSA-N 0 3 280.412 2.802 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@H](CC)c1ccccc1[O-] ZINC000229554681 618217982 /nfs/dbraw/zinc/21/79/82/618217982.db2.gz QQVRBELDSFOZGQ-HIFRSBDPSA-N 0 3 251.370 2.984 20 10 CFCDHN C[C@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000840879709 618360498 /nfs/dbraw/zinc/36/04/98/618360498.db2.gz HFASSFMIMYTRDU-GXTWGEPZSA-N 0 3 289.350 2.958 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CC[C@H]3COCC[C@@H]3C2)c([O-])c1 ZINC000894184554 618431618 /nfs/dbraw/zinc/43/16/18/618431618.db2.gz BETHKCUWXUNPER-VHDGCEQUSA-N 0 3 291.391 2.696 20 10 CFCDHN Cc1ncsc1CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877564795 618436384 /nfs/dbraw/zinc/43/63/84/618436384.db2.gz LOFKVLSAPKVGJN-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+][C@H]2CCc3cccc([O-])c32)n1 ZINC000314593050 618437184 /nfs/dbraw/zinc/43/71/84/618437184.db2.gz SUTVZANUAGJNDA-HNNXBMFYSA-N 0 3 285.391 2.873 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000877616852 618449704 /nfs/dbraw/zinc/44/97/04/618449704.db2.gz OYDSEGQNAATSRM-ZDUSSCGKSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000877616852 618449709 /nfs/dbraw/zinc/44/97/09/618449709.db2.gz OYDSEGQNAATSRM-ZDUSSCGKSA-N 0 3 253.292 2.932 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@@H]2CC(C)=NO2)cc1F ZINC000895307554 618527975 /nfs/dbraw/zinc/52/79/75/618527975.db2.gz BKWNPUBRVKEYEJ-AWEZNQCLSA-N 0 3 293.386 2.926 20 10 CFCDHN COc1ccc(CNCc2ccoc2C)c(O)c1OC ZINC000892658101 618678893 /nfs/dbraw/zinc/67/88/93/618678893.db2.gz HNUQFPWLGJJLRJ-UHFFFAOYSA-N 0 3 277.320 2.601 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](CO)C2)c([O-])c1 ZINC000311717317 618720288 /nfs/dbraw/zinc/72/02/88/618720288.db2.gz TYIQQNLIBBLNOP-MELADBBJSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc(C)c(C)n2)c1 ZINC000313794971 619011033 /nfs/dbraw/zinc/01/10/33/619011033.db2.gz DSWQSDKYYWTYPW-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN CN(C)c1ccc(CNCc2cnn(CC(F)F)c2)cc1 ZINC000314489103 619081310 /nfs/dbraw/zinc/08/13/10/619081310.db2.gz QCBROOSSJXUOPX-UHFFFAOYSA-N 0 3 294.349 2.504 20 10 CFCDHN CC1(C)CCC[C@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000094266019 619102664 /nfs/dbraw/zinc/10/26/64/619102664.db2.gz QYPALKCMRKMKLI-CQSZACIVSA-N 0 3 263.337 2.789 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000060358321 619157138 /nfs/dbraw/zinc/15/71/38/619157138.db2.gz QFVLSUPEIWYJJC-HNNXBMFYSA-N 0 3 277.751 2.869 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2(C)CC2)c1[O-] ZINC000230935127 619168683 /nfs/dbraw/zinc/16/86/83/619168683.db2.gz UIJGWZUOEQSFGV-UHFFFAOYSA-N 0 3 255.745 2.944 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC(C)(C)c1cccnc1 ZINC000840974709 619196615 /nfs/dbraw/zinc/19/66/15/619196615.db2.gz FKHMSARXJOTTTE-UHFFFAOYSA-N 0 3 286.375 2.863 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000319895469 619365567 /nfs/dbraw/zinc/36/55/67/619365567.db2.gz YJHLJQFXEGMVQL-OAHLLOKOSA-N 0 3 296.370 2.529 20 10 CFCDHN CCn1cc([C@H](C)NCc2cc(C)cc(OC)c2O)cn1 ZINC000894919643 619512956 /nfs/dbraw/zinc/51/29/56/619512956.db2.gz SNGHSTTZFKFVTB-LBPRGKRZSA-N 0 3 289.379 2.776 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCC(C)(C)CO2)c([O-])c1 ZINC000895529801 619548270 /nfs/dbraw/zinc/54/82/70/619548270.db2.gz WEJOKBXNSWOUHW-AWEZNQCLSA-N 0 3 263.381 2.995 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCN(Cc2ccccc2O)C1 ZINC000895577597 619558699 /nfs/dbraw/zinc/55/86/99/619558699.db2.gz OFRHIGAHLPJALK-GFCCVEGCSA-N 0 3 275.270 2.545 20 10 CFCDHN CO[C@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000895577597 619558701 /nfs/dbraw/zinc/55/87/01/619558701.db2.gz OFRHIGAHLPJALK-GFCCVEGCSA-N 0 3 275.270 2.545 20 10 CFCDHN CO[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000895577597 619558703 /nfs/dbraw/zinc/55/87/03/619558703.db2.gz OFRHIGAHLPJALK-GFCCVEGCSA-N 0 3 275.270 2.545 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)Cc1ccc(F)cc1 ZINC000895753142 619599657 /nfs/dbraw/zinc/59/96/57/619599657.db2.gz OORADGLCBRVHLB-HNNXBMFYSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895842038 619617028 /nfs/dbraw/zinc/61/70/28/619617028.db2.gz DWVQOAHCXHHZHT-ZBFHGGJFSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895842038 619617029 /nfs/dbraw/zinc/61/70/29/619617029.db2.gz DWVQOAHCXHHZHT-ZBFHGGJFSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@H](C(F)(F)F)O2)c([O-])c1 ZINC000896284592 619709918 /nfs/dbraw/zinc/70/99/18/619709918.db2.gz XYZPSGYUCICMDH-WCQYABFASA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000896862395 619847540 /nfs/dbraw/zinc/84/75/40/619847540.db2.gz COGYHOFRRHEHMM-GXSJLCMTSA-N 0 3 259.271 2.989 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897034237 619916962 /nfs/dbraw/zinc/91/69/62/619916962.db2.gz JMMSBVRRVMVJPW-UHFFFAOYSA-N 0 3 261.365 2.519 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cccc3c2OCCO3)c([O-])c1 ZINC000897210285 619950957 /nfs/dbraw/zinc/95/09/57/619950957.db2.gz ZYSZZKMKPQZLCW-UHFFFAOYSA-N 0 3 299.370 2.804 20 10 CFCDHN Cc1cc(O)c(CN(C)Cc2cccc(=O)[nH]2)cc1C ZINC000897391992 620092321 /nfs/dbraw/zinc/09/23/21/620092321.db2.gz IZHPKSLJONSYFF-UHFFFAOYSA-N 0 3 272.348 2.742 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C1CC2(C1)CO[C@H](C)C2 ZINC000897776791 620280294 /nfs/dbraw/zinc/28/02/94/620280294.db2.gz XFIIVUGRQAPIAY-VEAWUBTESA-N 0 3 261.365 2.748 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccccc1[O-] ZINC000897815328 620282947 /nfs/dbraw/zinc/28/29/47/620282947.db2.gz VDNXMMXFFFMAAS-GNIGRLLJSA-N 0 3 259.349 2.609 20 10 CFCDHN C[C@H](Cc1cccnc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000897969058 620315183 /nfs/dbraw/zinc/31/51/83/620315183.db2.gz CQKIQBYBFALSJK-LLVKDONJSA-N 0 3 260.312 2.647 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC([NH2+]C2CCC2)CC1 ZINC000897981861 620317912 /nfs/dbraw/zinc/31/79/12/620317912.db2.gz SOTIABCEKGZVJE-UHFFFAOYSA-N 0 3 278.371 2.638 20 10 CFCDHN COC1(OC)CC[C@H]1NCc1ccc(N2CCCC2)cc1 ZINC000924647725 620432169 /nfs/dbraw/zinc/43/21/69/620432169.db2.gz IPGZKJAUGSPJFI-MRXNPFEDSA-N 0 3 290.407 2.528 20 10 CFCDHN COC[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(C)C ZINC000927096161 620452197 /nfs/dbraw/zinc/45/21/97/620452197.db2.gz JMGQFGVRSPSJHU-KBPBESRZSA-N 0 3 263.381 2.888 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1N)c1ccccc1[O-] ZINC000902438324 621079936 /nfs/dbraw/zinc/07/99/36/621079936.db2.gz MNHNALFQQPZCTE-UXEPBGEESA-N 0 3 268.360 2.668 20 10 CFCDHN C[C@@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902478957 621088741 /nfs/dbraw/zinc/08/87/41/621088741.db2.gz ZECQONUXBCDLNK-HMHPOGMRSA-N 0 3 266.772 2.589 20 10 CFCDHN CC[C@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cccc(Cl)c1[O-] ZINC000902464405 621098040 /nfs/dbraw/zinc/09/80/40/621098040.db2.gz CENQQXRZQLGOPF-IGJVIKARSA-N 0 3 280.799 2.979 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1N2)c1cccc(Cl)c1[O-] ZINC000902464405 621098044 /nfs/dbraw/zinc/09/80/44/621098044.db2.gz CENQQXRZQLGOPF-IGJVIKARSA-N 0 3 280.799 2.979 20 10 CFCDHN C[C@H](NC[C@H]1CCCCC[NH2+]1)c1ccc(F)cc1[O-] ZINC000902484532 621110776 /nfs/dbraw/zinc/11/07/76/621110776.db2.gz WCXRRIYCKOYJSV-WCQYABFASA-N 0 3 266.360 2.714 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H]1CC(=O)N(C)C1)c1ccc(C)cc1[O-] ZINC000903211013 621288855 /nfs/dbraw/zinc/28/88/55/621288855.db2.gz AGIVOSFMQJRAEH-ZFWWWQNUSA-N 0 3 290.407 2.610 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CC(=O)N(C)C2)c([O-])c1 ZINC000903213679 621290289 /nfs/dbraw/zinc/29/02/89/621290289.db2.gz PJGGEWMPPSMXOE-ZIAGYGMSSA-N 0 3 290.407 2.528 20 10 CFCDHN C[C@H]([NH2+]CC1(C2(O)CCC2)CC1)c1cc(F)ccc1[O-] ZINC000903258611 621301584 /nfs/dbraw/zinc/30/15/84/621301584.db2.gz YMVOAEOSUMUBOY-NSHDSACASA-N 0 3 279.355 2.877 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)CC2 ZINC000903259158 621302262 /nfs/dbraw/zinc/30/22/62/621302262.db2.gz CKWPAWNYPHTESM-ZENOOKHLSA-N 0 3 259.349 2.537 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c([O-])c1 ZINC000903288438 621319729 /nfs/dbraw/zinc/31/97/29/621319729.db2.gz YAANEFUSFUFKME-HPTZYISWSA-N 0 3 259.349 2.527 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@]2(OC(C)C)CCOC2)c([O-])c1 ZINC000903358720 621348141 /nfs/dbraw/zinc/34/81/41/621348141.db2.gz YGFXQOAAVVSBSL-WMLDXEAASA-N 0 3 293.407 2.935 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCOC1CCSCC1)CC2 ZINC000903446815 621385055 /nfs/dbraw/zinc/38/50/55/621385055.db2.gz UZEAQRYZTHXHKM-AWEZNQCLSA-N 0 3 293.432 2.881 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1CCSCC1 ZINC000877029146 623017501 /nfs/dbraw/zinc/01/75/01/623017501.db2.gz TYHMQLKUNJRVFJ-UHFFFAOYSA-N 0 3 251.395 2.933 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877030025 623017990 /nfs/dbraw/zinc/01/79/90/623017990.db2.gz WHBRFMMNFLCUSK-SWLSCSKDSA-N 0 3 251.370 2.587 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOC1CCCC1 ZINC000226587675 623083528 /nfs/dbraw/zinc/08/35/28/623083528.db2.gz DIRRAZMMMLLZOD-UHFFFAOYSA-N 0 3 253.317 2.580 20 10 CFCDHN O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000226619329 623085123 /nfs/dbraw/zinc/08/51/23/623085123.db2.gz VJQKEAKTAWLJEM-UHFFFAOYSA-N 0 3 276.267 2.729 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@@H](C)C2)c([O-])c1 ZINC000226866558 623092629 /nfs/dbraw/zinc/09/26/29/623092629.db2.gz FNYJZEBOAYAFNF-MELADBBJSA-N 0 3 262.397 2.834 20 10 CFCDHN C[C@H]1CCC[C@@H]1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000230650187 623288380 /nfs/dbraw/zinc/28/83/80/623288380.db2.gz SBDWMNWQXHOPPF-WDEREUQCSA-N 0 3 263.337 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@]2(C)CCO[C@H]2C)c1[O-] ZINC000230935801 623311992 /nfs/dbraw/zinc/31/19/92/623311992.db2.gz PFUZXHIPUJOHTG-XPTSAGLGSA-N 0 3 285.771 2.711 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@]2(C)CCO[C@@H]2C)c1[O-] ZINC000230935797 623312082 /nfs/dbraw/zinc/31/20/82/623312082.db2.gz PFUZXHIPUJOHTG-YMTOWFKASA-N 0 3 285.771 2.711 20 10 CFCDHN C[C@@H](CC(F)(F)F)[NH2+]Cc1cc(F)ccc1[O-] ZINC000231901507 623375815 /nfs/dbraw/zinc/37/58/15/623375815.db2.gz HIUNZTCEJMUWPC-ZETCQYMHSA-N 0 3 251.223 2.962 20 10 CFCDHN CC(C)C[N@H+](CCN(C)C)Cc1cc(F)ccc1[O-] ZINC000232600199 623429020 /nfs/dbraw/zinc/42/90/20/623429020.db2.gz WYEWMAMEIZHCBP-UHFFFAOYSA-N 0 3 268.376 2.551 20 10 CFCDHN CC(C)C[N@@H+](CCN(C)C)Cc1cc(F)ccc1[O-] ZINC000232600199 623429023 /nfs/dbraw/zinc/42/90/23/623429023.db2.gz WYEWMAMEIZHCBP-UHFFFAOYSA-N 0 3 268.376 2.551 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000824914769 623587382 /nfs/dbraw/zinc/58/73/82/623587382.db2.gz YQGFEDDBCBPOSU-ZDUSSCGKSA-N 0 3 267.369 2.859 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCSC[C@H]1C1CC1 ZINC000824914769 623587385 /nfs/dbraw/zinc/58/73/85/623587385.db2.gz YQGFEDDBCBPOSU-ZDUSSCGKSA-N 0 3 267.369 2.859 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)Cc1cnn(C)c1)c1ccccc1[O-] ZINC000825046212 623616091 /nfs/dbraw/zinc/61/60/91/623616091.db2.gz QVJGUNCAVIMNBS-DOMZBBRYSA-N 0 3 273.380 2.798 20 10 CFCDHN COc1cccc(CN2CCOCC23CCCCC3)c1O ZINC000825098600 623628412 /nfs/dbraw/zinc/62/84/12/623628412.db2.gz LKWXOVSYJBZVQK-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000825320538 623669817 /nfs/dbraw/zinc/66/98/17/623669817.db2.gz KZZIVYROYNWMMA-DGCLKSJQSA-N 0 3 282.815 2.926 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2c([O-])cccc2OC)CC1 ZINC000825321891 623671418 /nfs/dbraw/zinc/67/14/18/623671418.db2.gz QCFZQLNLMFCSOQ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2c([O-])cccc2OC)CC1 ZINC000825321891 623671420 /nfs/dbraw/zinc/67/14/20/623671420.db2.gz QCFZQLNLMFCSOQ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)c1[O-] ZINC000827489994 624016395 /nfs/dbraw/zinc/01/63/95/624016395.db2.gz ZWUNMRNDUIQZAD-PJXYFTJBSA-N 0 3 267.756 2.942 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(c2ccon2)CC1 ZINC000827630012 624048471 /nfs/dbraw/zinc/04/84/71/624048471.db2.gz TUCYOZVWVJRPEF-UHFFFAOYSA-N 0 3 288.347 2.768 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC3(COC3)C2)c1[O-] ZINC000827644670 624050328 /nfs/dbraw/zinc/05/03/28/624050328.db2.gz QGUMPIJFPBHYOG-UHFFFAOYSA-N 0 3 267.756 2.576 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC3(COC3)C2)c1[O-] ZINC000827644670 624050332 /nfs/dbraw/zinc/05/03/32/624050332.db2.gz QGUMPIJFPBHYOG-UHFFFAOYSA-N 0 3 267.756 2.576 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000827851282 624112000 /nfs/dbraw/zinc/11/20/00/624112000.db2.gz SGILBJVBIHSCMA-CALCHBBNSA-N 0 3 273.376 2.785 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000827851282 624112001 /nfs/dbraw/zinc/11/20/01/624112001.db2.gz SGILBJVBIHSCMA-CALCHBBNSA-N 0 3 273.376 2.785 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](c1ccncc1)C1(CO)CCC1 ZINC000827933638 624131608 /nfs/dbraw/zinc/13/16/08/624131608.db2.gz AATNBCCZHKAZOD-QGZVFWFLSA-N 0 3 298.386 2.781 20 10 CFCDHN C[C@@H](NC(=O)CN(C)CC(C)(C)C)c1ccccc1O ZINC000827956217 624137808 /nfs/dbraw/zinc/13/78/08/624137808.db2.gz IHRLMEUTAGUNLO-GFCCVEGCSA-N 0 3 278.396 2.547 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1CO)c1ccccc1[O-] ZINC000154090903 624264845 /nfs/dbraw/zinc/26/48/45/624264845.db2.gz GKBASSRIHUFPCO-LBPRGKRZSA-N 0 3 257.333 2.735 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000929977467 624340934 /nfs/dbraw/zinc/34/09/34/624340934.db2.gz UVSMBHDELREMHO-YPMHNXCESA-N 0 3 289.297 2.934 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000929977467 624340937 /nfs/dbraw/zinc/34/09/37/624340937.db2.gz UVSMBHDELREMHO-YPMHNXCESA-N 0 3 289.297 2.934 20 10 CFCDHN CCC[N@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000068973545 625040901 /nfs/dbraw/zinc/04/09/01/625040901.db2.gz JEUGRMLQINYATR-UHFFFAOYSA-N 0 3 259.353 2.538 20 10 CFCDHN CCC[N@@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000068973545 625040909 /nfs/dbraw/zinc/04/09/09/625040909.db2.gz JEUGRMLQINYATR-UHFFFAOYSA-N 0 3 259.353 2.538 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(F)ccc1[O-] ZINC000185369506 625720503 /nfs/dbraw/zinc/72/05/03/625720503.db2.gz MMVAVKNNJIJYOH-WDEREUQCSA-N 0 3 266.360 2.665 20 10 CFCDHN CC(C)(C)[S@](=O)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834588674 625727940 /nfs/dbraw/zinc/72/79/40/625727940.db2.gz DUJJXVSFRKIODB-HXPMCKFVSA-N 0 3 281.421 2.516 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CC[C@@H](CO)CC1)CC2 ZINC000834620744 625738558 /nfs/dbraw/zinc/73/85/58/625738558.db2.gz VNTMZHYZKMDOBA-YUTCNCBUSA-N 0 3 261.365 2.520 20 10 CFCDHN COc1cccc(CN[C@H](C)c2c(C)noc2C)c1O ZINC000073006963 625756169 /nfs/dbraw/zinc/75/61/69/625756169.db2.gz VWSLNJXJMITFAJ-SECBINFHSA-N 0 3 276.336 2.856 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@H](O)Cc1ccccc1 ZINC000834689087 625786238 /nfs/dbraw/zinc/78/62/38/625786238.db2.gz JKIGJBNQQWERDM-QANKJYHBSA-N 0 3 297.398 2.961 20 10 CFCDHN Cc1ncc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)s1 ZINC000834689920 625787338 /nfs/dbraw/zinc/78/73/38/625787338.db2.gz UJRXITRZXMFXET-CYBMUJFWSA-N 0 3 274.389 2.977 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCC2(CO)CC2)c2c1c(F)ccc2[O-] ZINC000834895970 625912445 /nfs/dbraw/zinc/91/24/45/625912445.db2.gz GFICKAMVWCYVMZ-PWSUYJOCSA-N 0 3 279.355 2.832 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC2(CO)CC2)c([O-])c1 ZINC000834896532 625912857 /nfs/dbraw/zinc/91/28/57/625912857.db2.gz KTTKMOIUZHVKMI-CYBMUJFWSA-N 0 3 263.381 2.822 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@]2(C)CCC(=O)N2)c1[O-] ZINC000834907843 625918947 /nfs/dbraw/zinc/91/89/47/625918947.db2.gz DJWFIGUXQRSXJV-BONVTDFDSA-N 0 3 296.798 2.673 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2cn(C)cn2)c2c1c(F)ccc2[O-] ZINC000840767525 625926218 /nfs/dbraw/zinc/92/62/18/625926218.db2.gz USTRSTSVDKHRQT-MFKMUULPSA-N 0 3 289.354 2.645 20 10 CFCDHN CC(C)[C@@H](C[NH2+]Cc1ccccc1[O-])c1ccnn1C ZINC000788075860 625965111 /nfs/dbraw/zinc/96/51/11/625965111.db2.gz KXDWBFAJEKWXJT-CQSZACIVSA-N 0 3 273.380 2.655 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC(O)(CC)CC)c([O-])c1 ZINC000788078638 625986787 /nfs/dbraw/zinc/98/67/87/625986787.db2.gz YCUNKOGQLWIMHL-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN C[C@@H](N[C@@H](CCO)c1ccco1)c1ccccc1O ZINC000186561563 626334260 /nfs/dbraw/zinc/33/42/60/626334260.db2.gz PMHOAAIBPUHQEP-YPMHNXCESA-N 0 3 261.321 2.760 20 10 CFCDHN Oc1cc2c(cc1CN[C@H]1CCCc3cccnc31)OCO2 ZINC000922882217 626386697 /nfs/dbraw/zinc/38/66/97/626386697.db2.gz VRUFUQDDBPIAAP-ZDUSSCGKSA-N 0 3 298.342 2.683 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CCC2(CCC2)O1 ZINC000922969962 626436384 /nfs/dbraw/zinc/43/63/84/626436384.db2.gz XZUBFYVCMXZLCK-CYBMUJFWSA-N 0 3 291.391 2.982 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H](C)O ZINC000824921332 626480563 /nfs/dbraw/zinc/48/05/63/626480563.db2.gz JENFSBIXYZZYKO-SKDRFNHKSA-N 0 3 257.761 2.603 20 10 CFCDHN Oc1ccccc1CN(Cc1ccco1)C[C@H](O)C1CC1 ZINC000838893517 626514457 /nfs/dbraw/zinc/51/44/57/626514457.db2.gz DFHFSDXELIJBLI-KRWDZBQOSA-N 0 3 287.359 2.758 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](Cc1ccco1)C[C@H](O)C1CC1 ZINC000838893517 626514458 /nfs/dbraw/zinc/51/44/58/626514458.db2.gz DFHFSDXELIJBLI-KRWDZBQOSA-N 0 3 287.359 2.758 20 10 CFCDHN [O-]c1ccccc1C[N@H+](Cc1ccco1)C[C@H](O)C1CC1 ZINC000838893517 626514459 /nfs/dbraw/zinc/51/44/59/626514459.db2.gz DFHFSDXELIJBLI-KRWDZBQOSA-N 0 3 287.359 2.758 20 10 CFCDHN CCOC[C@H]1CCCC[N@@H+]1Cc1c([O-])cccc1OC ZINC000839169709 626529388 /nfs/dbraw/zinc/52/93/88/626529388.db2.gz HYRLWCFFZXSMPL-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOC[C@H]1CCCC[N@H+]1Cc1c([O-])cccc1OC ZINC000839169709 626529389 /nfs/dbraw/zinc/52/93/89/626529389.db2.gz HYRLWCFFZXSMPL-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC13CCC(CC1)C3)OCO2 ZINC000756988846 626543165 /nfs/dbraw/zinc/54/31/65/626543165.db2.gz DNNQNEUDNWCPJG-UHFFFAOYSA-N 0 3 275.348 2.791 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCO2)c1cccc(CO)c1 ZINC000760174024 626717414 /nfs/dbraw/zinc/71/74/14/626717414.db2.gz WWICJKIXOZCRLD-ZDUSSCGKSA-N 0 3 283.371 2.965 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1COC(C)(C)O1 ZINC000851791798 634531484 /nfs/dbraw/zinc/53/14/84/634531484.db2.gz GWVQZAHQHURYNV-CQSZACIVSA-N 0 3 279.380 2.756 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1COC(C)(C)O1 ZINC000851791798 634531485 /nfs/dbraw/zinc/53/14/85/634531485.db2.gz GWVQZAHQHURYNV-CQSZACIVSA-N 0 3 279.380 2.756 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763697617 627006281 /nfs/dbraw/zinc/00/62/81/627006281.db2.gz NZDNNAOAAZYOHN-AWEZNQCLSA-N 0 3 289.375 2.700 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763697617 627006285 /nfs/dbraw/zinc/00/62/85/627006285.db2.gz NZDNNAOAAZYOHN-AWEZNQCLSA-N 0 3 289.375 2.700 20 10 CFCDHN C[C@@H]([NH2+]CCOCC1CCC1)c1cc(F)ccc1[O-] ZINC000765808316 627158728 /nfs/dbraw/zinc/15/87/28/627158728.db2.gz JHSDEBYGERHGKD-LLVKDONJSA-N 0 3 267.344 2.999 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000767730400 627280910 /nfs/dbraw/zinc/28/09/10/627280910.db2.gz YVTNSAMKSWLAML-AWEZNQCLSA-N 0 3 299.370 2.754 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCCCCCC1)[C@H](O)CO2 ZINC000768437683 627342923 /nfs/dbraw/zinc/34/29/23/627342923.db2.gz CTGJOBCJMKMJST-OAHLLOKOSA-N 0 3 277.364 2.584 20 10 CFCDHN CC[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768448431 627344209 /nfs/dbraw/zinc/34/42/09/627344209.db2.gz UXABBWNJKVYARL-LRDDRELGSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC1 ZINC000768448431 627344210 /nfs/dbraw/zinc/34/42/10/627344210.db2.gz UXABBWNJKVYARL-LRDDRELGSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cccc(CN2CC(C)(C)OCC2(C)C)c1O ZINC000769445377 627439513 /nfs/dbraw/zinc/43/95/13/627439513.db2.gz HEJWVPNSJYUPHA-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)N(C)C ZINC000773018928 627769921 /nfs/dbraw/zinc/76/99/21/627769921.db2.gz JKESNTARTHJBIP-BBRMVZONSA-N 0 3 291.439 2.516 20 10 CFCDHN CCN(C)c1ccc(CN2CCN(C3CCC3)CC2)cc1 ZINC000773756456 627855292 /nfs/dbraw/zinc/85/52/92/627855292.db2.gz LOUHUZUBUSXRMH-UHFFFAOYSA-N 0 3 287.451 2.813 20 10 CFCDHN CCCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000774480982 627931635 /nfs/dbraw/zinc/93/16/35/627931635.db2.gz GPFZOCCNMIKKQB-ZIAGYGMSSA-N 0 3 291.439 2.708 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1ccc(OCC)cc1[O-] ZINC000775176234 627998419 /nfs/dbraw/zinc/99/84/19/627998419.db2.gz MJYSUPRHYNAZET-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1ccc(OCC)cc1[O-] ZINC000775176234 627998422 /nfs/dbraw/zinc/99/84/22/627998422.db2.gz MJYSUPRHYNAZET-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN C[C@H](NCc1cnc2cnccn12)c1ccc(N(C)C)cc1 ZINC000775363312 628015912 /nfs/dbraw/zinc/01/59/12/628015912.db2.gz MPIUNRFVOCIGFM-ZDUSSCGKSA-N 0 3 295.390 2.646 20 10 CFCDHN CC[C@H]([NH2+]CCN1CC[C@@H](C)C1)c1ccccc1[O-] ZINC000775416707 628023640 /nfs/dbraw/zinc/02/36/40/628023640.db2.gz XPEFNCHDJHWSKN-HIFRSBDPSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)Cc1cnccn1)c1ccccc1[O-] ZINC000775495833 628031708 /nfs/dbraw/zinc/03/17/08/628031708.db2.gz CSWFKSOCLSIKEM-SWLSCSKDSA-N 0 3 271.364 2.854 20 10 CFCDHN CC[C@@H]([NH2+]CC1(CCO)CCC1)c1ccccc1[O-] ZINC000775522423 628033922 /nfs/dbraw/zinc/03/39/22/628033922.db2.gz PBJFEMDRRMDVDS-CQSZACIVSA-N 0 3 263.381 2.986 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000775587254 628043282 /nfs/dbraw/zinc/04/32/82/628043282.db2.gz VFLMTYAUSGJZHW-ZBAXXZLZSA-N 0 3 279.355 2.973 20 10 CFCDHN CCC(C)(C)NC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775829947 628073338 /nfs/dbraw/zinc/07/33/38/628073338.db2.gz BHIJCHCQRMNDTI-ZDUSSCGKSA-N 0 3 291.439 2.708 20 10 CFCDHN COc1ccc(CNCc2ccc(Cl)cn2)c(O)c1 ZINC000776254997 628122919 /nfs/dbraw/zinc/12/29/19/628122919.db2.gz SHKDYYNCRQNWAB-UHFFFAOYSA-N 0 3 278.739 2.739 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@@H](C)[C@@H](OC)C2(C)C)c([O-])c1 ZINC000776497650 628154239 /nfs/dbraw/zinc/15/42/39/628154239.db2.gz DVRLRKAIRMRHBE-HFBAOOFYSA-N 0 3 293.407 2.940 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000777440129 628226085 /nfs/dbraw/zinc/22/60/85/628226085.db2.gz UYEQMHOTCGBDDH-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000777440129 628226087 /nfs/dbraw/zinc/22/60/87/628226087.db2.gz UYEQMHOTCGBDDH-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC1(O)CCC([NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000779106186 628353256 /nfs/dbraw/zinc/35/32/56/628353256.db2.gz MDVFIBJBCRQBIZ-UHFFFAOYSA-N 0 3 267.344 2.705 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000779188653 628358908 /nfs/dbraw/zinc/35/89/08/628358908.db2.gz WCBQFZMJXMLKSR-CQSZACIVSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000779188653 628358910 /nfs/dbraw/zinc/35/89/10/628358910.db2.gz WCBQFZMJXMLKSR-CQSZACIVSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CC1(O)CCCCCC1 ZINC000779203651 628360383 /nfs/dbraw/zinc/36/03/83/628360383.db2.gz GHEUQYRYPURPKX-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CC1(O)CCCCCC1 ZINC000779203651 628360385 /nfs/dbraw/zinc/36/03/85/628360385.db2.gz GHEUQYRYPURPKX-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1ccc(O)c(CN2CCC[C@H](OC(F)F)C2)c1 ZINC000781532126 628557620 /nfs/dbraw/zinc/55/76/20/628557620.db2.gz LZCVHUQLVKCBFH-LBPRGKRZSA-N 0 3 287.306 2.604 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3[nH]c(=O)[nH]c3c2)cc1 ZINC000784619066 628831821 /nfs/dbraw/zinc/83/18/21/628831821.db2.gz PXYFSXFJNVPJNI-UHFFFAOYSA-N 0 3 296.374 2.624 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000784667706 628835613 /nfs/dbraw/zinc/83/56/13/628835613.db2.gz KCSMGXYOBCWAMA-INIZCTEOSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C(C)(C)C2CCOCC2)c1 ZINC000785608528 628898391 /nfs/dbraw/zinc/89/83/91/628898391.db2.gz WROKYCKNJJEJPD-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccnn1-c1ccccc1 ZINC000790468863 629241117 /nfs/dbraw/zinc/24/11/17/629241117.db2.gz AFTZDEBPCOMNLV-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000790934134 629272372 /nfs/dbraw/zinc/27/23/72/629272372.db2.gz FZAFHDBCYZGUKN-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000790934134 629272373 /nfs/dbraw/zinc/27/23/73/629272373.db2.gz FZAFHDBCYZGUKN-HIFRSBDPSA-N 0 3 293.407 2.916 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000790949837 629273622 /nfs/dbraw/zinc/27/36/22/629273622.db2.gz PMSWXSSICMODCV-OLZOCXBDSA-N 0 3 298.789 2.901 20 10 CFCDHN COc1cc(CNC/C=C/c2ccc(N(C)C)cc2)ccn1 ZINC000835036182 629328531 /nfs/dbraw/zinc/32/85/31/629328531.db2.gz BBKHFFZOOHJVPI-SNAWJCMRSA-N 0 3 297.402 2.959 20 10 CFCDHN CCn1cc(CNC/C=C/c2ccc(N(C)C)cc2)cn1 ZINC000835039016 629332813 /nfs/dbraw/zinc/33/28/13/629332813.db2.gz ACFSFEHOIPEVQK-AATRIKPKSA-N 0 3 284.407 2.772 20 10 CFCDHN CN(C)c1ccc(/C=C/CN(C)CCc2cnccn2)cc1 ZINC000835043761 629339204 /nfs/dbraw/zinc/33/92/04/629339204.db2.gz CBWFMXFCPZMFTO-SNAWJCMRSA-N 0 3 296.418 2.730 20 10 CFCDHN CN(C)c1ccc(/C=C\CN(C)CCc2cnccn2)cc1 ZINC000835043760 629340260 /nfs/dbraw/zinc/34/02/60/629340260.db2.gz CBWFMXFCPZMFTO-PLNGDYQASA-N 0 3 296.418 2.730 20 10 CFCDHN Oc1ccccc1CN(C[C@H]1CCCO1)CC1(F)CC1 ZINC000792766061 629449871 /nfs/dbraw/zinc/44/98/71/629449871.db2.gz MWFBESSDOTUWLB-CQSZACIVSA-N 0 3 279.355 2.875 20 10 CFCDHN Cc1ccc(CN(CCO)Cc2cccc(C)c2O)o1 ZINC000793364870 629532117 /nfs/dbraw/zinc/53/21/17/629532117.db2.gz HTIPPXOCBBCXEP-UHFFFAOYSA-N 0 3 275.348 2.597 20 10 CFCDHN COc1ccc(C[NH2+]Cc2[nH]nc3ccccc32)c([O-])c1 ZINC000793389160 629536172 /nfs/dbraw/zinc/53/61/72/629536172.db2.gz XOSLEVILVSAUTN-UHFFFAOYSA-N 0 3 283.331 2.567 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCN(C)C1)c1ccc(C)cc1[O-] ZINC000794804797 629688164 /nfs/dbraw/zinc/68/81/64/629688164.db2.gz WGGDTGIBXVXDOH-UKRRQHHQSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]CC(=O)NC1CCCC1)c1ccc(C)cc1[O-] ZINC000794808733 629688836 /nfs/dbraw/zinc/68/88/36/629688836.db2.gz BVMPMEIAVAOLHL-HNNXBMFYSA-N 0 3 290.407 2.800 20 10 CFCDHN CC[C@@H]([NH2+]CC1(CCO)CC1)c1ccc(C)cc1[O-] ZINC000794811895 629689513 /nfs/dbraw/zinc/68/95/13/629689513.db2.gz ABTWWDYRIJGWCM-CQSZACIVSA-N 0 3 263.381 2.904 20 10 CFCDHN CC[C@H]([NH2+]CCc1nncn1CC)c1ccc(C)cc1[O-] ZINC000794811897 629689629 /nfs/dbraw/zinc/68/96/29/629689629.db2.gz UMACQDKVJTUPIY-AWEZNQCLSA-N 0 3 288.395 2.595 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)COCCOC)c1ccc(C)cc1[O-] ZINC000794818692 629690288 /nfs/dbraw/zinc/69/02/88/629690288.db2.gz UWANZCXRFUMQJY-UKRRQHHQSA-N 0 3 281.396 2.793 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CO)CC(F)F)c1ccc(C)cc1[O-] ZINC000794817698 629690568 /nfs/dbraw/zinc/69/05/68/629690568.db2.gz UUJCCNXQDNCQDS-ZYHUDNBSSA-N 0 3 273.323 2.757 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000796758380 629961371 /nfs/dbraw/zinc/96/13/71/629961371.db2.gz DHLULDRVQCEDCX-DOMZBBRYSA-N 0 3 280.387 2.914 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000798503282 630197381 /nfs/dbraw/zinc/19/73/81/630197381.db2.gz FPQPKDKZDDMFFP-CQSZACIVSA-N 0 3 293.407 2.679 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000798963816 630265246 /nfs/dbraw/zinc/26/52/46/630265246.db2.gz GAHMIVLRYYBXIK-ZDUSSCGKSA-N 0 3 254.333 2.777 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000798963816 630265251 /nfs/dbraw/zinc/26/52/51/630265251.db2.gz GAHMIVLRYYBXIK-ZDUSSCGKSA-N 0 3 254.333 2.777 20 10 CFCDHN C[C@@H](CN(C)C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000806169921 630779198 /nfs/dbraw/zinc/77/91/98/630779198.db2.gz MAOHUPDJLNPQNO-NHCYSSNCSA-N 0 3 266.360 2.619 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccccc1-n1cccn1 ZINC000040495444 649985090 /nfs/dbraw/zinc/98/50/90/649985090.db2.gz VXNGWXITLVWTOL-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN COCC(C)(C)CCC[NH2+]Cc1c([O-])cccc1OC ZINC000808428198 630990711 /nfs/dbraw/zinc/99/07/11/630990711.db2.gz BZTRHTNINXCOBP-UHFFFAOYSA-N 0 3 281.396 2.943 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCNC(=O)C2CC2)c1[O-] ZINC000808672713 631025969 /nfs/dbraw/zinc/02/59/69/631025969.db2.gz RQOQUPFAWSSYIW-SNVBAGLBSA-N 0 3 296.798 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC2(CO)CC2)c1[O-] ZINC000808701110 631031261 /nfs/dbraw/zinc/03/12/61/631031261.db2.gz WIWJGLGMFUIEQW-JTQLQIEISA-N 0 3 269.772 2.777 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(=O)NCC2CC2)c1[O-] ZINC000808714028 631033069 /nfs/dbraw/zinc/03/30/69/631033069.db2.gz RNJURPWTIZQCLW-SNVBAGLBSA-N 0 3 296.798 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCCO)c1[O-] ZINC000808716823 631034776 /nfs/dbraw/zinc/03/47/76/631034776.db2.gz WVKKNQOILDNCEZ-SNVBAGLBSA-N 0 3 257.761 2.777 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C1CC1)N(C)C)c1ccccc1[O-] ZINC000155228174 650004589 /nfs/dbraw/zinc/00/45/89/650004589.db2.gz UDFKYIPSAFDSJD-HUUCEWRRSA-N 0 3 262.397 2.773 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C2CCN(C)CC2)c(Cl)c1 ZINC000840871887 631247135 /nfs/dbraw/zinc/24/71/35/631247135.db2.gz HBLARQONABGRGW-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@@H](O)C(C)C ZINC000840881264 631250166 /nfs/dbraw/zinc/25/01/66/631250166.db2.gz HCUHQRMWTDGEQH-XEZPLFJOSA-N 0 3 263.381 2.765 20 10 CFCDHN CCN1CCN(Cc2cc(Cl)cc(OC)c2O)[C@@H](C)C1 ZINC000809698328 631266892 /nfs/dbraw/zinc/26/68/92/631266892.db2.gz YIEUBYUIKATZAT-NSHDSACASA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cccc(CNCc2cnn(C(C)(C)C)c2)c1O ZINC000809740147 631275175 /nfs/dbraw/zinc/27/51/75/631275175.db2.gz MWJOUGHCISJYHT-UHFFFAOYSA-N 0 3 289.379 2.642 20 10 CFCDHN CC(C)C[C@@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841038520 631315672 /nfs/dbraw/zinc/31/56/72/631315672.db2.gz LIEQHHGYBUXSKB-LBPRGKRZSA-N 0 3 256.777 2.509 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](N)c2ccccc2)c([O-])c1 ZINC000841037380 631316387 /nfs/dbraw/zinc/31/63/87/631316387.db2.gz OVVWVEALVVTEOL-MRXNPFEDSA-N 0 3 286.375 2.581 20 10 CFCDHN C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1C[NH3+] ZINC000841099364 631339951 /nfs/dbraw/zinc/33/99/51/631339951.db2.gz IVFRGUSYLBFPLD-ZJUUUORDSA-N 0 3 286.778 2.601 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@@]3(CCSC3)C2)c1 ZINC000842626110 631684398 /nfs/dbraw/zinc/68/43/98/631684398.db2.gz UYFWKZSBVFRIJD-INIZCTEOSA-N 0 3 293.432 2.717 20 10 CFCDHN COCC1(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])CC1 ZINC000842890142 631775099 /nfs/dbraw/zinc/77/50/99/631775099.db2.gz AJAYMCVZGGZABW-LLVKDONJSA-N 0 3 267.344 2.999 20 10 CFCDHN CC[C@H](C)C[C@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000842915947 631781941 /nfs/dbraw/zinc/78/19/41/631781941.db2.gz HZLNJWUKNIRZJT-YUTCNCBUSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H](C)[NH2+][C@@H](C)C2)c(Cl)c1 ZINC000843049556 631814712 /nfs/dbraw/zinc/81/47/12/631814712.db2.gz PWFVZAYDYQXSRE-PHIMTYICSA-N 0 3 268.788 2.536 20 10 CFCDHN C[C@H]([NH3+])[C@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000843052415 631816713 /nfs/dbraw/zinc/81/67/13/631816713.db2.gz SUQLSTIOUSSZCN-UWVGGRQHSA-N 0 3 286.778 2.744 20 10 CFCDHN CN(C)c1ccc(CN(Cc2ccc(N)nc2)C2CC2)cc1 ZINC000843060941 631823106 /nfs/dbraw/zinc/82/31/06/631823106.db2.gz SPYJINZQIPWCFL-UHFFFAOYSA-N 0 3 296.418 2.894 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@]3(CC[NH2+]C3)C2)c(Cl)c1 ZINC000843120302 631841850 /nfs/dbraw/zinc/84/18/50/631841850.db2.gz DLZJIYDLROSUDV-OAHLLOKOSA-N 0 3 280.799 2.539 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CCC[C@]2(CC[NH2+]C2)C1 ZINC000843124341 631842953 /nfs/dbraw/zinc/84/29/53/631842953.db2.gz YPZGBYFMPQWIDB-OAHLLOKOSA-N 0 3 280.799 2.621 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccccc2[O-])CC2(CCCC2)O1 ZINC000843435029 631959425 /nfs/dbraw/zinc/95/94/25/631959425.db2.gz PUARQJVDBWDQOD-ZDUSSCGKSA-N 0 3 261.365 2.926 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccccc2[O-])CC2(CCCC2)O1 ZINC000843435029 631959432 /nfs/dbraw/zinc/95/94/32/631959432.db2.gz PUARQJVDBWDQOD-ZDUSSCGKSA-N 0 3 261.365 2.926 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCN1C ZINC000844301726 632161978 /nfs/dbraw/zinc/16/19/78/632161978.db2.gz WWSRORSPMYRMSN-OAHLLOKOSA-N 0 3 262.397 2.698 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCN1C ZINC000844301726 632161985 /nfs/dbraw/zinc/16/19/85/632161985.db2.gz WWSRORSPMYRMSN-OAHLLOKOSA-N 0 3 262.397 2.698 20 10 CFCDHN Cc1cc(CN2CCC(O)(C(F)F)CC2)ccc1N(C)C ZINC000815095164 632200206 /nfs/dbraw/zinc/20/02/06/632200206.db2.gz AMUGPGAVEZZHGD-UHFFFAOYSA-N 0 3 298.377 2.653 20 10 CFCDHN C[N@@H+]1CCC[C@@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000816642452 632500785 /nfs/dbraw/zinc/50/07/85/632500785.db2.gz ZUZYJECCKAAZMT-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN C[N@H+]1CCC[C@@]2(CCN(Cc3cccc(Cl)c3[O-])C2)C1 ZINC000816642452 632500788 /nfs/dbraw/zinc/50/07/88/632500788.db2.gz ZUZYJECCKAAZMT-MRXNPFEDSA-N 0 3 294.826 2.963 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C ZINC000816648507 632504090 /nfs/dbraw/zinc/50/40/90/632504090.db2.gz LLYSBOWKEJKTSL-CHWSQXEVSA-N 0 3 278.371 2.503 20 10 CFCDHN COC[C@@H](CC(C)(C)C)[NH2+]Cc1ccccc1[O-] ZINC000845928694 632598619 /nfs/dbraw/zinc/59/86/19/632598619.db2.gz FMMZHVNHXKUKCZ-CYBMUJFWSA-N 0 3 251.370 2.933 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@](C)(O)c1ccccc1 ZINC000846040337 632620791 /nfs/dbraw/zinc/62/07/91/632620791.db2.gz WGJJDIGJUPQQAU-YVEFUNNKSA-N 0 3 289.350 2.917 20 10 CFCDHN CCCN1C[C@H](C[NH2+][C@H](CC)c2ccccc2[O-])CC1=O ZINC000817411722 632623486 /nfs/dbraw/zinc/62/34/86/632623486.db2.gz UOQXNGUMIYCFGR-DZGCQCFKSA-N 0 3 290.407 2.691 20 10 CFCDHN Cc1cc(CNCc2ccc3c(c2)CCO3)cc(C)n1 ZINC000817410056 632623581 /nfs/dbraw/zinc/62/35/81/632623581.db2.gz IOSLUZIFPUAGQY-UHFFFAOYSA-N 0 3 268.360 2.923 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2ccc(C)nc2)cc1 ZINC000846053461 632625788 /nfs/dbraw/zinc/62/57/88/632625788.db2.gz YDWTWLBJNNYWJD-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CC[C@@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000817414713 632626346 /nfs/dbraw/zinc/62/63/46/632626346.db2.gz ITSXZLDWBOVVAZ-CHWSQXEVSA-N 0 3 253.317 2.579 20 10 CFCDHN COc1cccc([C@H](C)N[C@H]2CCCc3c[nH]nc32)c1O ZINC000846154729 632648835 /nfs/dbraw/zinc/64/88/35/632648835.db2.gz RQMUOCATXOIXAS-GWCFXTLKSA-N 0 3 287.363 2.852 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000846182813 632655026 /nfs/dbraw/zinc/65/50/26/632655026.db2.gz DMUXBGKPXDGLEY-YUTCNCBUSA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@H](COCC1CC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000846205009 632659718 /nfs/dbraw/zinc/65/97/18/632659718.db2.gz LYJNWLHVPVTMKI-RISCZKNCSA-N 0 3 261.365 2.784 20 10 CFCDHN C[C@H](COCC1CC1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000846206428 632660044 /nfs/dbraw/zinc/66/00/44/632660044.db2.gz YRUDVNQITKORTE-MNOVXSKESA-N 0 3 267.344 2.997 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCN2CCCC2=O)c1[O-] ZINC000846204722 632660162 /nfs/dbraw/zinc/66/01/62/632660162.db2.gz AZOOAZGFSINRFA-LLVKDONJSA-N 0 3 296.798 2.627 20 10 CFCDHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1cc(Cl)ccc1O ZINC000846475744 632716762 /nfs/dbraw/zinc/71/67/62/632716762.db2.gz HXAQDZZNQMRXDH-PHIMTYICSA-N 0 3 296.798 2.535 20 10 CFCDHN C[C@H](NC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1[O-] ZINC000817951680 632751698 /nfs/dbraw/zinc/75/16/98/632751698.db2.gz JIZYKXKGEIQXJG-ONGXEEELSA-N 0 3 299.212 2.557 20 10 CFCDHN Nc1ccc(CC[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000817956950 632755347 /nfs/dbraw/zinc/75/53/47/632755347.db2.gz GLLBWGJXTMRBQZ-HNNXBMFYSA-N 0 3 268.360 2.794 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CN)CC(C)C)c1ccc(F)cc1[O-] ZINC000817957922 632757265 /nfs/dbraw/zinc/75/72/65/632757265.db2.gz GEAZUAJOXCJLMI-TZMCWYRMSA-N 0 3 268.376 2.945 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CN)c1ccc(C(F)(F)F)cc1[O-] ZINC000817966587 632765405 /nfs/dbraw/zinc/76/54/05/632765405.db2.gz QNRSHKKDCCOUPS-KCJUWKMLSA-N 0 3 276.302 2.799 20 10 CFCDHN CCN[C@H](C)C[NH2+][C@H](CC)c1ccc(F)cc1[O-] ZINC000817972871 632772348 /nfs/dbraw/zinc/77/23/48/632772348.db2.gz OTMPTMIOVWLVGE-ZWNOBZJWSA-N 0 3 254.349 2.570 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)N)c1ccc(C(F)(F)F)cc1[O-] ZINC000817973527 632773289 /nfs/dbraw/zinc/77/32/89/632773289.db2.gz UVOMQAVGPKNGBI-GZMMTYOYSA-N 0 3 276.302 2.799 20 10 CFCDHN CC[C@H](N)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817979885 632776979 /nfs/dbraw/zinc/77/69/79/632776979.db2.gz PXROJGOKGBFWOE-IUCAKERBSA-N 0 3 276.302 2.799 20 10 CFCDHN CC[C@@H](N[C@@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 ZINC000817981078 632778037 /nfs/dbraw/zinc/77/80/37/632778037.db2.gz PSRMXUNYKPQOBD-HUUCEWRRSA-N 0 3 297.393 2.791 20 10 CFCDHN CN(Cc1cc(C(C)(C)C)cc(O)c1O)[C@H]1CCOC1 ZINC000106857600 632987294 /nfs/dbraw/zinc/98/72/94/632987294.db2.gz TTXMJOOBUQVBIF-ZDUSSCGKSA-N 0 3 279.380 2.616 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)c1[O-] ZINC000857060699 635922217 /nfs/dbraw/zinc/92/22/17/635922217.db2.gz DZAHSYONVRGUOC-ZYHUDNBSSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c1[O-] ZINC000857060699 635922220 /nfs/dbraw/zinc/92/22/20/635922220.db2.gz DZAHSYONVRGUOC-ZYHUDNBSSA-N 0 3 299.798 2.505 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CC1)[C@H]1CCCCO1 ZINC000848559592 633289451 /nfs/dbraw/zinc/28/94/51/633289451.db2.gz GBCKGWXRDKWKPS-HZPDHXFCSA-N 0 3 261.365 2.830 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848925382 633408827 /nfs/dbraw/zinc/40/88/27/633408827.db2.gz UGXTVEPOCOCJGP-AWEZNQCLSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848925382 633408828 /nfs/dbraw/zinc/40/88/28/633408828.db2.gz UGXTVEPOCOCJGP-AWEZNQCLSA-N 0 3 291.391 2.934 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C[C@H](C)O)C2CC2)c1[O-] ZINC000848929537 633411905 /nfs/dbraw/zinc/41/19/05/633411905.db2.gz XZKADUZWRIFPNO-JTQLQIEISA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C[C@H](C)O)C2CC2)c1[O-] ZINC000848929537 633411908 /nfs/dbraw/zinc/41/19/08/633411908.db2.gz XZKADUZWRIFPNO-JTQLQIEISA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cccc(CNc2ccc([C@H]3CNCCO3)cc2)c1O ZINC000849352075 633626989 /nfs/dbraw/zinc/62/69/89/633626989.db2.gz HDTDIZWBNULAGA-QGZVFWFLSA-N 0 3 298.386 2.974 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnc(C)n2C)cc1 ZINC000850035173 633796870 /nfs/dbraw/zinc/79/68/70/633796870.db2.gz WWADFWSRXCCTPX-UHFFFAOYSA-N 0 3 286.423 2.865 20 10 CFCDHN COc1cccc(O)c1CN[C@H]1C[C@@H](O)c2ccccc21 ZINC000850370983 633960735 /nfs/dbraw/zinc/96/07/35/633960735.db2.gz HGRYBUWVLBOIPQ-GOEBONIOSA-N 0 3 285.343 2.669 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC[C@H](C)O2)c([O-])c1 ZINC000850379248 633966645 /nfs/dbraw/zinc/96/66/45/633966645.db2.gz IUUNPSBOHYCBGG-SWLSCSKDSA-N 0 3 279.380 2.838 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@]1(C)CC1(F)F ZINC000850380899 633967789 /nfs/dbraw/zinc/96/77/89/633967789.db2.gz PXTDGVXKHWNFSL-CYBMUJFWSA-N 0 3 271.307 2.926 20 10 CFCDHN CNC(=O)CC1(C[NH2+]Cc2ccccc2[O-])CCCCC1 ZINC000850399360 633978226 /nfs/dbraw/zinc/97/82/26/633978226.db2.gz KGMMBGNNTVEKLT-UHFFFAOYSA-N 0 3 290.407 2.568 20 10 CFCDHN Cc1cc(CN[C@@H]2CCCn3nccc32)ccc1N(C)C ZINC000850442391 633994522 /nfs/dbraw/zinc/99/45/22/633994522.db2.gz CQRULPHTTDLGQK-OAHLLOKOSA-N 0 3 284.407 2.882 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2CC23CC3)cc1F ZINC000858182637 636149260 /nfs/dbraw/zinc/14/92/60/636149260.db2.gz AULDNSOPCZAIDT-ZDUSSCGKSA-N 0 3 252.308 2.673 20 10 CFCDHN COC1CC(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000850482014 634012164 /nfs/dbraw/zinc/01/21/64/634012164.db2.gz LYJIUXCMGMULIB-ZBOXLXRLSA-N 0 3 267.344 2.997 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](OC)[C@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000850484942 634013653 /nfs/dbraw/zinc/01/36/53/634013653.db2.gz VFPGQJDPDJCJAY-JLJPHGGASA-N 0 3 293.407 2.793 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](COC)OC)c1ccc(C)cc1[O-] ZINC000850487329 634014908 /nfs/dbraw/zinc/01/49/08/634014908.db2.gz ZCRIKYQOGSDJQH-ZFWWWQNUSA-N 0 3 281.396 2.793 20 10 CFCDHN C[C@H]([NH2+][C@H]1Cc2ccccc2N(C)C1=O)c1ccccc1[O-] ZINC000850500744 634019719 /nfs/dbraw/zinc/01/97/19/634019719.db2.gz IYWHATVVVPMUFQ-WFASDCNBSA-N 0 3 296.370 2.631 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C/C=C/CO)c1[O-] ZINC000850506550 634022662 /nfs/dbraw/zinc/02/26/62/634022662.db2.gz ANMAYYSPGRDWBM-HMDXOVGESA-N 0 3 255.745 2.553 20 10 CFCDHN Cc1ccncc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000850505198 634022688 /nfs/dbraw/zinc/02/26/88/634022688.db2.gz OVTXPCFGYHUTRV-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H](C)C2(CO)CC2)c([O-])c1 ZINC000850513168 634026358 /nfs/dbraw/zinc/02/63/58/634026358.db2.gz CPXJKXZFLVDDQW-QWHCGFSZSA-N 0 3 263.381 2.821 20 10 CFCDHN C[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cc(F)ccc1[O-] ZINC000850534862 634041144 /nfs/dbraw/zinc/04/11/44/634041144.db2.gz OKHQIJXRSCTGAP-SNVBAGLBSA-N 0 3 289.354 2.993 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](O)C23CCC3)c2c1c(F)ccc2[O-] ZINC000850545415 634046432 /nfs/dbraw/zinc/04/64/32/634046432.db2.gz GVTXNIABALXGLK-QEGRKFQGSA-N 0 3 291.366 2.973 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)CC2CC2)c([O-])c1 ZINC000850546427 634047698 /nfs/dbraw/zinc/04/76/98/634047698.db2.gz ZQJLGNPEWNDVQN-JSGCOSHPSA-N 0 3 263.381 2.760 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)[C@@]1(O)CCCOC1)c1ccccc1[O-] ZINC000850561133 634053702 /nfs/dbraw/zinc/05/37/02/634053702.db2.gz HZZCNLMFOATDIS-SUMWQHHRSA-N 0 3 293.407 2.611 20 10 CFCDHN COC(=O)c1ccc([C@@H](C)N(C)Cc2ccccc2O)o1 ZINC000111235856 634963456 /nfs/dbraw/zinc/96/34/56/634963456.db2.gz GSWCPFHJOSQMQF-LLVKDONJSA-N 0 3 289.331 2.965 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CCC4(COC4)C3)c2c1 ZINC000853594454 635045172 /nfs/dbraw/zinc/04/51/72/635045172.db2.gz FJUORSPDWTVLEC-UHFFFAOYSA-N 0 3 299.370 2.776 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CCC4(COC4)C3)c2c1 ZINC000853594454 635045175 /nfs/dbraw/zinc/04/51/75/635045175.db2.gz FJUORSPDWTVLEC-UHFFFAOYSA-N 0 3 299.370 2.776 20 10 CFCDHN CC1(c2ccccc2)CN(Cc2cc3c(cc2O)OCO3)C1 ZINC000857058722 635920273 /nfs/dbraw/zinc/92/02/73/635920273.db2.gz SQQYHRGGNJYAHB-UHFFFAOYSA-N 0 3 297.354 2.894 20 10 CFCDHN CCC(O)(CC)CNCc1cc(F)c(N(C)C)cc1F ZINC000858116517 636132229 /nfs/dbraw/zinc/13/22/29/636132229.db2.gz MXKNZGPDLWLCFW-UHFFFAOYSA-N 0 3 286.366 2.672 20 10 CFCDHN CCC[C@@](C)(O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135333 636135249 /nfs/dbraw/zinc/13/52/49/636135249.db2.gz RNUTUXWMJITPSP-OAHLLOKOSA-N 0 3 286.366 2.672 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@H](CO)CC2CC2)cc1F ZINC000858193634 636152492 /nfs/dbraw/zinc/15/24/92/636152492.db2.gz YWDGCXNECVSDTO-GFCCVEGCSA-N 0 3 298.377 2.529 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H]2COC3(CCC3)C2)cc1F ZINC000858189964 636153268 /nfs/dbraw/zinc/15/32/68/636153268.db2.gz WOSGXRAYEGGJLC-LBPRGKRZSA-N 0 3 296.361 2.832 20 10 CFCDHN C/C=C/C[NH2+]Cc1cc(Br)cc(OC)c1[O-] ZINC000858290773 636177133 /nfs/dbraw/zinc/17/71/33/636177133.db2.gz HFSFVCLCNVJLJB-ONEGZZNKSA-N 0 3 286.169 2.829 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000858484968 636267794 /nfs/dbraw/zinc/26/77/94/636267794.db2.gz HHGPNZGNGDGDRW-QWHCGFSZSA-N 0 3 251.370 2.840 20 10 CFCDHN CCOC(=O)C1=CC[C@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000858506588 636275917 /nfs/dbraw/zinc/27/59/17/636275917.db2.gz VCADZDZMBHXJSO-GWCFXTLKSA-N 0 3 293.338 2.834 20 10 CFCDHN Cc1ncc(CNCCCSc2nccs2)o1 ZINC000862281763 637310968 /nfs/dbraw/zinc/31/09/68/637310968.db2.gz VPLKGTZBUQZZGH-UHFFFAOYSA-N 0 3 269.395 2.712 20 10 CFCDHN CCCCCNC(=O)CN(CCC)Cc1ccccc1O ZINC000076074070 650365653 /nfs/dbraw/zinc/36/56/53/650365653.db2.gz QUGOPDVZTLSCFS-UHFFFAOYSA-N 0 3 292.423 2.911 20 10 CFCDHN CCOc1ccc(CNCc2ccc(C)o2)c(O)c1 ZINC000865724448 638536556 /nfs/dbraw/zinc/53/65/56/638536556.db2.gz UWUPMPRTUBKPFS-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCCn3nccc32)c([O-])c1 ZINC000865871181 638629600 /nfs/dbraw/zinc/62/96/00/638629600.db2.gz GNIYIKHVGWLVCW-AWEZNQCLSA-N 0 3 287.363 2.612 20 10 CFCDHN CCOc1cccc(CN[C@@H]2CCCn3nccc32)c1O ZINC000865871824 638630649 /nfs/dbraw/zinc/63/06/49/638630649.db2.gz MEAKXCMXRNANAS-CYBMUJFWSA-N 0 3 287.363 2.612 20 10 CFCDHN CCOc1ccc(O)c(CN[C@H]2CCCn3nccc32)c1 ZINC000865872984 638631850 /nfs/dbraw/zinc/63/18/50/638631850.db2.gz YFSZBVOHMYQKBQ-AWEZNQCLSA-N 0 3 287.363 2.612 20 10 CFCDHN Cc1ccnc(N2CCN(Cc3cc(C)ccc3O)CC2)c1 ZINC000120916812 638742437 /nfs/dbraw/zinc/74/24/37/638742437.db2.gz GCENKHXODKUCQB-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866489462 638830062 /nfs/dbraw/zinc/83/00/62/638830062.db2.gz OBUFMYOSWUTKKO-VGDYDELISA-N 0 3 265.328 2.583 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H](C)c1cnn(C)c1 ZINC000122722090 639369095 /nfs/dbraw/zinc/36/90/95/639369095.db2.gz AKPRNSVJHKNVPS-CYBMUJFWSA-N 0 3 272.396 2.645 20 10 CFCDHN C[C@H](NCc1ccc(N2CCOCC2)cc1)c1cccnc1 ZINC000078378929 650496931 /nfs/dbraw/zinc/49/69/31/650496931.db2.gz XYVSSPYCXKWUDA-HNNXBMFYSA-N 0 3 297.402 2.769 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000191570102 650511201 /nfs/dbraw/zinc/51/12/01/650511201.db2.gz PHQQELTWXYLPED-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN C[C@@H]([NH2+]CCC[C@H]1CCOC1=O)c1cc(F)ccc1[O-] ZINC000872112880 641643474 /nfs/dbraw/zinc/64/34/74/641643474.db2.gz LKXXWUCYMQLFSF-MNOVXSKESA-N 0 3 281.327 2.525 20 10 CFCDHN Cc1nccnc1[C@@H](C)N[C@H]1CCc2cccc(O)c21 ZINC000872132854 641659849 /nfs/dbraw/zinc/65/98/49/641659849.db2.gz IBFFCTFLCQTUPW-YPMHNXCESA-N 0 3 269.348 2.829 20 10 CFCDHN Cc1ccc(CN2CCN(C)c3ncccc3C2)c(O)c1 ZINC000872264928 641725895 /nfs/dbraw/zinc/72/58/95/641725895.db2.gz BVNREIFGWOOCOA-UHFFFAOYSA-N 0 3 283.375 2.548 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@]23CCC[C@H]2OCC3)c1[O-] ZINC000872263527 641726023 /nfs/dbraw/zinc/72/60/23/641726023.db2.gz GKZLJOBPCPDVDF-HIFRSBDPSA-N 0 3 297.782 2.855 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1ccccc1 ZINC000873193643 642058422 /nfs/dbraw/zinc/05/84/22/642058422.db2.gz NGJWJQJIRMOPHS-DOTOQJQBSA-N 0 3 271.360 2.994 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1Cc2ccccc2CN1)c1ccccc1[O-] ZINC000873294466 642125861 /nfs/dbraw/zinc/12/58/61/642125861.db2.gz SYWCHSGBJKKDNI-XJKSGUPXSA-N 0 3 282.387 2.757 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1Cc3ccccc3CN1)CC2 ZINC000873296509 642127690 /nfs/dbraw/zinc/12/76/90/642127690.db2.gz HGZOTBQZBQTHMN-DLBZAZTESA-N 0 3 294.398 2.684 20 10 CFCDHN CCCN1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000020189673 642316487 /nfs/dbraw/zinc/31/64/87/642316487.db2.gz GSOOLJXOLHGHLN-ZDUSSCGKSA-N 0 3 262.397 2.917 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000876812654 643019345 /nfs/dbraw/zinc/01/93/45/643019345.db2.gz XTNSXHODSPGWSV-HUUCEWRRSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000876812654 643019349 /nfs/dbraw/zinc/01/93/49/643019349.db2.gz XTNSXHODSPGWSV-HUUCEWRRSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000876812655 643020807 /nfs/dbraw/zinc/02/08/07/643020807.db2.gz XTNSXHODSPGWSV-LSDHHAIUSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000876812655 643020818 /nfs/dbraw/zinc/02/08/18/643020818.db2.gz XTNSXHODSPGWSV-LSDHHAIUSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](c2ccco2)N(C)C)c([O-])c1 ZINC000876891505 643054054 /nfs/dbraw/zinc/05/40/54/643054054.db2.gz ZODWLVZZDJAFLU-CQSZACIVSA-N 0 3 274.364 2.686 20 10 CFCDHN CC1CCN(CCC[NH2+]Cc2ccc(F)c(F)c2[O-])CC1 ZINC000876899383 643057170 /nfs/dbraw/zinc/05/71/70/643057170.db2.gz WCYVPLQPUCJRDA-UHFFFAOYSA-N 0 3 298.377 2.882 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1Cc2ccccc2O1 ZINC000876916076 643063447 /nfs/dbraw/zinc/06/34/47/643063447.db2.gz KETLRHJSGZEYNJ-AWEZNQCLSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1nc(CC[NH2+]Cc2ccc(C)cc2[O-])cs1 ZINC000876925084 643066548 /nfs/dbraw/zinc/06/65/48/643066548.db2.gz SZZSRWPBAXSIEQ-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN Cc1ccc(C(=O)NCC[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876961189 643083667 /nfs/dbraw/zinc/08/36/67/643083667.db2.gz CVIJIEVODTYVEB-UHFFFAOYSA-N 0 3 298.386 2.529 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2COc3ccccc3C2)c([O-])c1 ZINC000876975753 643089779 /nfs/dbraw/zinc/08/97/79/643089779.db2.gz JOHYPQWJAXGKCU-HNNXBMFYSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)[C@@H](C)c2ccccc2)c([O-])c1 ZINC000877034473 643113042 /nfs/dbraw/zinc/11/30/42/643113042.db2.gz IFBBMXJEAFFDPG-WMLDXEAASA-N 0 3 285.387 2.955 20 10 CFCDHN COc1cccc([C@H](O)C[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877037261 643115670 /nfs/dbraw/zinc/11/56/70/643115670.db2.gz YXSVQFMEVFQQTG-QGZVFWFLSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(C[NH2+]CCCC(=O)OC(C)(C)C)c([O-])c1 ZINC000877068398 643132542 /nfs/dbraw/zinc/13/25/42/643132542.db2.gz QOTLGUNXABFECQ-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN CN(C(=O)[C@H](N)CC1CCCCC1)c1ccc(N)cc1 ZINC000877075982 643138191 /nfs/dbraw/zinc/13/81/91/643138191.db2.gz KRWDLVLHIGLHCF-OAHLLOKOSA-N 0 3 275.396 2.529 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](C)C[C@@H](O)c1ccco1 ZINC000877128313 643166646 /nfs/dbraw/zinc/16/66/46/643166646.db2.gz GBBWBZWBNAMVOR-IUODEOHRSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1nn(C)c(C)c1CCC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877130867 643169149 /nfs/dbraw/zinc/16/91/49/643169149.db2.gz PQAYBPHTDAHRGR-UHFFFAOYSA-N 0 3 287.407 2.773 20 10 CFCDHN Cc1ccc(C[NH2+]CCNc2cccc(C)n2)c([O-])c1 ZINC000877158575 643182137 /nfs/dbraw/zinc/18/21/37/643182137.db2.gz UTJGNSANJDMDRO-UHFFFAOYSA-N 0 3 271.364 2.606 20 10 CFCDHN CC(=O)NC1CCC([N@H+](C)Cc2ccc(C)cc2[O-])CC1 ZINC000877314724 643233279 /nfs/dbraw/zinc/23/32/79/643233279.db2.gz PXFFSXSXVBMFBE-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN CC(=O)NC1CCC([N@@H+](C)Cc2ccc(C)cc2[O-])CC1 ZINC000877314724 643233285 /nfs/dbraw/zinc/23/32/85/643233285.db2.gz PXFFSXSXVBMFBE-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN CC[C@@](C)(CC(=O)OC)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877325972 643240389 /nfs/dbraw/zinc/24/03/89/643240389.db2.gz PDBPEPILYWPNSX-HNNXBMFYSA-N 0 3 265.353 2.522 20 10 CFCDHN CO[C@@H](CC[NH2+]Cc1c(C)cccc1[O-])C(F)(F)F ZINC000877466688 643286686 /nfs/dbraw/zinc/28/66/86/643286686.db2.gz PCSZFUZHUKIITL-LBPRGKRZSA-N 0 3 277.286 2.758 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000877485139 643300211 /nfs/dbraw/zinc/30/02/11/643300211.db2.gz LYHRETJABMXKSX-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000877485139 643300217 /nfs/dbraw/zinc/30/02/17/643300217.db2.gz LYHRETJABMXKSX-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000877508325 643318230 /nfs/dbraw/zinc/31/82/30/643318230.db2.gz WWCXKRSPLHVYPH-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000877508325 643318233 /nfs/dbraw/zinc/31/82/33/643318233.db2.gz WWCXKRSPLHVYPH-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN CNC(=O)CC[C@@H]1CCCC[N@@H+]1Cc1ccc(C)cc1[O-] ZINC000877521237 643325808 /nfs/dbraw/zinc/32/58/08/643325808.db2.gz TWAKJAJUSJICMX-HNNXBMFYSA-N 0 3 290.407 2.581 20 10 CFCDHN CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1ccc(C)cc1[O-] ZINC000877521237 643325812 /nfs/dbraw/zinc/32/58/12/643325812.db2.gz TWAKJAJUSJICMX-HNNXBMFYSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1ccc(C[N@@H+](C)[C@@H](CO)CC(C)C)c([O-])c1 ZINC000877529997 643332215 /nfs/dbraw/zinc/33/22/15/643332215.db2.gz BHSKUOAAUKWALJ-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[N@H+](C)[C@@H](CO)CC(C)C)c([O-])c1 ZINC000877529997 643332219 /nfs/dbraw/zinc/33/22/19/643332219.db2.gz BHSKUOAAUKWALJ-CQSZACIVSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c([O-])c1 ZINC000877534535 643337480 /nfs/dbraw/zinc/33/74/80/643337480.db2.gz CFWWZLYDPUWYDD-SUMWQHHRSA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)c([O-])c1 ZINC000877534534 643337724 /nfs/dbraw/zinc/33/77/24/643337724.db2.gz CFWWZLYDPUWYDD-GUYCJALGSA-N 0 3 271.360 2.912 20 10 CFCDHN CCc1nc(C)c(CNCc2ccc(C)cc2O)o1 ZINC000877547582 643347855 /nfs/dbraw/zinc/34/78/55/643347855.db2.gz BQGCSEPGMPMUOA-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000877548793 643349662 /nfs/dbraw/zinc/34/96/62/643349662.db2.gz BLAHROXIHJXLEE-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000877548793 643349666 /nfs/dbraw/zinc/34/96/66/643349666.db2.gz BLAHROXIHJXLEE-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000877552954 643354372 /nfs/dbraw/zinc/35/43/72/643354372.db2.gz UPOZBDSAFPHUAC-OAHLLOKOSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](CCO)CC2)c([O-])c1 ZINC000877596921 643389243 /nfs/dbraw/zinc/38/92/43/643389243.db2.gz VLBMUHIRPBARJM-AWEZNQCLSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](CCO)CC2)c([O-])c1 ZINC000877596921 643389249 /nfs/dbraw/zinc/38/92/49/643389249.db2.gz VLBMUHIRPBARJM-AWEZNQCLSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cn2c(cccc2C)n1 ZINC000877608377 643394341 /nfs/dbraw/zinc/39/43/41/643394341.db2.gz QKSCGNWSPQVZJY-UHFFFAOYSA-N 0 3 295.386 2.989 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(CO)CCc2ccccc21 ZINC000877610319 643397031 /nfs/dbraw/zinc/39/70/31/643397031.db2.gz SGPSHVZWJWGYGG-IBGZPJMESA-N 0 3 297.398 2.667 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C2CC2)C2CCOCC2)c([O-])c1 ZINC000877610483 643397110 /nfs/dbraw/zinc/39/71/10/643397110.db2.gz PRNKUOJYMSMJML-QGZVFWFLSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCCc3c2ccc(=O)n3C)c([O-])c1 ZINC000877617678 643404275 /nfs/dbraw/zinc/40/42/75/643404275.db2.gz ZPOVHELGHQFHJE-HNNXBMFYSA-N 0 3 298.386 2.567 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](C)CC1(C)OCCO1 ZINC000877670681 643444901 /nfs/dbraw/zinc/44/49/01/643444901.db2.gz UVJQDBWXXYAPOA-LBPRGKRZSA-N 0 3 279.380 2.579 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](C)CC1(C)OCCO1 ZINC000877670680 643445251 /nfs/dbraw/zinc/44/52/51/643445251.db2.gz UVJQDBWXXYAPOA-GFCCVEGCSA-N 0 3 279.380 2.579 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877739574 643506422 /nfs/dbraw/zinc/50/64/22/643506422.db2.gz OJYWMKYUUAODLO-NWDGAFQWSA-N 0 3 279.405 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000877739574 643506429 /nfs/dbraw/zinc/50/64/29/643506429.db2.gz OJYWMKYUUAODLO-NWDGAFQWSA-N 0 3 279.405 2.586 20 10 CFCDHN COC[C@@H](CC1CCOCC1)[NH2+][C@H](C)c1ccccc1[O-] ZINC000877755884 643534909 /nfs/dbraw/zinc/53/49/09/643534909.db2.gz QSOOADXPNHPPLT-UKRRQHHQSA-N 0 3 293.407 2.875 20 10 CFCDHN C[C@H]([NH2+]Cc1cccn(C(F)F)c1=O)c1ccccc1[O-] ZINC000877758128 643538499 /nfs/dbraw/zinc/53/84/99/643538499.db2.gz JYLBQVBEODNYON-JTQLQIEISA-N 0 3 294.301 2.800 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c([O-])c1 ZINC000877807179 643569084 /nfs/dbraw/zinc/56/90/84/643569084.db2.gz VIHNVRDXKLIKNM-NOLJZWGESA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000877807585 643569949 /nfs/dbraw/zinc/56/99/49/643569949.db2.gz XIILRKSNFGVBTB-XEZPLFJOSA-N 0 3 261.365 2.748 20 10 CFCDHN CCOC(=O)[C@H](C)C1CN(Cc2cc(C)c(C)cc2O)C1 ZINC000877829222 643595260 /nfs/dbraw/zinc/59/52/60/643595260.db2.gz RJRIYZYLIFDOQE-CYBMUJFWSA-N 0 3 291.391 2.640 20 10 CFCDHN CCC[C@H](C)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649042 644362441 /nfs/dbraw/zinc/36/24/41/644362441.db2.gz JZDBDEVEEJZEAP-XQQFMLRXSA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1cc(C)n(CC[NH2+][C@H](C)c2ccccc2[O-])n1 ZINC000879648526 644363390 /nfs/dbraw/zinc/36/33/90/644363390.db2.gz SHCDJTGESQXAFU-CYBMUJFWSA-N 0 3 259.353 2.556 20 10 CFCDHN C[C@@H](NC(=O)C[NH2+][C@@H](C)c1ccccc1[O-])c1ccccc1 ZINC000879650322 644364563 /nfs/dbraw/zinc/36/45/63/644364563.db2.gz UNHHANCTNFVXRC-KGLIPLIRSA-N 0 3 298.386 2.920 20 10 CFCDHN C[C@H]([NH2+]CC(=O)NCCC(C)(C)C)c1ccccc1[O-] ZINC000879651514 644364816 /nfs/dbraw/zinc/36/48/16/644364816.db2.gz ZCPQMFNKOKUNQU-LBPRGKRZSA-N 0 3 278.396 2.595 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1[C@@H](C)CCC[C@@H]1C)c1ccccc1[O-] ZINC000879652219 644366312 /nfs/dbraw/zinc/36/63/12/644366312.db2.gz BIHOXIXJKFIEED-IHRRRGAJSA-N 0 3 290.407 2.832 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@H]12)c1cc(F)ccc1[O-] ZINC000094617313 650960426 /nfs/dbraw/zinc/96/04/26/650960426.db2.gz ZSIXSXGSVIBYSQ-TUKIKUTGSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H]1CCCN(Cc2cc(Cl)ccc2[O-])[C@H]1C[NH3+] ZINC000252108137 650998057 /nfs/dbraw/zinc/99/80/57/650998057.db2.gz HIZCWAKKDJCLJJ-GWCFXTLKSA-N 0 3 268.788 2.605 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2ccns2)cc1F ZINC000883239458 645688393 /nfs/dbraw/zinc/68/83/93/645688393.db2.gz HONQKMILQHKDSO-UHFFFAOYSA-N 0 3 297.374 2.820 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc2c(cc1[O-])OCO2)CC(F)F ZINC000883252226 645699355 /nfs/dbraw/zinc/69/93/55/645699355.db2.gz YWONAOUBFAYFHB-UHFFFAOYSA-N 0 3 287.306 2.892 20 10 CFCDHN C[C@@H](NCCCSc1nccs1)c1cnccn1 ZINC000132221322 645896338 /nfs/dbraw/zinc/89/63/38/645896338.db2.gz ONQNNYDIISFKOU-SNVBAGLBSA-N 0 3 280.422 2.766 20 10 CFCDHN CSCC[NH2+]Cc1cc(Br)cc(C)c1[O-] ZINC000132554158 645931656 /nfs/dbraw/zinc/93/16/56/645931656.db2.gz BZKJYAOKXNVBCB-UHFFFAOYSA-N 0 3 290.226 2.916 20 10 CFCDHN COc1ccc([N+](=O)[O-])cc1CNCc1ccccc1O ZINC000134400009 646339219 /nfs/dbraw/zinc/33/92/19/646339219.db2.gz CNAOFCIPPGIPIA-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@](C)(O)C(F)F ZINC000886027736 646826889 /nfs/dbraw/zinc/82/68/89/646826889.db2.gz IAHDAZUETKGHNJ-AWEZNQCLSA-N 0 3 273.323 2.620 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@](C)(O)C(F)F ZINC000886027736 646826891 /nfs/dbraw/zinc/82/68/91/646826891.db2.gz IAHDAZUETKGHNJ-AWEZNQCLSA-N 0 3 273.323 2.620 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC000886282543 646951579 /nfs/dbraw/zinc/95/15/79/646951579.db2.gz MOCMJVDZTXRWAX-CYDGBPFRSA-N 0 3 261.365 2.783 20 10 CFCDHN CC(C)[C@@H](NCc1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000886493653 647018988 /nfs/dbraw/zinc/01/89/88/647018988.db2.gz UULHERJUJOZAPE-QGZVFWFLSA-N 0 3 286.423 2.973 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1ccccc1[O-])c1cnn(C)c1 ZINC000886520375 647026840 /nfs/dbraw/zinc/02/68/40/647026840.db2.gz CONPQAWDEIRXSH-OAHLLOKOSA-N 0 3 259.353 2.613 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCCN(C)C1)c1c([O-])cccc1F ZINC000886524913 647028701 /nfs/dbraw/zinc/02/87/01/647028701.db2.gz TZZFHJSKXFFLPK-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H]2CCC2(OC)OC)cc1 ZINC000924710204 648032426 /nfs/dbraw/zinc/03/24/26/648032426.db2.gz HQNDESVKZFVBCF-MRXNPFEDSA-N 0 3 292.423 2.774 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H](C)c1ccnnc1 ZINC000925081580 648101915 /nfs/dbraw/zinc/10/19/15/648101915.db2.gz SAOOICKPHFFLFT-CYBMUJFWSA-N 0 3 270.380 2.702 20 10 CFCDHN Nc1ccc2c(c1)C[N@H+]([C@H]1CCc3cccc([O-])c31)CCO2 ZINC000925753860 648308629 /nfs/dbraw/zinc/30/86/29/648308629.db2.gz KCZNDWBMMRYRMB-HNNXBMFYSA-N 0 3 296.370 2.856 20 10 CFCDHN Nc1ccc2c(c1)C[N@@H+]([C@H]1CCc3cccc([O-])c31)CCO2 ZINC000925753860 648308634 /nfs/dbraw/zinc/30/86/34/648308634.db2.gz KCZNDWBMMRYRMB-HNNXBMFYSA-N 0 3 296.370 2.856 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1ccccc1[O-] ZINC000927057839 648692915 /nfs/dbraw/zinc/69/29/15/648692915.db2.gz MFAKRWNMPUGZPB-FKGLVLAHSA-N 0 3 277.364 2.725 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CC1)[C@@H]1CCCOC1 ZINC000723977264 770730154 /nfs/dbraw/zinc/73/01/54/770730154.db2.gz KIKUWHSLYRWQQK-ZBFHGGJFSA-N 0 3 261.365 2.687 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC001140851528 775562432 /nfs/dbraw/zinc/56/24/32/775562432.db2.gz KUFVUYFLZDSMJE-OKILXGFUSA-N 0 3 292.423 2.848 20 10 CFCDHN CC(C)OC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000695089278 775660907 /nfs/dbraw/zinc/66/09/07/775660907.db2.gz GJXBTGILBCKGIP-UHFFFAOYSA-N 0 3 267.344 2.921 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CC[C@@H](C3CC3)O1)CC2 ZINC000722328696 776473634 /nfs/dbraw/zinc/47/36/34/776473634.db2.gz LDWQYTRBXNRWGA-FMKPAKJESA-N 0 3 273.376 2.927 20 10 CFCDHN C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588307 777269974 /nfs/dbraw/zinc/26/99/74/777269974.db2.gz PBFSBLBSEPDNCJ-TZMCWYRMSA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588307 777269975 /nfs/dbraw/zinc/26/99/75/777269975.db2.gz PBFSBLBSEPDNCJ-TZMCWYRMSA-N 0 3 271.360 2.891 20 10 CFCDHN CN1CC2(C1)CC[N@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231590503 777272103 /nfs/dbraw/zinc/27/21/03/777272103.db2.gz FDWINJIPBHKDDE-UHFFFAOYSA-N 0 3 282.387 2.683 20 10 CFCDHN CN1CC2(C1)CC[N@@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231590503 777272112 /nfs/dbraw/zinc/27/21/12/777272112.db2.gz FDWINJIPBHKDDE-UHFFFAOYSA-N 0 3 282.387 2.683 20 10 CFCDHN Cc1cccc(CN2CCc3ncccc3C2)c1O ZINC001231593452 777273653 /nfs/dbraw/zinc/27/36/53/777273653.db2.gz ZDDASGOCHMWXMN-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN COc1cc(CN2CCC(C(F)F)CC2)c(O)cc1O ZINC001231637004 777287739 /nfs/dbraw/zinc/28/77/39/777287739.db2.gz CRTUXVGGHDXHPD-UHFFFAOYSA-N 0 3 287.306 2.584 20 10 CFCDHN CN(Cc1cc2cc[nH]c2cn1)Cc1ccccc1O ZINC001231670069 777304465 /nfs/dbraw/zinc/30/44/65/777304465.db2.gz VALSFSNMZGCVHC-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN COC[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1OC ZINC001231848079 777348437 /nfs/dbraw/zinc/34/84/37/777348437.db2.gz GELYMMFACAZTNM-INIZCTEOSA-N 0 3 292.423 2.762 20 10 CFCDHN CCOC1CCN(Cc2ccc(N(C)C)cc2OC)CC1 ZINC001231851401 777350790 /nfs/dbraw/zinc/35/07/90/777350790.db2.gz BGLMZSZHRBGPRT-UHFFFAOYSA-N 0 3 292.423 2.762 20 10 CFCDHN [O-]c1c(C[N@@H+]2CCOC3(CC3)C2)ccc2ccccc21 ZINC001231883753 777367513 /nfs/dbraw/zinc/36/75/13/777367513.db2.gz UDNRUURANJXREA-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1c(C[N@H+]2CCOC3(CC3)C2)ccc2ccccc21 ZINC001231883753 777367520 /nfs/dbraw/zinc/36/75/20/777367520.db2.gz UDNRUURANJXREA-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN Cc1ccc(CN2CCc3cccc(O)c3C2)c(C)n1 ZINC001232085337 777435176 /nfs/dbraw/zinc/43/51/76/777435176.db2.gz RMKLWTFIVSKENR-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN C[C@@H]1CCC[C@@H](C)N1Cc1cc(O)c(O)c(O)c1 ZINC001233009117 777761856 /nfs/dbraw/zinc/76/18/56/777761856.db2.gz KGUPKLHDQBHOHV-NXEZZACHSA-N 0 3 251.326 2.566 20 10 CFCDHN Cc1cccc(CCN(C)Cc2cc(O)c(O)c(O)c2)c1 ZINC001233014041 777764445 /nfs/dbraw/zinc/76/44/45/777764445.db2.gz XGNCVOFHVWTVOD-UHFFFAOYSA-N 0 3 287.359 2.786 20 10 CFCDHN Oc1cc(CN2CCCCCCC2)cc(O)c1O ZINC001233014026 777764501 /nfs/dbraw/zinc/76/45/01/777764501.db2.gz WUXULDUIFKBRRU-UHFFFAOYSA-N 0 3 251.326 2.570 20 10 CFCDHN [O-]c1cc(O)ccc1C[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001168407310 777866849 /nfs/dbraw/zinc/86/68/49/777866849.db2.gz NRXPXFSOSYLLOR-HNNXBMFYSA-N 0 3 287.334 2.884 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001233287898 777869082 /nfs/dbraw/zinc/86/90/82/777869082.db2.gz MFGYTKNWJGBSIR-BMIGLBTASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@](C)(O)[C@H](C)C2)c1[O-] ZINC001233287898 777869091 /nfs/dbraw/zinc/86/90/91/777869091.db2.gz MFGYTKNWJGBSIR-BMIGLBTASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@](C)(O)[C@H](C)C2)c1O ZINC001233287898 777869100 /nfs/dbraw/zinc/86/91/00/777869100.db2.gz MFGYTKNWJGBSIR-BMIGLBTASA-N 0 3 299.798 2.647 20 10 CFCDHN [O-]c1c(CN2CC3(C2)CCC[NH2+]3)cccc1-c1ccccc1 ZINC001235203810 778414456 /nfs/dbraw/zinc/41/44/56/778414456.db2.gz ZAWNTYYHPOSPQA-UHFFFAOYSA-N 0 3 294.398 2.997 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3C[C@H]2C[NH2+]3)cc1Cl ZINC001235407780 778479723 /nfs/dbraw/zinc/47/97/23/778479723.db2.gz VXEXBCGKSTWWMB-RYUDHWBXSA-N 0 3 294.826 2.889 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCc3nccn3CC2)c([O-])c1 ZINC001235677051 778534590 /nfs/dbraw/zinc/53/45/90/778534590.db2.gz ADQGTVBZKLQFMI-UHFFFAOYSA-N 0 3 299.418 2.945 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCc3nccn3CC2)c([O-])c1 ZINC001235677051 778534595 /nfs/dbraw/zinc/53/45/95/778534595.db2.gz ADQGTVBZKLQFMI-UHFFFAOYSA-N 0 3 299.418 2.945 20 10 CFCDHN [O-]c1cccc(F)c1C[N@@H+]1CCN[C@H](c2ccccc2)C1 ZINC001235858670 778583378 /nfs/dbraw/zinc/58/33/78/778583378.db2.gz IJNJYSOFALTQSE-INIZCTEOSA-N 0 3 286.350 2.678 20 10 CFCDHN [O-]c1cccc(F)c1C[N@H+]1CCN[C@H](c2ccccc2)C1 ZINC001235858670 778583381 /nfs/dbraw/zinc/58/33/81/778583381.db2.gz IJNJYSOFALTQSE-INIZCTEOSA-N 0 3 286.350 2.678 20 10 CFCDHN CN(Cc1cc(F)c(Cl)cc1[O-])[C@H]1CCCC[C@H]1[NH3+] ZINC001236217010 778741227 /nfs/dbraw/zinc/74/12/27/778741227.db2.gz MQJUNJCKANWKHX-OLZOCXBDSA-N 0 3 286.778 2.886 20 10 CFCDHN CN(Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@H]1[NH3+] ZINC001236219799 778743947 /nfs/dbraw/zinc/74/39/47/778743947.db2.gz XOMCMYBCYCWHJB-OLZOCXBDSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@H]1N ZINC001236219799 778743951 /nfs/dbraw/zinc/74/39/51/778743951.db2.gz XOMCMYBCYCWHJB-OLZOCXBDSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@H]1N ZINC001236219799 778743955 /nfs/dbraw/zinc/74/39/55/778743955.db2.gz XOMCMYBCYCWHJB-OLZOCXBDSA-N 0 3 286.778 2.886 20 10 CFCDHN CC(C)C[N@H+](Cc1ccc(F)c(F)c1[O-])[C@@H]1CCCNC1 ZINC001236476247 778843741 /nfs/dbraw/zinc/84/37/41/778843741.db2.gz WVTPICHIQZVCDG-CYBMUJFWSA-N 0 3 298.377 2.880 20 10 CFCDHN CC(C)C[N@@H+](Cc1ccc(F)c(F)c1[O-])[C@@H]1CCCNC1 ZINC001236476247 778843748 /nfs/dbraw/zinc/84/37/48/778843748.db2.gz WVTPICHIQZVCDG-CYBMUJFWSA-N 0 3 298.377 2.880 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](O)CC2)c([O-])c1 ZINC001236784668 778934724 /nfs/dbraw/zinc/93/47/24/778934724.db2.gz YCWNXUWBPULXLA-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](O)CC2)c([O-])c1 ZINC001236784668 778934729 /nfs/dbraw/zinc/93/47/29/778934729.db2.gz YCWNXUWBPULXLA-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@]3(CCCO3)C2)c([O-])c1 ZINC001236783844 778935681 /nfs/dbraw/zinc/93/56/81/778935681.db2.gz OTIFTEUDCDDDAO-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@]3(CCCO3)C2)c([O-])c1 ZINC001236783844 778935684 /nfs/dbraw/zinc/93/56/84/778935684.db2.gz OTIFTEUDCDDDAO-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCCO[C@@H]1CC[N@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236788886 778936765 /nfs/dbraw/zinc/93/67/65/778936765.db2.gz SDZIPKRFKJYKMJ-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCCO[C@@H]1CC[N@@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236788886 778936770 /nfs/dbraw/zinc/93/67/70/778936770.db2.gz SDZIPKRFKJYKMJ-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@]3(CCC(=O)O3)C2)c([O-])c1 ZINC001236791743 778937338 /nfs/dbraw/zinc/93/73/38/778937338.db2.gz JNRDULUBGWYTQP-QGZVFWFLSA-N 0 3 289.375 2.626 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@]3(CCC(=O)O3)C2)c([O-])c1 ZINC001236791743 778937341 /nfs/dbraw/zinc/93/73/41/778937341.db2.gz JNRDULUBGWYTQP-QGZVFWFLSA-N 0 3 289.375 2.626 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)c([O-])c1 ZINC001236792825 778939373 /nfs/dbraw/zinc/93/93/73/778939373.db2.gz RUIIFCPSLBYQKD-GOEBONIOSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c([O-])c1 ZINC001236792825 778939377 /nfs/dbraw/zinc/93/93/77/778939377.db2.gz RUIIFCPSLBYQKD-GOEBONIOSA-N 0 3 261.365 2.565 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c([O-])c1 ZINC001236810844 778948705 /nfs/dbraw/zinc/94/87/05/778948705.db2.gz KDBFMQODUPUAJT-CQSZACIVSA-N 0 3 283.318 2.940 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c([O-])c1 ZINC001236810844 778948708 /nfs/dbraw/zinc/94/87/08/778948708.db2.gz KDBFMQODUPUAJT-CQSZACIVSA-N 0 3 283.318 2.940 20 10 CFCDHN C[C@@]1(CO)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826764 778955107 /nfs/dbraw/zinc/95/51/07/778955107.db2.gz MLMRXNRMKTWIRU-QGZVFWFLSA-N 0 3 271.360 2.750 20 10 CFCDHN C[C@@]1(CO)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826764 778955110 /nfs/dbraw/zinc/95/51/10/778955110.db2.gz MLMRXNRMKTWIRU-QGZVFWFLSA-N 0 3 271.360 2.750 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C[C@H]1O ZINC001236827926 778956090 /nfs/dbraw/zinc/95/60/90/778956090.db2.gz WVOVZQADPFHFDL-SJKOYZFVSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C[C@H]1O ZINC001236827926 778956096 /nfs/dbraw/zinc/95/60/96/778956096.db2.gz WVOVZQADPFHFDL-SJKOYZFVSA-N 0 3 271.360 2.748 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC2(C1)OCCO2 ZINC001236832820 778958132 /nfs/dbraw/zinc/95/81/32/778958132.db2.gz LXFYRCSIVAWFTQ-UHFFFAOYSA-N 0 3 299.370 2.884 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC2(C1)OCCO2 ZINC001236832820 778958136 /nfs/dbraw/zinc/95/81/36/778958136.db2.gz LXFYRCSIVAWFTQ-UHFFFAOYSA-N 0 3 299.370 2.884 20 10 CFCDHN CN1CCC[N@H+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236841167 778962032 /nfs/dbraw/zinc/96/20/32/778962032.db2.gz WCHXXALMMWOFMD-UHFFFAOYSA-N 0 3 270.376 2.683 20 10 CFCDHN CN1CCC[N@@H+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236841167 778962035 /nfs/dbraw/zinc/96/20/35/778962035.db2.gz WCHXXALMMWOFMD-UHFFFAOYSA-N 0 3 270.376 2.683 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001237045223 778997043 /nfs/dbraw/zinc/99/70/43/778997043.db2.gz ZCJOGYWQAPVEKX-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](C(C)=O)C2)c([O-])c1 ZINC001237045223 778997047 /nfs/dbraw/zinc/99/70/47/778997047.db2.gz ZCJOGYWQAPVEKX-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](F)CC2)c([O-])c1 ZINC001237044326 778997282 /nfs/dbraw/zinc/99/72/82/778997282.db2.gz BULCWISMWLTTKD-HUUCEWRRSA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](F)CC2)c([O-])c1 ZINC001237044326 778997285 /nfs/dbraw/zinc/99/72/85/778997285.db2.gz BULCWISMWLTTKD-HUUCEWRRSA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@H](O)CC[C@H]2C)c([O-])c1 ZINC001237045435 778997841 /nfs/dbraw/zinc/99/78/41/778997841.db2.gz KPNUEHCLSVTOLY-IUODEOHRSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@H](O)CC[C@H]2C)c([O-])c1 ZINC001237045435 778997846 /nfs/dbraw/zinc/99/78/46/778997846.db2.gz KPNUEHCLSVTOLY-IUODEOHRSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCCC[C@@H]2CO)c([O-])c1 ZINC001237048905 778998571 /nfs/dbraw/zinc/99/85/71/778998571.db2.gz ZQCIBBQGQHZBGA-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCCC[C@@H]2CO)c([O-])c1 ZINC001237048905 778998577 /nfs/dbraw/zinc/99/85/77/778998577.db2.gz ZQCIBBQGQHZBGA-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001237050743 778999859 /nfs/dbraw/zinc/99/98/59/778999859.db2.gz WRCRGABYOFJFJN-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC(C)(C)C[C@@]2(C)CO)c([O-])c1 ZINC001237050743 778999863 /nfs/dbraw/zinc/99/98/63/778999863.db2.gz WRCRGABYOFJFJN-KRWDZBQOSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237049407 778999959 /nfs/dbraw/zinc/99/99/59/778999959.db2.gz OCLFOUTZHBUNOZ-OAHLLOKOSA-N 0 3 291.391 2.901 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237049407 778999963 /nfs/dbraw/zinc/99/99/63/778999963.db2.gz OCLFOUTZHBUNOZ-OAHLLOKOSA-N 0 3 291.391 2.901 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001237049475 779000300 /nfs/dbraw/zinc/00/03/00/779000300.db2.gz GLOSNRDHGIEQOH-GUYCJALGSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001237049475 779000305 /nfs/dbraw/zinc/00/03/05/779000305.db2.gz GLOSNRDHGIEQOH-GUYCJALGSA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237383089 779087176 /nfs/dbraw/zinc/08/71/76/779087176.db2.gz OCZFZUAQWWFZGR-BXUZGUMPSA-N 0 3 280.799 2.620 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237404117 779097943 /nfs/dbraw/zinc/09/79/43/779097943.db2.gz NFYNCJBLHROBPT-RISCZKNCSA-N 0 3 280.799 2.620 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC(C)(C)C[C@@]1(C)CO ZINC001237484350 779117710 /nfs/dbraw/zinc/11/77/10/779117710.db2.gz CSDZPDVMQVEVGV-INIZCTEOSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC(C)(C)C[C@@]1(C)CO ZINC001237484350 779117713 /nfs/dbraw/zinc/11/77/13/779117713.db2.gz CSDZPDVMQVEVGV-INIZCTEOSA-N 0 3 263.381 2.684 20 10 CFCDHN CCCCOC(=O)[C@@H]1CC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237494781 779119989 /nfs/dbraw/zinc/11/99/89/779119989.db2.gz LKAFBQGYZKRYSS-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN CCCCOC(=O)[C@@H]1CC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237494781 779119997 /nfs/dbraw/zinc/11/99/97/779119997.db2.gz LKAFBQGYZKRYSS-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237493140 779120231 /nfs/dbraw/zinc/12/02/31/779120231.db2.gz VQSNAXZGXNMICD-KRWDZBQOSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237493140 779120234 /nfs/dbraw/zinc/12/02/34/779120234.db2.gz VQSNAXZGXNMICD-KRWDZBQOSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](O)[C@H](C)C2)c1[O-] ZINC001237681009 779159965 /nfs/dbraw/zinc/15/99/65/779159965.db2.gz KBCBRZIGVUDLGJ-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](O)[C@H](C)C2)c1[O-] ZINC001237681009 779159968 /nfs/dbraw/zinc/15/99/68/779159968.db2.gz KBCBRZIGVUDLGJ-RISCZKNCSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)[C@H](F)CC2)c1[O-] ZINC001237681377 779160579 /nfs/dbraw/zinc/16/05/79/779160579.db2.gz ONNHXZCNZWFBRO-CHWSQXEVSA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)[C@H](F)CC2)c1[O-] ZINC001237681377 779160583 /nfs/dbraw/zinc/16/05/83/779160583.db2.gz ONNHXZCNZWFBRO-CHWSQXEVSA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](F)[C@@H](O)CC2)c1[O-] ZINC001237681378 779160901 /nfs/dbraw/zinc/16/09/01/779160901.db2.gz ONNHXZCNZWFBRO-OLZOCXBDSA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](F)[C@@H](O)CC2)c1[O-] ZINC001237681378 779160904 /nfs/dbraw/zinc/16/09/04/779160904.db2.gz ONNHXZCNZWFBRO-OLZOCXBDSA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c1[O-] ZINC001238063257 779242715 /nfs/dbraw/zinc/24/27/15/779242715.db2.gz LPDREXRLXVOJTJ-INIZCTEOSA-N 0 3 279.355 2.985 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@]3(C2)CCCCO3)c1[O-] ZINC001238063257 779242722 /nfs/dbraw/zinc/24/27/22/779242722.db2.gz LPDREXRLXVOJTJ-INIZCTEOSA-N 0 3 279.355 2.985 20 10 CFCDHN CCO[C@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238062974 779242915 /nfs/dbraw/zinc/24/29/15/779242915.db2.gz VDYYCXFZWLEZDB-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN CCO[C@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238062974 779242918 /nfs/dbraw/zinc/24/29/18/779242918.db2.gz VDYYCXFZWLEZDB-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN COC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065711 779243794 /nfs/dbraw/zinc/24/37/94/779243794.db2.gz ZJXPQOWQACAYRK-VXGBXAGGSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065711 779243797 /nfs/dbraw/zinc/24/37/97/779243797.db2.gz ZJXPQOWQACAYRK-VXGBXAGGSA-N 0 3 295.354 2.613 20 10 CFCDHN CC[N@H+](CCn1cccn1)Cc1cc(F)cc(C)c1[O-] ZINC001238066051 779243963 /nfs/dbraw/zinc/24/39/63/779243963.db2.gz DMJCDRXHWLUOQE-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN CC[N@@H+](CCn1cccn1)Cc1cc(F)cc(C)c1[O-] ZINC001238066051 779243967 /nfs/dbraw/zinc/24/39/67/779243967.db2.gz DMJCDRXHWLUOQE-UHFFFAOYSA-N 0 3 277.343 2.558 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1[O-] ZINC001238070531 779247105 /nfs/dbraw/zinc/24/71/05/779247105.db2.gz MUIWRUIBQVANIK-XDTLVQLUSA-N 0 3 253.292 2.772 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1[O-] ZINC001238070531 779247109 /nfs/dbraw/zinc/24/71/09/779247109.db2.gz MUIWRUIBQVANIK-XDTLVQLUSA-N 0 3 253.292 2.772 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(CO)CC2)c1[O-] ZINC001238064457 779739113 /nfs/dbraw/zinc/73/91/13/779739113.db2.gz PIKRGIZOJIIREX-MRXNPFEDSA-N 0 3 281.371 2.824 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(CO)CC2)c1[O-] ZINC001238064457 779739118 /nfs/dbraw/zinc/73/91/18/779739118.db2.gz PIKRGIZOJIIREX-MRXNPFEDSA-N 0 3 281.371 2.824 20 10 CFCDHN O=C1CCN(Cc2ccccc2O)[C@@H]2CCCC[C@@H]12 ZINC001203546885 779977868 /nfs/dbraw/zinc/97/78/68/779977868.db2.gz BMGPHNXZWRUVBY-ZIAGYGMSSA-N 0 3 259.349 2.726 20 10 CFCDHN CCc1noc([C@@H]2CC[C@H]([NH2+]Cc3ccccc3[O-])C2)n1 ZINC000922865641 780574429 /nfs/dbraw/zinc/57/44/29/780574429.db2.gz JYRQWTMRUQQYJL-YPMHNXCESA-N 0 3 287.363 2.764 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)cc1[O-] ZINC000700816758 780726389 /nfs/dbraw/zinc/72/63/89/780726389.db2.gz NNTSNZOCIVPHGL-CHWSQXEVSA-N 0 3 280.387 2.914 20 10 CFCDHN CCN1CCN(c2ccc(-c3nccs3)cc2)CC1 ZINC001241744231 781105078 /nfs/dbraw/zinc/10/50/78/781105078.db2.gz ZCOABHKAFLXVQI-UHFFFAOYSA-N 0 3 273.405 2.952 20 10 CFCDHN CCc1cccc(C[NH2+]CC(C)(C)CCCO)c1[O-] ZINC000709465793 781311602 /nfs/dbraw/zinc/31/16/02/781311602.db2.gz XRFZNSSVWKYLSC-UHFFFAOYSA-N 0 3 265.397 2.843 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000709849464 781320510 /nfs/dbraw/zinc/32/05/10/781320510.db2.gz KPIOBSNKUAIWJD-HNNXBMFYSA-N 0 3 280.799 2.621 20 10 CFCDHN [O-]c1ccccc1C[NH+](C[C@H]1CCCO1)C[C@H]1CCCO1 ZINC000072952777 346952299 /nfs/dbraw/zinc/95/22/99/346952299.db2.gz DLTDGFUIQAWOFW-HZPDHXFCSA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccccc1[O-] ZINC000295133703 199364108 /nfs/dbraw/zinc/36/41/08/199364108.db2.gz YMIJSHXCDJPFOA-AAEUAGOBSA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCCCO)c([O-])c1 ZINC000294512589 199068174 /nfs/dbraw/zinc/06/81/74/199068174.db2.gz YTJNVWOCZZCHTM-CYBMUJFWSA-N 0 3 251.370 2.822 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](C)CCCO)c1[O-] ZINC000294816959 199196786 /nfs/dbraw/zinc/19/67/86/199196786.db2.gz ONCYGTDCWTYHRW-JTQLQIEISA-N 0 3 287.787 2.552 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H](CO)C1CCCC1)CC2 ZINC000297183819 200107444 /nfs/dbraw/zinc/10/74/44/200107444.db2.gz DZYSETMLEJXKQK-KBPBESRZSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)Cc1cccc(F)c1)c1ccccc1[O-] ZINC000297338765 200153718 /nfs/dbraw/zinc/15/37/18/200153718.db2.gz OIEUWXOOGCABAG-IUODEOHRSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCC[C@H]1O ZINC000297640473 200249780 /nfs/dbraw/zinc/24/97/80/200249780.db2.gz JSYTXFIDOGDWNE-FRFSOERESA-N 0 3 275.392 2.910 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccccc1[O-] ZINC000020120691 372232429 /nfs/dbraw/zinc/23/24/29/372232429.db2.gz HTAWMKBXCCQVDT-HNNXBMFYSA-N 0 3 292.423 2.544 20 10 CFCDHN CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000037644185 372681837 /nfs/dbraw/zinc/68/18/37/372681837.db2.gz CWFPHBPKDKSFLN-UONOGXRCSA-N 0 3 262.397 2.693 20 10 CFCDHN COc1ccc(CNCc2ccc(C)nc2)cc1C ZINC000057591586 373601082 /nfs/dbraw/zinc/60/10/82/373601082.db2.gz MUDHHEFFCXMJOE-UHFFFAOYSA-N 0 3 256.349 2.997 20 10 CFCDHN CCOCCC[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000076274279 374543647 /nfs/dbraw/zinc/54/36/47/374543647.db2.gz LQXPXKLVDXKFFN-UHFFFAOYSA-N 0 3 273.760 2.570 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](Oc3cccnc3)C2)c1 ZINC000093691603 375299686 /nfs/dbraw/zinc/29/96/86/375299686.db2.gz NCLHRUXATMKLNP-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](Oc3cccnc3)C2)c1 ZINC000093691603 375299692 /nfs/dbraw/zinc/29/96/92/375299692.db2.gz NCLHRUXATMKLNP-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000093838940 375319030 /nfs/dbraw/zinc/31/90/30/375319030.db2.gz WHJMXSOLISNPRC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2cccc(OCC)c2[O-])C1 ZINC000093838940 375319032 /nfs/dbraw/zinc/31/90/32/375319032.db2.gz WHJMXSOLISNPRC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CC[C@@H]([NH2+]CCn1cc(C)cn1)c1ccccc1[O-] ZINC000121098278 376761830 /nfs/dbraw/zinc/76/18/30/376761830.db2.gz YHBAUMXDRNKJTB-CQSZACIVSA-N 0 3 259.353 2.638 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCn2cccn2)c([O-])c1 ZINC000126266002 377219502 /nfs/dbraw/zinc/21/95/02/377219502.db2.gz ISJCBCXSICDWRT-ZDUSSCGKSA-N 0 3 259.353 2.638 20 10 CFCDHN CCN(CC)CCC[NH2+]Cc1cccc(Cl)c1[O-] ZINC000127870579 377305781 /nfs/dbraw/zinc/30/57/81/377305781.db2.gz QZXQTCXKVIWQAW-UHFFFAOYSA-N 0 3 270.804 2.867 20 10 CFCDHN CC[NH+](CC)CCCNCc1cccc(Cl)c1[O-] ZINC000127870579 377305788 /nfs/dbraw/zinc/30/57/88/377305788.db2.gz QZXQTCXKVIWQAW-UHFFFAOYSA-N 0 3 270.804 2.867 20 10 CFCDHN Cc1ccc(O)c(CN2CCN(C3CCCC3)CC2)c1 ZINC000133876940 377964814 /nfs/dbraw/zinc/96/48/14/377964814.db2.gz NEGZURANZRZLHT-UHFFFAOYSA-N 0 3 274.408 2.761 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000134000148 377975575 /nfs/dbraw/zinc/97/55/75/377975575.db2.gz JVZOJUPKLUVYPO-HIFRSBDPSA-N 0 3 279.405 2.537 20 10 CFCDHN CCN(CC)c1ncc(C[NH2+]Cc2ccccc2[O-])s1 ZINC000134236525 377994735 /nfs/dbraw/zinc/99/47/35/377994735.db2.gz IFZNVHTXBVQLQT-UHFFFAOYSA-N 0 3 291.420 2.985 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](C)C2CCOCC2)c1[O-] ZINC000134496131 378023270 /nfs/dbraw/zinc/02/32/70/378023270.db2.gz SWWARORXOBDMFQ-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccccc2[O-])C12CCC2 ZINC000135200153 378096451 /nfs/dbraw/zinc/09/64/51/378096451.db2.gz XTHWKOYTKYFVJY-HUUCEWRRSA-N 0 3 261.365 2.830 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)c1 ZINC000151438747 378326305 /nfs/dbraw/zinc/32/63/05/378326305.db2.gz KHQGBPNBWILCPU-ZBFHGGJFSA-N 0 3 293.432 2.845 20 10 CFCDHN COC(=O)[C@H]1CCC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000151634420 378343199 /nfs/dbraw/zinc/34/31/99/378343199.db2.gz RLZYGCBAVWKIJE-AWEZNQCLSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@H]1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000151634420 378343202 /nfs/dbraw/zinc/34/32/02/378343202.db2.gz RLZYGCBAVWKIJE-AWEZNQCLSA-N 0 3 299.370 2.930 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)NCc2ccnn2C)cc1 ZINC000152182266 378402661 /nfs/dbraw/zinc/40/26/61/378402661.db2.gz WZQLWKRUNZOFAP-CYBMUJFWSA-N 0 3 272.396 2.727 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)[C@H](CO)SC)cc1 ZINC000152466327 378418564 /nfs/dbraw/zinc/41/85/64/378418564.db2.gz VFHFVVGVKBZHKC-BBRMVZONSA-N 0 3 296.480 2.735 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000177224445 380318425 /nfs/dbraw/zinc/31/84/25/380318425.db2.gz RMWKOXLTBPZBSU-GOSISDBHSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000177224445 380318435 /nfs/dbraw/zinc/31/84/35/380318435.db2.gz RMWKOXLTBPZBSU-GOSISDBHSA-N 0 3 299.370 2.930 20 10 CFCDHN Cn1ccnc1CC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000179572383 380558299 /nfs/dbraw/zinc/55/82/99/380558299.db2.gz JHCBQVUMODMRKH-UHFFFAOYSA-N 0 3 285.391 2.580 20 10 CFCDHN Oc1ccccc1CN1CCN(c2cccs2)CC1 ZINC000179580789 380560325 /nfs/dbraw/zinc/56/03/25/380560325.db2.gz CJIVSSRXTNDFKE-UHFFFAOYSA-N 0 3 274.389 2.776 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)[C@H](C)C2CC2)cc1OC ZINC000179714808 380573946 /nfs/dbraw/zinc/57/39/46/380573946.db2.gz QGJXWUOILVSZJH-SNVBAGLBSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)[C@H](C)C2CC2)cc1OC ZINC000179714808 380573950 /nfs/dbraw/zinc/57/39/50/380573950.db2.gz QGJXWUOILVSZJH-SNVBAGLBSA-N 0 3 265.353 2.640 20 10 CFCDHN CC[NH+](CC)C[C@@H]1CCN(Cc2cc(F)ccc2[O-])C1 ZINC000180207469 380634266 /nfs/dbraw/zinc/63/42/66/380634266.db2.gz DEKRYYLUYJIUKN-ZDUSSCGKSA-N 0 3 280.387 2.695 20 10 CFCDHN C[N@H+](Cc1ccc2c(c1)OCO2)Cc1cc(F)ccc1[O-] ZINC000179888613 380591264 /nfs/dbraw/zinc/59/12/64/380591264.db2.gz QHUGKQLEXQYMQO-UHFFFAOYSA-N 0 3 289.306 2.892 20 10 CFCDHN C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1cc(F)ccc1[O-] ZINC000179888613 380591272 /nfs/dbraw/zinc/59/12/72/380591272.db2.gz QHUGKQLEXQYMQO-UHFFFAOYSA-N 0 3 289.306 2.892 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1ccccc1[O-] ZINC000179889939 380591705 /nfs/dbraw/zinc/59/17/05/380591705.db2.gz KPDSLKKBCJNIRZ-ZBEGNZNMSA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H]2CN2CCCC2)c1[O-] ZINC000179878138 380591828 /nfs/dbraw/zinc/59/18/28/380591828.db2.gz QIHNFNJZDVPQAU-MRXNPFEDSA-N 0 3 274.408 2.761 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H]2CN2CCCC2)c1[O-] ZINC000179878138 380591832 /nfs/dbraw/zinc/59/18/32/380591832.db2.gz QIHNFNJZDVPQAU-MRXNPFEDSA-N 0 3 274.408 2.761 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCOC2)c1[O-] ZINC000180342529 380646025 /nfs/dbraw/zinc/64/60/25/380646025.db2.gz VYHYOANZSMSOJL-NSHDSACASA-N 0 3 269.772 2.870 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC([NH+]2CCCC2)CC1 ZINC000179916798 380596735 /nfs/dbraw/zinc/59/67/35/380596735.db2.gz TWKLNKWVZQLZMD-UHFFFAOYSA-N 0 3 278.371 2.592 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(n2ccnc2)CC1 ZINC000180010259 380610064 /nfs/dbraw/zinc/61/00/64/380610064.db2.gz RYXWDJQGXPURGH-UHFFFAOYSA-N 0 3 275.327 2.565 20 10 CFCDHN C[C@H]1SCC[N@H+](Cc2cc(F)ccc2[O-])[C@@H]1C ZINC000180172076 380628632 /nfs/dbraw/zinc/62/86/32/380628632.db2.gz JIDDVCDTGLJGEY-NXEZZACHSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@H]1SCC[N@@H+](Cc2cc(F)ccc2[O-])[C@@H]1C ZINC000180172076 380628639 /nfs/dbraw/zinc/62/86/39/380628639.db2.gz JIDDVCDTGLJGEY-NXEZZACHSA-N 0 3 255.358 2.857 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1[O-] ZINC000180487876 380668198 /nfs/dbraw/zinc/66/81/98/380668198.db2.gz TWYMBUYYMXFVKG-CQSZACIVSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1[O-] ZINC000180487876 380668201 /nfs/dbraw/zinc/66/82/01/380668201.db2.gz TWYMBUYYMXFVKG-CQSZACIVSA-N 0 3 291.391 2.864 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@@H](OCC(C)C)C2)c1 ZINC000180723179 380693353 /nfs/dbraw/zinc/69/33/53/380693353.db2.gz QEMBTYZBRVCRBP-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000180723179 380693357 /nfs/dbraw/zinc/69/33/57/380693357.db2.gz QEMBTYZBRVCRBP-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000180723179 380693364 /nfs/dbraw/zinc/69/33/64/380693364.db2.gz QEMBTYZBRVCRBP-OAHLLOKOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccncc1CN[C@H](C)c1ccccc1O ZINC000287642390 380896072 /nfs/dbraw/zinc/89/60/72/380896072.db2.gz GHGSQBPPOSHBKI-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCOC[C@@H]2C)c1[O-] ZINC000289207558 381028964 /nfs/dbraw/zinc/02/89/64/381028964.db2.gz BTQPBAVPFGQBEP-QWRGUYRKSA-N 0 3 299.798 2.816 20 10 CFCDHN C[C@H](CN1CCCCC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295767356 381063192 /nfs/dbraw/zinc/06/31/92/381063192.db2.gz ACSOFCLIYJWAEP-UKRRQHHQSA-N 0 3 274.408 2.844 20 10 CFCDHN COCC1CCC([NH2+]Cc2cccc(OC)c2[O-])CC1 ZINC000295920830 381159032 /nfs/dbraw/zinc/15/90/32/381159032.db2.gz FAVKKZMTCJKGSF-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000295933655 381166442 /nfs/dbraw/zinc/16/64/42/381166442.db2.gz KNGKWNYRTYMUAC-HNNXBMFYSA-N 0 3 296.370 2.529 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@](C)(O)c2ccc(F)cc2)c1[O-] ZINC000182676857 381136206 /nfs/dbraw/zinc/13/62/06/381136206.db2.gz MKBRRZNFBGGSKW-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCCC(C)(F)F)cc1OC ZINC000295960914 381182391 /nfs/dbraw/zinc/18/23/91/381182391.db2.gz HWAIUIGEXDHTCH-UHFFFAOYSA-N 0 3 289.322 2.934 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295996539 381203185 /nfs/dbraw/zinc/20/31/85/381203185.db2.gz OABOZSRBBLDNDF-GDBMZVCRSA-N 0 3 299.370 2.711 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)c1cccc(F)c1)CC2 ZINC000295999219 381205626 /nfs/dbraw/zinc/20/56/26/381205626.db2.gz OFOQGMYATCLYGD-HOCLYGCPSA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@H]1CCCN(CC[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000296019944 381215495 /nfs/dbraw/zinc/21/54/95/381215495.db2.gz PMEHSBOFUIGFOV-DZGCQCFKSA-N 0 3 274.408 2.701 20 10 CFCDHN C[C@H]([NH2+]CCc1ccccc1O)c1ccccc1[O-] ZINC000183481133 381276576 /nfs/dbraw/zinc/27/65/76/381276576.db2.gz UHWDVBZEMKYXSA-LBPRGKRZSA-N 0 3 257.333 2.991 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccc(CO)c1)c1ccccc1[O-] ZINC000183497690 381279552 /nfs/dbraw/zinc/27/95/52/381279552.db2.gz FIMSVEVOAAVUPX-GFCCVEGCSA-N 0 3 257.333 2.735 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183529023 381283444 /nfs/dbraw/zinc/28/34/44/381283444.db2.gz BDAGZZURWJFZME-NSHDSACASA-N 0 3 265.353 2.775 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183538132 381285257 /nfs/dbraw/zinc/28/52/57/381285257.db2.gz ZJMDPJLTRWQHNI-CHWSQXEVSA-N 0 3 251.370 2.842 20 10 CFCDHN CC(C)[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)C(C)(C)O ZINC000296302937 381339529 /nfs/dbraw/zinc/33/95/29/381339529.db2.gz DRZYVCDVRXJRKH-DOMZBBRYSA-N 0 3 263.381 2.765 20 10 CFCDHN Cc1cnccc1CNCc1ccc(N2CCOCC2)cc1 ZINC000296368201 381364192 /nfs/dbraw/zinc/36/41/92/381364192.db2.gz JXBKTMYZCQYEPK-UHFFFAOYSA-N 0 3 297.402 2.516 20 10 CFCDHN CO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296394073 381376288 /nfs/dbraw/zinc/37/62/88/381376288.db2.gz KBEHGIWUDKXZTF-UMVBOHGHSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])[C@H](O)C(F)F ZINC000296444699 381399086 /nfs/dbraw/zinc/39/90/86/381399086.db2.gz MNDUTKQRSGXBAZ-CDMKHQONSA-N 0 3 273.323 2.756 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1[O-])[C@@H](O)C(F)F ZINC000296444715 381400030 /nfs/dbraw/zinc/40/00/30/381400030.db2.gz MNDUTKQRSGXBAZ-XHVZSJERSA-N 0 3 273.323 2.756 20 10 CFCDHN CC[C@H](NCc1n[nH]c(C2CC2)n1)c1ccc(N(C)C)cc1 ZINC000296541759 381441389 /nfs/dbraw/zinc/44/13/89/381441389.db2.gz RALNKBNDWGSNBX-HNNXBMFYSA-N 0 3 299.422 2.989 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H](CO)Cc1ccccc1)CC2 ZINC000296490832 381418443 /nfs/dbraw/zinc/41/84/43/381418443.db2.gz PPSXHMBLWOZYRK-JKSUJKDBSA-N 0 3 283.371 2.573 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C(C)C)CC2)c1O ZINC000184677807 381457897 /nfs/dbraw/zinc/45/78/97/381457897.db2.gz RBHGZAKODSNKQG-UHFFFAOYSA-N 0 3 298.814 2.580 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000296596610 381464945 /nfs/dbraw/zinc/46/49/45/381464945.db2.gz VIZXAYSMSMYBNT-RNCFNFMXSA-N 0 3 253.317 2.749 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185030551 381516661 /nfs/dbraw/zinc/51/66/61/381516661.db2.gz YHYINZDLZDWNTK-GFCCVEGCSA-N 0 3 296.386 2.831 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCCC[C@H]2C)c1 ZINC000185028048 381517366 /nfs/dbraw/zinc/51/73/66/381517366.db2.gz QZJXEFIXVBERMY-KGLIPLIRSA-N 0 3 292.423 2.926 20 10 CFCDHN C[C@H]([NH2+]CCCN(C)C)c1cc(Cl)ccc1[O-] ZINC000184842747 381485797 /nfs/dbraw/zinc/48/57/97/381485797.db2.gz MJFUOVNQZGXBNT-JTQLQIEISA-N 0 3 256.777 2.648 20 10 CFCDHN CSCCCCC[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000185160975 381548284 /nfs/dbraw/zinc/54/82/84/381548284.db2.gz SRHFHOLPMXNIJW-UHFFFAOYSA-N 0 3 283.393 2.744 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296753494 381529484 /nfs/dbraw/zinc/52/94/84/381529484.db2.gz JUNIILVHZQPWBT-ZDUSSCGKSA-N 0 3 263.381 2.768 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](O)C2CCCCC2)c1 ZINC000185328013 381599561 /nfs/dbraw/zinc/59/95/61/381599561.db2.gz BCYDEWAGAJVANW-PXAZEXFGSA-N 0 3 293.407 2.993 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)Cc2ccccc2)c([O-])c1 ZINC000185370537 381616049 /nfs/dbraw/zinc/61/60/49/381616049.db2.gz XPGYNTNBHNHVDZ-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000371469080 381635094 /nfs/dbraw/zinc/63/50/94/381635094.db2.gz CYEXEZWVCCBBIA-BMFZPTHFSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1[O-] ZINC000371469080 381635100 /nfs/dbraw/zinc/63/51/00/381635100.db2.gz CYEXEZWVCCBBIA-BMFZPTHFSA-N 0 3 275.392 2.946 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 ZINC000371471779 381635995 /nfs/dbraw/zinc/63/59/95/381635995.db2.gz WVWCVOCPMLDJFO-BMFZPTHFSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 ZINC000371471779 381636004 /nfs/dbraw/zinc/63/60/04/381636004.db2.gz WVWCVOCPMLDJFO-BMFZPTHFSA-N 0 3 291.391 2.646 20 10 CFCDHN CC[C@@H](C)[C@H](O)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000185438474 381632981 /nfs/dbraw/zinc/63/29/81/381632981.db2.gz QJXIAGAOOYGMHQ-TYNCELHUSA-N 0 3 251.370 2.758 20 10 CFCDHN CC(C)[C@@H](O)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185463554 381640658 /nfs/dbraw/zinc/64/06/58/381640658.db2.gz KGTKXCLBZOFQKW-PXAZEXFGSA-N 0 3 277.408 2.939 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[O-] ZINC000371488988 381642644 /nfs/dbraw/zinc/64/26/44/381642644.db2.gz MMPWAYXZSSCXGI-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@@H]3CC[N@H+](C)[C@@H]3C2)c1[O-] ZINC000371488988 381642650 /nfs/dbraw/zinc/64/26/50/381642650.db2.gz MMPWAYXZSSCXGI-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN C[C@@H]([NH2+]CC[S@](=O)C(C)(C)C)c1cc(F)ccc1[O-] ZINC000185475982 381643803 /nfs/dbraw/zinc/64/38/03/381643803.db2.gz FENRVFJTBQCQPB-DGIBIBHMSA-N 0 3 287.400 2.729 20 10 CFCDHN C[C@@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000185535132 381660368 /nfs/dbraw/zinc/66/03/68/381660368.db2.gz UWJTVBDWXBNCNB-GQANPOSXSA-N 0 3 279.355 2.995 20 10 CFCDHN Cc1cccc(CN[C@@H]2CN(C)Cc3ccccc32)c1O ZINC000359895597 381663998 /nfs/dbraw/zinc/66/39/98/381663998.db2.gz HKZYNUXRYLJAMR-QGZVFWFLSA-N 0 3 282.387 2.977 20 10 CFCDHN C[C@H](CCO)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185500406 381651316 /nfs/dbraw/zinc/65/13/16/381651316.db2.gz RAWMOKCKSOXMCS-VXGBXAGGSA-N 0 3 263.381 2.693 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cc(F)ccc1[O-] ZINC000185653711 381694075 /nfs/dbraw/zinc/69/40/75/381694075.db2.gz CWFYVPFQJJGCJT-OCCSQVGLSA-N 0 3 289.350 2.958 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c([O-])c1C ZINC000359963515 381700727 /nfs/dbraw/zinc/70/07/27/381700727.db2.gz ZRVGYSPWYAFYNE-TZMCWYRMSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1[O-] ZINC000360042752 381746953 /nfs/dbraw/zinc/74/69/53/381746953.db2.gz YELGLIWQKOEKRB-IMJJTQAJSA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CC(=O)N(C(C)(C)C)C2)c1 ZINC000186085938 381820974 /nfs/dbraw/zinc/82/09/74/381820974.db2.gz ZRWFSZPKKQNSKE-OLZOCXBDSA-N 0 3 290.407 2.751 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)C[C@H](C)O)c1 ZINC000186075235 381817360 /nfs/dbraw/zinc/81/73/60/381817360.db2.gz XGJHCKMTARAZAD-NWDGAFQWSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1c(CN[C@@H](C)c2cc(C)ccc2O)cnn1C ZINC000186188055 381847791 /nfs/dbraw/zinc/84/77/91/381847791.db2.gz KAXKFDUIWKFNED-NSHDSACASA-N 0 3 259.353 2.593 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000374997588 382063641 /nfs/dbraw/zinc/06/36/41/382063641.db2.gz KKWODAQLLAUVRX-ZFWWWQNUSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1[O-] ZINC000374997588 382063646 /nfs/dbraw/zinc/06/36/46/382063646.db2.gz KKWODAQLLAUVRX-ZFWWWQNUSA-N 0 3 261.365 2.559 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000375825885 382105985 /nfs/dbraw/zinc/10/59/85/382105985.db2.gz SYEFOOJLGQFIAK-GOEBONIOSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000375825885 382105994 /nfs/dbraw/zinc/10/59/94/382105994.db2.gz SYEFOOJLGQFIAK-GOEBONIOSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@]3(CCCCO3)C2)c1[O-] ZINC000376029675 382117517 /nfs/dbraw/zinc/11/75/17/382117517.db2.gz PKUDYPRBSZJTIN-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@]3(CCCCO3)C2)c1[O-] ZINC000376029675 382117523 /nfs/dbraw/zinc/11/75/23/382117523.db2.gz PKUDYPRBSZJTIN-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@@]3(CCOC3)C2)c1 ZINC000376301253 382128905 /nfs/dbraw/zinc/12/89/05/382128905.db2.gz HCYVQBRNIBMWMW-VBQJREDUSA-N 0 3 291.391 2.689 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000375301596 382078854 /nfs/dbraw/zinc/07/88/54/382078854.db2.gz GXTVFYGHTXIWJL-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000375301596 382078861 /nfs/dbraw/zinc/07/88/61/382078861.db2.gz GXTVFYGHTXIWJL-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN Cc1cccc(C[NH+]2CCC([C@@H]3CCOC3)CC2)c1[O-] ZINC000363841878 382248127 /nfs/dbraw/zinc/24/81/27/382248127.db2.gz ASGZEPHVJCROLJ-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1[O-] ZINC000293751092 382262483 /nfs/dbraw/zinc/26/24/83/382262483.db2.gz RISQHFIQLPBZQZ-TZMCWYRMSA-N 0 3 250.386 2.631 20 10 CFCDHN CC(C)(CO)[C@H]([NH2+]Cc1ccccc1[O-])c1cccnc1 ZINC000293758788 382266756 /nfs/dbraw/zinc/26/67/56/382266756.db2.gz XMKVFJYUABJYNH-MRXNPFEDSA-N 0 3 286.375 2.637 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000293767999 382270446 /nfs/dbraw/zinc/27/04/46/382270446.db2.gz RVRAUQLEBMEVBV-UONOGXRCSA-N 0 3 292.423 2.904 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000187978475 382315266 /nfs/dbraw/zinc/31/52/66/382315266.db2.gz GLGOOOYTNBKQLS-UHFFFAOYSA-N 0 3 267.344 2.826 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000293880121 382320342 /nfs/dbraw/zinc/32/03/42/382320342.db2.gz CZNJVIAAMKWAND-MRXNPFEDSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000293880121 382320345 /nfs/dbraw/zinc/32/03/45/382320345.db2.gz CZNJVIAAMKWAND-MRXNPFEDSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000294028629 382384655 /nfs/dbraw/zinc/38/46/55/382384655.db2.gz NZEITIPESXFYJL-IRXDYDNUSA-N 0 3 273.376 2.844 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cccc(C)c1[O-])OC ZINC000294141315 382431476 /nfs/dbraw/zinc/43/14/76/382431476.db2.gz GKSGZLPVLSHCFL-FZMZJTMJSA-N 0 3 251.370 2.851 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@@H]21 ZINC000378538099 382479474 /nfs/dbraw/zinc/47/94/74/382479474.db2.gz ZZKJCYBEOINOKU-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@@H]21 ZINC000378538099 382479479 /nfs/dbraw/zinc/47/94/79/382479479.db2.gz ZZKJCYBEOINOKU-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCc2nccnc2C)c1 ZINC000295035017 382563756 /nfs/dbraw/zinc/56/37/56/382563756.db2.gz OYXIOMIZMLYNSM-GFCCVEGCSA-N 0 3 271.364 2.692 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCc2ncccc2C)c1 ZINC000295040153 382564107 /nfs/dbraw/zinc/56/41/07/382564107.db2.gz OQQNDHFXVIYJAU-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1cccnc1CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000295131317 382578158 /nfs/dbraw/zinc/57/81/58/382578158.db2.gz YMGGLSPHSKRMJA-UHFFFAOYSA-N 0 3 260.312 2.567 20 10 CFCDHN CC[C@@H]([NH2+]CCOCC(F)F)c1ccccc1[O-] ZINC000189846776 382642539 /nfs/dbraw/zinc/64/25/39/382642539.db2.gz RHUIZLWDNXKICP-LLVKDONJSA-N 0 3 259.296 2.715 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190848073 382682536 /nfs/dbraw/zinc/68/25/36/382682536.db2.gz WGCCFLXAHMGACY-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190848073 382682537 /nfs/dbraw/zinc/68/25/37/382682537.db2.gz WGCCFLXAHMGACY-LBPRGKRZSA-N 0 3 281.421 2.976 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCSC[C@@H](C)C2)c1 ZINC000190850311 382682554 /nfs/dbraw/zinc/68/25/54/382682554.db2.gz WKAYNDXOAAWTMK-LBPRGKRZSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCSC[C@@H](C)C2)c1 ZINC000190850311 382682555 /nfs/dbraw/zinc/68/25/55/382682555.db2.gz WKAYNDXOAAWTMK-LBPRGKRZSA-N 0 3 251.395 2.886 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CC1CCCC1 ZINC000190860902 382682926 /nfs/dbraw/zinc/68/29/26/382682926.db2.gz DOCUFRUBMZTBFI-HNNXBMFYSA-N 0 3 263.381 2.765 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)CC1CCCC1 ZINC000190860902 382682927 /nfs/dbraw/zinc/68/29/27/382682927.db2.gz DOCUFRUBMZTBFI-HNNXBMFYSA-N 0 3 263.381 2.765 20 10 CFCDHN C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1O)c1cc(F)ccc1[O-] ZINC000248493044 383249930 /nfs/dbraw/zinc/24/99/30/383249930.db2.gz JQWMTTACNIOXSO-LZVXQISVSA-N 0 3 287.334 2.840 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000248526213 383253887 /nfs/dbraw/zinc/25/38/87/383253887.db2.gz UWJTVBDWXBNCNB-PVRXDPTQSA-N 0 3 279.355 2.995 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@@H+]2CCC[C@H]2C1 ZINC000250743773 383379519 /nfs/dbraw/zinc/37/95/19/383379519.db2.gz GYAONYMBZAPFSO-AWEZNQCLSA-N 0 3 280.799 2.716 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[N@H+]2CCC[C@H]2C1 ZINC000250743773 383379523 /nfs/dbraw/zinc/37/95/23/383379523.db2.gz GYAONYMBZAPFSO-AWEZNQCLSA-N 0 3 280.799 2.716 20 10 CFCDHN CC[C@H](N[C@H]1CC[NH2+]C12CCC2)c1ccccc1[O-] ZINC000530216953 383768656 /nfs/dbraw/zinc/76/86/56/383768656.db2.gz RACPKOSTWZJLSA-ZFWWWQNUSA-N 0 3 260.381 2.718 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCC[C@@H](C)CO)cc1C ZINC000270243922 385029621 /nfs/dbraw/zinc/02/96/21/385029621.db2.gz DIKKLUYKTOHDIC-LLVKDONJSA-N 0 3 251.370 2.507 20 10 CFCDHN CCCOc1ccc(C[N@H+](CCO)C2CCCC2)c([O-])c1 ZINC000271028700 385308517 /nfs/dbraw/zinc/30/85/17/385308517.db2.gz XILISTIKXRLOBR-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCCOc1ccc(C[N@@H+](CCO)C2CCCC2)c([O-])c1 ZINC000271028700 385308519 /nfs/dbraw/zinc/30/85/19/385308519.db2.gz XILISTIKXRLOBR-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2CCCC23CCOCC3)c1 ZINC000282275932 385269162 /nfs/dbraw/zinc/26/91/62/385269162.db2.gz RLQQSRDGZPSVRA-MRXNPFEDSA-N 0 3 291.391 2.840 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271765394 385391160 /nfs/dbraw/zinc/39/11/60/385391160.db2.gz FIAKTWBPDRSMLC-LBPRGKRZSA-N 0 3 255.745 2.575 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000271765394 385391166 /nfs/dbraw/zinc/39/11/66/385391166.db2.gz FIAKTWBPDRSMLC-LBPRGKRZSA-N 0 3 255.745 2.575 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@@H](CO)C(C)(C)C)c1[O-] ZINC000271772636 385390784 /nfs/dbraw/zinc/39/07/84/385390784.db2.gz GKODBXYOGIPOCY-ZDUSSCGKSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@@H](CO)C(C)(C)C)c1[O-] ZINC000271772636 385390787 /nfs/dbraw/zinc/39/07/87/385390787.db2.gz GKODBXYOGIPOCY-ZDUSSCGKSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cc([C@@](C)(O)C[NH2+]Cc2cccc(C)c2[O-])c(C)o1 ZINC000271770323 385391306 /nfs/dbraw/zinc/39/13/06/385391306.db2.gz BOIVYSSZRUEXAP-KRWDZBQOSA-N 0 3 289.375 2.908 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@H]2CCC[C@H]2O)c1[O-] ZINC000271797297 385392278 /nfs/dbraw/zinc/39/22/78/385392278.db2.gz KGBHKOKGDLPXRP-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c1[O-] ZINC000271797297 385392284 /nfs/dbraw/zinc/39/22/84/385392284.db2.gz KGBHKOKGDLPXRP-BXUZGUMPSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cccc(C[NH2+]CC2([C@@H](C)CCO)CCC2)c1[O-] ZINC000271840846 385394121 /nfs/dbraw/zinc/39/41/21/385394121.db2.gz QULBMYIZMCFBOU-AWEZNQCLSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2cn[nH]c2)c1[O-] ZINC000271820993 385394156 /nfs/dbraw/zinc/39/41/56/385394156.db2.gz MTUINEOOCOIXSX-VIFPVBQESA-N 0 3 265.744 2.928 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](CCO)C2CCCCC2)c1 ZINC000271862470 385395760 /nfs/dbraw/zinc/39/57/60/385395760.db2.gz ZHEWGYVRBXCWGJ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](CCO)C2CCCCC2)c1 ZINC000271862470 385395764 /nfs/dbraw/zinc/39/57/64/385395764.db2.gz ZHEWGYVRBXCWGJ-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2([C@@H](C)CCO)CCC2)c1 ZINC000271873086 385395832 /nfs/dbraw/zinc/39/58/32/385395832.db2.gz YIUJUQYVVPDBBM-AWEZNQCLSA-N 0 3 277.408 2.979 20 10 CFCDHN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1[O-] ZINC000282836580 385398131 /nfs/dbraw/zinc/39/81/31/385398131.db2.gz CHGIYQANFQJPOK-CVEARBPZSA-N 0 3 295.386 2.946 20 10 CFCDHN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1[O-] ZINC000282836580 385398135 /nfs/dbraw/zinc/39/81/35/385398135.db2.gz CHGIYQANFQJPOK-CVEARBPZSA-N 0 3 295.386 2.946 20 10 CFCDHN Cc1cc([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)[nH]n1 ZINC000283113318 385437145 /nfs/dbraw/zinc/43/71/45/385437145.db2.gz URCAUSLFQFRGIT-LBPRGKRZSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)[nH]n1 ZINC000283113318 385437147 /nfs/dbraw/zinc/43/71/47/385437147.db2.gz URCAUSLFQFRGIT-LBPRGKRZSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n[nH]1 ZINC000283113318 385437150 /nfs/dbraw/zinc/43/71/50/385437150.db2.gz URCAUSLFQFRGIT-LBPRGKRZSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n[nH]1 ZINC000283113318 385437154 /nfs/dbraw/zinc/43/71/54/385437154.db2.gz URCAUSLFQFRGIT-LBPRGKRZSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2(C(N)=O)CCCC2)c([O-])c1 ZINC000283887580 385510365 /nfs/dbraw/zinc/51/03/65/385510365.db2.gz CJGZFYHZFKDIMN-CYBMUJFWSA-N 0 3 290.407 2.705 20 10 CFCDHN Cc1cc(CN[C@H](C)c2c(C)cc(C)cc2O)n(C)n1 ZINC000284062023 385529971 /nfs/dbraw/zinc/52/99/71/385529971.db2.gz MSNHYCRPEKCOTM-CYBMUJFWSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])n(C)n1 ZINC000284062023 385529973 /nfs/dbraw/zinc/52/99/73/385529973.db2.gz MSNHYCRPEKCOTM-CYBMUJFWSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2ccc(C)c(C)c2O)n(C)n1 ZINC000284137389 385539828 /nfs/dbraw/zinc/53/98/28/385539828.db2.gz DBDLYODKCZYZBM-ZDUSSCGKSA-N 0 3 273.380 2.902 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)CCCO)c([O-])c1 ZINC000284311445 385547781 /nfs/dbraw/zinc/54/77/81/385547781.db2.gz ZHKFDOLPAFKQKE-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN COC[C@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284006656 385524110 /nfs/dbraw/zinc/52/41/10/385524110.db2.gz HYAOZXAYHBWWOX-DGCLKSJQSA-N 0 3 251.370 2.942 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000285003878 385550937 /nfs/dbraw/zinc/55/09/37/385550937.db2.gz GXSINURAIKUWFK-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC(C)(C)O)c([O-])c1 ZINC000284980799 385551136 /nfs/dbraw/zinc/55/11/36/385551136.db2.gz GEGFSQPBBWZRKW-GFCCVEGCSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CC(=O)N(C(C)C)C2)c([O-])c1 ZINC000285159851 385552571 /nfs/dbraw/zinc/55/25/71/385552571.db2.gz MOGPXJGIPIXDKR-KGLIPLIRSA-N 0 3 290.407 2.669 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H]2CCOC[C@H]2C)c1[O-] ZINC000285577911 385556294 /nfs/dbraw/zinc/55/62/94/385556294.db2.gz TUVAFDMUVOMPMU-CHWSQXEVSA-N 0 3 279.380 2.553 20 10 CFCDHN CC[C@H]([NH2+]CCCN(C)CCOC)c1ccc(F)cc1[O-] ZINC000285635808 385556392 /nfs/dbraw/zinc/55/63/92/385556392.db2.gz LNBWXFBAWVRTRG-HNNXBMFYSA-N 0 3 298.402 2.540 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000272653189 385582865 /nfs/dbraw/zinc/58/28/65/385582865.db2.gz QEVPLZKOJLQLGR-HIFRSBDPSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000272653189 385582868 /nfs/dbraw/zinc/58/28/68/385582868.db2.gz QEVPLZKOJLQLGR-HIFRSBDPSA-N 0 3 293.407 2.774 20 10 CFCDHN COC[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273303999 385676392 /nfs/dbraw/zinc/67/63/92/385676392.db2.gz CHNYEUNMTRXDSI-GWCFXTLKSA-N 0 3 251.370 2.942 20 10 CFCDHN COCCOCCC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273379287 385678520 /nfs/dbraw/zinc/67/85/20/385678520.db2.gz HVKWWAKYLNKENO-CQSZACIVSA-N 0 3 281.396 2.713 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2ccccc2[O-])C[C@H]1O ZINC000273446133 385682491 /nfs/dbraw/zinc/68/24/91/385682491.db2.gz XNRBDEUNXWZOLU-UKRRQHHQSA-N 0 3 263.381 2.621 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@H]1O ZINC000273446133 385682495 /nfs/dbraw/zinc/68/24/95/385682495.db2.gz XNRBDEUNXWZOLU-UKRRQHHQSA-N 0 3 263.381 2.621 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@](C)(O)C(F)(F)F)c1 ZINC000273460455 385685311 /nfs/dbraw/zinc/68/53/11/385685311.db2.gz IASSKXRXXZJUIK-JOYOIKCWSA-N 0 3 277.286 2.665 20 10 CFCDHN Cc1noc(CCC[NH2+][C@H](C)c2ccc(C)c(C)c2[O-])n1 ZINC000273517853 385686151 /nfs/dbraw/zinc/68/61/51/385686151.db2.gz SVHCQBVKRXRPNP-GFCCVEGCSA-N 0 3 289.379 2.984 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CC(=O)N(C(C)C)C2)c([O-])c1C ZINC000273497412 385686504 /nfs/dbraw/zinc/68/65/04/385686504.db2.gz PMAHDTMTKLJNDA-UONOGXRCSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c([O-])c1C ZINC000273513148 385686612 /nfs/dbraw/zinc/68/66/12/385686612.db2.gz SDRVLKYKRQUONF-BLWXERESSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCO[C@H]2CCOC2)c([O-])c1C ZINC000273563890 385687957 /nfs/dbraw/zinc/68/79/57/385687957.db2.gz IZBYYPOYZUQWEI-CABCVRRESA-N 0 3 293.407 2.855 20 10 CFCDHN CCOCc1cc(CNCC2=CCCOC2)ccc1OC ZINC000288571044 197115669 /nfs/dbraw/zinc/11/56/69/197115669.db2.gz ZRJGMQZOMZIXDE-UHFFFAOYSA-N 0 3 291.391 2.668 20 10 CFCDHN CC[C@@H](NCc1ccc2c(c1)CCN2C)c1cnn(C)c1 ZINC000372422830 393447511 /nfs/dbraw/zinc/44/75/11/393447511.db2.gz SPIYPZKDOWBHMD-MRXNPFEDSA-N 0 3 284.407 2.653 20 10 CFCDHN CN(C)c1ccc(CN2CCC(c3cn[nH]c3)CC2)cc1 ZINC000372434188 393449223 /nfs/dbraw/zinc/44/92/23/393449223.db2.gz XNSGKWOQQBGMDA-UHFFFAOYSA-N 0 3 284.407 2.855 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC)cc2[O-])C12CCC2 ZINC000372635868 393454179 /nfs/dbraw/zinc/45/41/79/393454179.db2.gz NVWDAOZXXPBVIX-HZPDHXFCSA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc(O)c(CN2CCSC[C@@H]2C)c1 ZINC000179665226 393469116 /nfs/dbraw/zinc/46/91/16/393469116.db2.gz NRKLZMLAJLYEAS-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CC(=O)N(C(C)(C)C)C2)c([O-])c1 ZINC000186086288 393540603 /nfs/dbraw/zinc/54/06/03/393540603.db2.gz QOKMWOYDTCQNOU-QWHCGFSZSA-N 0 3 290.407 2.751 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000374255037 393489443 /nfs/dbraw/zinc/48/94/43/393489443.db2.gz OTVLEKMHKVUTBI-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c1 ZINC000374255037 393489449 /nfs/dbraw/zinc/48/94/49/393489449.db2.gz OTVLEKMHKVUTBI-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CCc2ccccn2)c1[O-] ZINC000120801388 393940516 /nfs/dbraw/zinc/94/05/16/393940516.db2.gz POFLTFIFOIDELU-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CCc2ccccn2)c1[O-] ZINC000120801388 393940519 /nfs/dbraw/zinc/94/05/19/393940519.db2.gz POFLTFIFOIDELU-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)CCc2ccccn2)c1 ZINC000120807247 393941267 /nfs/dbraw/zinc/94/12/67/393941267.db2.gz MQUDSCZLAVISPJ-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)CCc2ccccn2)c1 ZINC000120807247 393941271 /nfs/dbraw/zinc/94/12/71/393941271.db2.gz MQUDSCZLAVISPJ-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cn[nH]c1CNCc1c(C)c2ccccc2n1C ZINC000352951680 394022656 /nfs/dbraw/zinc/02/26/56/394022656.db2.gz VGHLVXBAHQKECK-UHFFFAOYSA-N 0 3 268.364 2.808 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562591 394030480 /nfs/dbraw/zinc/03/04/80/394030480.db2.gz FAGRMVDNPDHUOR-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562591 394030483 /nfs/dbraw/zinc/03/04/83/394030483.db2.gz FAGRMVDNPDHUOR-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562591 394030486 /nfs/dbraw/zinc/03/04/86/394030486.db2.gz FAGRMVDNPDHUOR-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3c([O-])cccc3Cl)[C@@H]2C1 ZINC000272562591 394030487 /nfs/dbraw/zinc/03/04/87/394030487.db2.gz FAGRMVDNPDHUOR-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCCC[C@@H](CO)C2)c1 ZINC000366813034 394248063 /nfs/dbraw/zinc/24/80/63/394248063.db2.gz VVCGVJLANCMFFN-CHWSQXEVSA-N 0 3 279.380 2.556 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCCC[C@@H](CO)C2)c1 ZINC000366813034 394248067 /nfs/dbraw/zinc/24/80/67/394248067.db2.gz VVCGVJLANCMFFN-CHWSQXEVSA-N 0 3 279.380 2.556 20 10 CFCDHN Cc1cnccc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297103647 394313503 /nfs/dbraw/zinc/31/35/03/394313503.db2.gz XUAKMWOXDMRYBY-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)c1[O-] ZINC000527925208 394426828 /nfs/dbraw/zinc/42/68/28/394426828.db2.gz LIYSLGFHBSXQTO-OLZOCXBDSA-N 0 3 279.380 2.868 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CCC(N)=O)Cc2ccccc2)c1 ZINC000122128899 292164225 /nfs/dbraw/zinc/16/42/25/292164225.db2.gz UMPZRSFBODKTFD-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CCC(N)=O)Cc2ccccc2)c1 ZINC000122128899 292164229 /nfs/dbraw/zinc/16/42/29/292164229.db2.gz UMPZRSFBODKTFD-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN COc1cc(O)c(CN2CCS[C@H](C)[C@@H]2C)cc1OC ZINC000160218024 286238958 /nfs/dbraw/zinc/23/89/58/286238958.db2.gz AJMGIBMFMAUNIC-WDEREUQCSA-N 0 3 297.420 2.735 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CCO)C(C)C)c1ccccc1[O-] ZINC000156059760 286923723 /nfs/dbraw/zinc/92/37/23/286923723.db2.gz VEWWRDQRLBTAHQ-KGLIPLIRSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cn1 ZINC000020186167 171049926 /nfs/dbraw/zinc/04/99/26/171049926.db2.gz AMNOAJQCGAZVTE-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H](CO)c2ccccc2)c1 ZINC000071409382 176156667 /nfs/dbraw/zinc/15/66/67/176156667.db2.gz DQSUQDSLXVKSOU-HNNXBMFYSA-N 0 3 257.333 2.524 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](C)c2cnn(C)c2C)c1 ZINC000037167670 260072999 /nfs/dbraw/zinc/07/29/99/260072999.db2.gz PPWOROGTYFTYLO-QWRGUYRKSA-N 0 3 289.379 2.855 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCC[C@H]2C2CC2)cc1OC ZINC000367221346 228092346 /nfs/dbraw/zinc/09/23/46/228092346.db2.gz IQCOLJAXXIIVMK-ZDUSSCGKSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCC[C@H]2C2CC2)cc1OC ZINC000367221346 228092349 /nfs/dbraw/zinc/09/23/49/228092349.db2.gz IQCOLJAXXIIVMK-ZDUSSCGKSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCOCC[C@@H]2C)c1 ZINC000367700886 267110401 /nfs/dbraw/zinc/11/04/01/267110401.db2.gz DRUSUHRPFYPQFJ-NWDGAFQWSA-N 0 3 265.353 2.573 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCOCC[C@@H]2C)c1 ZINC000367700886 267110403 /nfs/dbraw/zinc/11/04/03/267110403.db2.gz DRUSUHRPFYPQFJ-NWDGAFQWSA-N 0 3 265.353 2.573 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CC([C@@H]3CCOC3)C2)c1[O-] ZINC000368440405 267172789 /nfs/dbraw/zinc/17/27/89/267172789.db2.gz CSNVITGPKNUWOK-LLVKDONJSA-N 0 3 281.783 2.822 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@]23CCOC3)c1 ZINC000368486089 267175962 /nfs/dbraw/zinc/17/59/62/267175962.db2.gz APWBGOKTTVIOPM-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@]23CCOC3)c1 ZINC000368486089 267175963 /nfs/dbraw/zinc/17/59/63/267175963.db2.gz APWBGOKTTVIOPM-MRXNPFEDSA-N 0 3 277.364 2.546 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)c1[O-] ZINC000369676679 267259296 /nfs/dbraw/zinc/25/92/96/267259296.db2.gz ROUHLDMEZNCYLV-GXFFZTMASA-N 0 3 297.782 2.665 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c1[O-] ZINC000369676679 267259300 /nfs/dbraw/zinc/25/93/00/267259300.db2.gz ROUHLDMEZNCYLV-GXFFZTMASA-N 0 3 297.782 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000370721680 267341988 /nfs/dbraw/zinc/34/19/88/267341988.db2.gz AJRDPBBTJWKAOD-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000370721680 267341990 /nfs/dbraw/zinc/34/19/90/267341990.db2.gz AJRDPBBTJWKAOD-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@@H](O)C(F)F ZINC000296329432 276638171 /nfs/dbraw/zinc/63/81/71/276638171.db2.gz HEXYBGPQQKPGLR-VIRWGQHYSA-N 0 3 277.286 2.587 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496055 278383839 /nfs/dbraw/zinc/38/38/39/278383839.db2.gz PBLFQZZTJISEJK-RNCFNFMXSA-N 0 3 275.327 2.983 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000296048447 280830650 /nfs/dbraw/zinc/83/06/50/280830650.db2.gz QZJJXYBEWJYJAI-CQSZACIVSA-N 0 3 254.333 2.873 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CC(=O)N(C(C)(C)C)C2)c1 ZINC000186085902 280920825 /nfs/dbraw/zinc/92/08/25/280920825.db2.gz ZRWFSZPKKQNSKE-CHWSQXEVSA-N 0 3 290.407 2.751 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cn2cccn2)c([O-])c1 ZINC000037154473 280942341 /nfs/dbraw/zinc/94/23/41/280942341.db2.gz FZTXLAKBRYVUIW-CHWSQXEVSA-N 0 3 259.353 2.636 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295926007 294554735 /nfs/dbraw/zinc/55/47/35/294554735.db2.gz JYVASZFKKGNBLN-UONOGXRCSA-N 0 3 283.375 2.780 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CC(C)(C)O)c1 ZINC000295069921 295168357 /nfs/dbraw/zinc/16/83/57/295168357.db2.gz PEPKSLXTLGRDBL-MNOVXSKESA-N 0 3 267.369 2.601 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCN1C1CCCCC1 ZINC000527752111 330281108 /nfs/dbraw/zinc/28/11/08/330281108.db2.gz MKYMASFXZRGBBU-INIZCTEOSA-N 0 3 274.408 2.889 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c([O-])c1 ZINC000527804513 330284356 /nfs/dbraw/zinc/28/43/56/330284356.db2.gz QKOXAVHLHBDPNB-YRORDHRNSA-N 0 3 279.380 2.692 20 10 CFCDHN CCCCN(C)C[C@@H](C)[NH2+]Cc1cc(OC)ccc1[O-] ZINC000291631665 520414972 /nfs/dbraw/zinc/41/49/72/520414972.db2.gz SKUMQLMEHVGIQW-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN CCCCN(C)C[C@@H](C)[NH2+]Cc1cccc(OC)c1[O-] ZINC000289435260 520413091 /nfs/dbraw/zinc/41/30/91/520413091.db2.gz AEECMHFJSNGYCL-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN C[C@@H]1C[C@@]2(CCO1)C[N@H+](Cc1ccccc1[O-])C[C@H](C)O2 ZINC000373978973 500907185 /nfs/dbraw/zinc/90/71/85/500907185.db2.gz UMMWPFKDDZHSIW-KEYYUXOJSA-N 0 3 291.391 2.551 20 10 CFCDHN C[C@@H]1C[C@@]2(CCO1)C[N@@H+](Cc1ccccc1[O-])C[C@H](C)O2 ZINC000373978973 500907188 /nfs/dbraw/zinc/90/71/88/500907188.db2.gz UMMWPFKDDZHSIW-KEYYUXOJSA-N 0 3 291.391 2.551 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000062747641 521710400 /nfs/dbraw/zinc/71/04/00/521710400.db2.gz LVRBEJTXZDZJKO-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+]Cc1cccc(C)c1[O-] ZINC000224698461 522061198 /nfs/dbraw/zinc/06/11/98/522061198.db2.gz CTGPKIWBKPWSPE-CYBMUJFWSA-N 0 3 250.386 2.521 20 10 CFCDHN CC(=O)N1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000280981293 519539524 /nfs/dbraw/zinc/53/95/24/519539524.db2.gz MBTBQXRQWJVTTJ-ZFWWWQNUSA-N 0 3 290.407 2.610 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000290208766 519628261 /nfs/dbraw/zinc/62/82/61/519628261.db2.gz PTIXTDLMPJHAFL-VXGBXAGGSA-N 0 3 268.376 2.911 20 10 CFCDHN CC(C)N(Cc1cnn(C)c1)Cc1ccc(N(C)C)cc1 ZINC000299584926 519662599 /nfs/dbraw/zinc/66/25/99/519662599.db2.gz HSTJJHCNEYKIND-UHFFFAOYSA-N 0 3 286.423 2.897 20 10 CFCDHN CC(C)NC(=O)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263695339 519708579 /nfs/dbraw/zinc/70/85/79/519708579.db2.gz PVMFIXVJPPQOQN-UHFFFAOYSA-N 0 3 298.386 2.673 20 10 CFCDHN CC(C)[C@H]([NH2+][C@H](C)c1ccccc1[O-])C(C)(C)O ZINC000276753595 519821578 /nfs/dbraw/zinc/82/15/78/519821578.db2.gz IAHGHVUUINTCFD-RISCZKNCSA-N 0 3 251.370 2.838 20 10 CFCDHN CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(C)c(C)c1O ZINC000276583725 520202643 /nfs/dbraw/zinc/20/26/43/520202643.db2.gz INBAWVLERCVKRU-QWHCGFSZSA-N 0 3 278.396 2.526 20 10 CFCDHN CCN(C)C(=O)[C@H](C)N[C@H](C)c1ccc(C)c(C)c1O ZINC000276583724 520213571 /nfs/dbraw/zinc/21/35/71/520213571.db2.gz INBAWVLERCVKRU-OLZOCXBDSA-N 0 3 278.396 2.526 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)[C@@H](C)OC)c([O-])c1 ZINC000289846289 520374494 /nfs/dbraw/zinc/37/44/94/520374494.db2.gz PFKIDYNEZNTHJD-VXGBXAGGSA-N 0 3 267.369 2.694 20 10 CFCDHN CCOC(=O)C1CCC([NH2+]Cc2ccccc2[O-])CC1 ZINC000037788227 520554797 /nfs/dbraw/zinc/55/47/97/520554797.db2.gz KPFWJHOPTDGMHE-UHFFFAOYSA-N 0 3 277.364 2.604 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCCCO)cc1F ZINC000276667477 520891197 /nfs/dbraw/zinc/89/11/97/520891197.db2.gz ORDJKOSHAGLIBG-UHFFFAOYSA-N 0 3 282.403 2.876 20 10 CFCDHN CCC[C@H](CCO)C[NH2+]Cc1cccc(C)c1[O-] ZINC000224876051 521095561 /nfs/dbraw/zinc/09/55/61/521095561.db2.gz FBZPERWAHBPNNK-CYBMUJFWSA-N 0 3 251.370 2.589 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CCCn2ccnc2)c1 ZINC000290440758 521139289 /nfs/dbraw/zinc/13/92/89/521139289.db2.gz LUZAOJZICNWRLE-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CCCn2ccnc2)c1 ZINC000290440758 521139296 /nfs/dbraw/zinc/13/92/96/521139296.db2.gz LUZAOJZICNWRLE-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@](C)(OC)C2CC2)c1 ZINC000291055322 521149892 /nfs/dbraw/zinc/14/98/92/521149892.db2.gz OECAOMFVUQKSLE-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@]2(O)CCCC2(C)C)c1 ZINC000292925107 521153051 /nfs/dbraw/zinc/15/30/51/521153051.db2.gz INXIDNKXLRYDLL-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN CCOc1cccc(C[N@H+](C)[C@H]2CCN(C)C[C@@H]2C)c1[O-] ZINC000290316364 521334597 /nfs/dbraw/zinc/33/45/97/521334597.db2.gz COGCURFTZMAILJ-ZFWWWQNUSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)[C@H]2CCN(C)C[C@@H]2C)c1[O-] ZINC000290316364 521334601 /nfs/dbraw/zinc/33/46/01/521334601.db2.gz COGCURFTZMAILJ-ZFWWWQNUSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1cccc(C[NH2+]CC2(SC)CC2)c1[O-] ZINC000193659872 521363106 /nfs/dbraw/zinc/36/31/06/521363106.db2.gz XPKILTVMVWTYNO-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](CCO)C(C)(C)C)c1[O-] ZINC000231075218 521370517 /nfs/dbraw/zinc/37/05/17/521370517.db2.gz JIMFKZTWFKKAKH-AWEZNQCLSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](CCO)C(C)(C)C)c1[O-] ZINC000231075221 521376487 /nfs/dbraw/zinc/37/64/87/521376487.db2.gz JIMFKZTWFKKAKH-CQSZACIVSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(CN[C@H](CO)c2ccccc2)c1O ZINC000062999376 521376651 /nfs/dbraw/zinc/37/66/51/521376651.db2.gz DYLZFGLOOFXVGN-OAHLLOKOSA-N 0 3 287.359 2.614 20 10 CFCDHN CCOC(CC[NH2+][C@H](C)c1cc(OC)ccc1[O-])OCC ZINC000276516396 521629240 /nfs/dbraw/zinc/62/92/40/521629240.db2.gz LMAZAUQEBHRVPY-GFCCVEGCSA-N 0 3 297.395 2.841 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280168895 521653152 /nfs/dbraw/zinc/65/31/52/521653152.db2.gz RCLNVHXMNTVBBN-GNHJJJEISA-N 0 3 293.407 2.671 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@H](C)c2ccc(C)cc2[O-])CCC1 ZINC000277114044 521733560 /nfs/dbraw/zinc/73/35/60/521733560.db2.gz IGEHHJAMZVHOSQ-CYBMUJFWSA-N 0 3 290.407 2.658 20 10 CFCDHN CN(C)c1ccc(CN(Cc2cnc[nH]2)C2CC2)cc1 ZINC000280525037 522173245 /nfs/dbraw/zinc/17/32/45/522173245.db2.gz RLHSBRIAWGGPSA-UHFFFAOYSA-N 0 3 270.380 2.640 20 10 CFCDHN CN(C)c1ccc(CN[C@H](CO)c2ccccc2)cc1 ZINC000062998920 522211954 /nfs/dbraw/zinc/21/19/54/522211954.db2.gz LRXBGYYNTUJPHS-QGZVFWFLSA-N 0 3 270.376 2.576 20 10 CFCDHN COc1cc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])ccn1 ZINC000062057928 522483123 /nfs/dbraw/zinc/48/31/23/522483123.db2.gz QNASFAYCULLREZ-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@H](O)C(C)(C)C2)c1O ZINC000275996527 522537703 /nfs/dbraw/zinc/53/77/03/522537703.db2.gz OFDQTSQIOGGELI-ZDUSSCGKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2CC(C)C2)c1[O-] ZINC000169090959 522540699 /nfs/dbraw/zinc/54/06/99/522540699.db2.gz YJBUYKRTSLDIPH-UHFFFAOYSA-N 0 3 255.745 2.942 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCc2ccncc2)c1[O-] ZINC000228676128 522541608 /nfs/dbraw/zinc/54/16/08/522541608.db2.gz APHXMRKCVMTYIQ-UHFFFAOYSA-N 0 3 292.766 2.782 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@H](C)OC)c1[O-] ZINC000273746477 522542009 /nfs/dbraw/zinc/54/20/09/522542009.db2.gz MVBFFZSFTZHNEP-VIFPVBQESA-N 0 3 273.760 2.569 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(C)cc1[O-] ZINC000279970034 522708951 /nfs/dbraw/zinc/70/89/51/522708951.db2.gz CWPHGFOZBZTVNY-GUTXKFCHSA-N 0 3 261.365 2.678 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CO[C@@H]1CCOC1)c1ccccc1[O-] ZINC000156297709 522733221 /nfs/dbraw/zinc/73/32/21/522733221.db2.gz YTCHIVNUXHGURS-NFAWXSAZSA-N 0 3 279.380 2.627 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1[O-])[C@@H]1CCCO1 ZINC000278832459 522764259 /nfs/dbraw/zinc/76/42/59/522764259.db2.gz OZYRPUQIZVHFAB-KBMXLJTQSA-N 0 3 293.407 2.854 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)CC(C)(C)C)cc1OC ZINC000160233590 522771027 /nfs/dbraw/zinc/77/10/27/522771027.db2.gz JCNLSIUOVKVUCP-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)CC(C)(C)C)cc1OC ZINC000160233590 522771033 /nfs/dbraw/zinc/77/10/33/522771033.db2.gz JCNLSIUOVKVUCP-UHFFFAOYSA-N 0 3 267.369 2.887 20 10 CFCDHN CC[C@@H]([NH2+]CC1(CO)CCOCC1)c1ccc(C)cc1[O-] ZINC000280249625 522820852 /nfs/dbraw/zinc/82/08/52/522820852.db2.gz WOEJPNWFUHNUCC-OAHLLOKOSA-N 0 3 293.407 2.530 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N(C)C)CCC1)c1ccccc1[O-] ZINC000097927942 522822027 /nfs/dbraw/zinc/82/20/27/522822027.db2.gz FWTNAEFDIUDIOS-CQSZACIVSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@@H](C)O)c1ccc(C)cc1[O-] ZINC000280077168 522831275 /nfs/dbraw/zinc/83/12/75/522831275.db2.gz LLSRAAARNYZKHF-TZMCWYRMSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]CCNC(=O)C(C)C)c1ccc(C)cc1[O-] ZINC000279957173 522836453 /nfs/dbraw/zinc/83/64/53/522836453.db2.gz CBYTXTQLSXNHKH-CQSZACIVSA-N 0 3 278.396 2.514 20 10 CFCDHN CC[C@@H](NCc1ccc(N(C)C)cc1)c1cnn(C)c1 ZINC000160529780 522878647 /nfs/dbraw/zinc/87/86/47/522878647.db2.gz GMDVCIGAQKNJAN-MRXNPFEDSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(C(C)C)C1=O)c1ccc(C)cc1[O-] ZINC000279942925 522925551 /nfs/dbraw/zinc/92/55/51/522925551.db2.gz BHYSFHJDTOLABD-HUUCEWRRSA-N 0 3 290.407 2.751 20 10 CFCDHN C[N@H+](CC[C@H](O)c1ccccc1)Cc1ccccc1[O-] ZINC000290129584 522935637 /nfs/dbraw/zinc/93/56/37/522935637.db2.gz ZIIABQHKUWBHRA-KRWDZBQOSA-N 0 3 271.360 2.948 20 10 CFCDHN C[N@@H+](CC[C@H](O)c1ccccc1)Cc1ccccc1[O-] ZINC000290129584 522935647 /nfs/dbraw/zinc/93/56/47/522935647.db2.gz ZIIABQHKUWBHRA-KRWDZBQOSA-N 0 3 271.360 2.948 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)c1cnn(C)c1)c1ccccc1[O-] ZINC000156005156 522940507 /nfs/dbraw/zinc/94/05/07/522940507.db2.gz OUUOHWOSCMUWJB-BXUZGUMPSA-N 0 3 259.353 2.928 20 10 CFCDHN CC[C@@H](c1ccccc1O)N1CCO[C@H](COC(C)C)C1 ZINC000372516578 523106000 /nfs/dbraw/zinc/10/60/00/523106000.db2.gz ROXQKCIOGKOTRF-HOCLYGCPSA-N 0 3 293.407 2.969 20 10 CFCDHN COCCCCC[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000230934280 523133449 /nfs/dbraw/zinc/13/34/49/523133449.db2.gz XGQVKYAAOOQTDZ-UHFFFAOYSA-N 0 3 287.787 2.961 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1c(F)cccc1F ZINC000264680050 523383969 /nfs/dbraw/zinc/38/39/69/523383969.db2.gz CLAKZINQDZAUDE-OAHLLOKOSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1c(F)cccc1F ZINC000264680050 523383977 /nfs/dbraw/zinc/38/39/77/523383977.db2.gz CLAKZINQDZAUDE-OAHLLOKOSA-N 0 3 293.313 2.836 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000193877988 523966031 /nfs/dbraw/zinc/96/60/31/523966031.db2.gz SXBJLTAYXDBEEM-FRRDWIJNSA-N 0 3 277.364 2.693 20 10 CFCDHN COC(=O)[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000193878003 523966547 /nfs/dbraw/zinc/96/65/47/523966547.db2.gz SXBJLTAYXDBEEM-RWMBFGLXSA-N 0 3 277.364 2.693 20 10 CFCDHN COc1ccc(CNC[C@H](c2ccco2)N(C)C)cc1C ZINC000035052618 524071907 /nfs/dbraw/zinc/07/19/07/524071907.db2.gz VQXNGXMMDUAUQN-OAHLLOKOSA-N 0 3 288.391 2.989 20 10 CFCDHN COc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1C ZINC000058792308 524072050 /nfs/dbraw/zinc/07/20/50/524072050.db2.gz ZVGVYYLCTHTNKB-INIZCTEOSA-N 0 3 289.350 2.966 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000279681278 524389531 /nfs/dbraw/zinc/38/95/31/524389531.db2.gz AJHRTNNWROGGDO-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000279681278 524389540 /nfs/dbraw/zinc/38/95/40/524389540.db2.gz AJHRTNNWROGGDO-DZGCQCFKSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c1[O-] ZINC000273179992 524433474 /nfs/dbraw/zinc/43/34/74/524433474.db2.gz OBRRGFJALDFZGH-KGLIPLIRSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000290829706 524434475 /nfs/dbraw/zinc/43/44/75/524434475.db2.gz HKYHXUWCJKJDKN-HNNXBMFYSA-N 0 3 263.381 2.587 20 10 CFCDHN C[C@@H](CC[NH2+]Cc1ccccc1[O-])NC(=O)OC(C)(C)C ZINC000222081901 524499229 /nfs/dbraw/zinc/49/92/29/524499229.db2.gz XFQBYSCYCGYSFR-LBPRGKRZSA-N 0 3 294.395 2.785 20 10 CFCDHN COc1ccc(O)c(CN(C)Cc2ccc(O)cc2)c1 ZINC000290421540 524733549 /nfs/dbraw/zinc/73/35/49/524733549.db2.gz KTGVZNDEWPAFBX-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2c(C)nn(C)c2C)c1 ZINC000092324571 524764023 /nfs/dbraw/zinc/76/40/23/524764023.db2.gz XXLXCDDMLSMYQN-SNVBAGLBSA-N 0 3 289.379 2.602 20 10 CFCDHN COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2[O-])c1 ZINC000168753176 524766887 /nfs/dbraw/zinc/76/68/87/524766887.db2.gz FQTSRMJWMZKSAH-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CSC)c1 ZINC000168786049 524767135 /nfs/dbraw/zinc/76/71/35/524767135.db2.gz XTRLDKQSOQICEE-NXEZZACHSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)CSC)c1 ZINC000168785958 524767187 /nfs/dbraw/zinc/76/71/87/524767187.db2.gz XTRLDKQSOQICEE-VHSXEESVSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCOCC2CC2)c1 ZINC000020190773 524769847 /nfs/dbraw/zinc/76/98/47/524769847.db2.gz GPTYGRQQERPGDE-LBPRGKRZSA-N 0 3 279.380 2.868 20 10 CFCDHN C[C@H]1[N@H+](Cc2cc(F)ccc2[O-])CCC12CCOCC2 ZINC000364942426 525003629 /nfs/dbraw/zinc/00/36/29/525003629.db2.gz MVGUJHOQMDIWFK-GFCCVEGCSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@H]1[N@@H+](Cc2cc(F)ccc2[O-])CCC12CCOCC2 ZINC000364942426 525003637 /nfs/dbraw/zinc/00/36/37/525003637.db2.gz MVGUJHOQMDIWFK-GFCCVEGCSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@@H]1C[N@@H+]2CCC[C@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000245947150 525087542 /nfs/dbraw/zinc/08/75/42/525087542.db2.gz RXXJOAPSHLMGHR-RISCZKNCSA-N 0 3 280.799 2.714 20 10 CFCDHN C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc(Cl)ccc1[O-] ZINC000245947150 525087552 /nfs/dbraw/zinc/08/75/52/525087552.db2.gz RXXJOAPSHLMGHR-RISCZKNCSA-N 0 3 280.799 2.714 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@](C)(O)CC2)cc1C ZINC000279736082 525314789 /nfs/dbraw/zinc/31/47/89/525314789.db2.gz WOVSKKITQNWUOH-INIZCTEOSA-N 0 3 263.381 2.746 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@](C)(O)CC2)cc1C ZINC000279736082 525314797 /nfs/dbraw/zinc/31/47/97/525314797.db2.gz WOVSKKITQNWUOH-INIZCTEOSA-N 0 3 263.381 2.746 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](n3cccn3)C2)cc1C ZINC000291173767 525319376 /nfs/dbraw/zinc/31/93/76/525319376.db2.gz RZCWSKHZXWKVCX-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](n3cccn3)C2)cc1C ZINC000291173767 525319385 /nfs/dbraw/zinc/31/93/85/525319385.db2.gz RZCWSKHZXWKVCX-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1ccc(O)c(CN2CC[C@@H](n3cc(Cl)cn3)C2)c1 ZINC000290879578 525342176 /nfs/dbraw/zinc/34/21/76/525342176.db2.gz KSYNHZAXYCAPOQ-CQSZACIVSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C2CCN(C3CCC3)CC2)c1 ZINC000264999339 525345009 /nfs/dbraw/zinc/34/50/09/525345009.db2.gz ZCOKCIRBQRGKER-UHFFFAOYSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2(N(C)C)CCCC2)c1 ZINC000096543742 525346500 /nfs/dbraw/zinc/34/65/00/525346500.db2.gz RHUABDDPRFBFLP-UHFFFAOYSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000289776074 525349545 /nfs/dbraw/zinc/34/95/45/525349545.db2.gz JEXCCMARBUQSGI-MJGOQNOKSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCc2cccnc2)c1 ZINC000037718026 525360722 /nfs/dbraw/zinc/36/07/22/525360722.db2.gz UOCWKMFTLDRBND-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN C[C@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1ccccc1[O-] ZINC000183517651 525366248 /nfs/dbraw/zinc/36/62/48/525366248.db2.gz YEESKXJUEDLBCP-BBATYDOGSA-N 0 3 269.410 2.590 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000094617611 525416350 /nfs/dbraw/zinc/41/63/50/525416350.db2.gz ABRPQGHDDUTMEP-NWDGAFQWSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCN(c2ncccn2)C1)c1ccccc1[O-] ZINC000192815469 525608503 /nfs/dbraw/zinc/60/85/03/525608503.db2.gz YSYXNZDGMWGVJK-KBPBESRZSA-N 0 3 298.390 2.502 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cn2cccn2)c([O-])c1 ZINC000037154469 525738796 /nfs/dbraw/zinc/73/87/96/525738796.db2.gz FZTXLAKBRYVUIW-QWHCGFSZSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000037649052 525924440 /nfs/dbraw/zinc/92/44/40/525924440.db2.gz IAACUQGPBGHZGM-UONOGXRCSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)Cc2ccccc2)c([O-])c1 ZINC000063218410 525936641 /nfs/dbraw/zinc/93/66/41/525936641.db2.gz VUQWOCGAGKVCKK-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)C2CCCC2)c([O-])c1 ZINC000290203136 525938339 /nfs/dbraw/zinc/93/83/39/525938339.db2.gz PHOBFRDVEGMQIQ-WFASDCNBSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290296579 525941181 /nfs/dbraw/zinc/94/11/81/525941181.db2.gz AWRHFWIPWMVZTM-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290296579 525941191 /nfs/dbraw/zinc/94/11/91/525941191.db2.gz AWRHFWIPWMVZTM-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc(C[NH2+]CCCc2cnccc2C)c1[O-] ZINC000289373492 526014791 /nfs/dbraw/zinc/01/47/91/526014791.db2.gz BLRRYAJVJRLBPY-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H](C(C)C)N2CCCC2)c1[O-] ZINC000020200751 526016844 /nfs/dbraw/zinc/01/68/44/526016844.db2.gz DAVJZXJPHRLBST-HNNXBMFYSA-N 0 3 292.423 2.611 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2CCCCN2C2CC2)c1[O-] ZINC000277436709 526018951 /nfs/dbraw/zinc/01/89/51/526018951.db2.gz DBQSINGAYYZXHJ-HNNXBMFYSA-N 0 3 290.407 2.507 20 10 CFCDHN Cc1cnn([C@@H]2CCN(Cc3ccc(N(C)C)cc3)C2)c1 ZINC000290057674 526266946 /nfs/dbraw/zinc/26/69/46/526266946.db2.gz XKPNWORHJUZJBH-QGZVFWFLSA-N 0 3 284.407 2.705 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@H](O)c1ccccc1 ZINC000289407024 526350194 /nfs/dbraw/zinc/35/01/94/526350194.db2.gz HIDCABBBHLFUCF-INIZCTEOSA-N 0 3 275.323 2.745 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCOC1CCOCC1)CC2 ZINC000296706047 526368373 /nfs/dbraw/zinc/36/83/73/526368373.db2.gz HXGGMKFVYXFYKH-OAHLLOKOSA-N 0 3 291.391 2.555 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000188249441 526372682 /nfs/dbraw/zinc/37/26/82/526372682.db2.gz PTTYVWJCQURZRA-INIZCTEOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cccc(N2CCOCC2)c1 ZINC000292991042 526373777 /nfs/dbraw/zinc/37/37/77/526373777.db2.gz NYMHBHSOFYSNRW-UHFFFAOYSA-N 0 3 298.386 2.519 20 10 CFCDHN Cc1noc(CCC[NH2+][C@@H](C)c2cc(C)ccc2[O-])n1 ZINC000273508660 526604755 /nfs/dbraw/zinc/60/47/55/526604755.db2.gz RIKHMTAEJNEFMF-NSHDSACASA-N 0 3 275.352 2.675 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000273583648 527431428 /nfs/dbraw/zinc/43/14/28/527431428.db2.gz NFOFTGLNFLWOCJ-LBPRGKRZSA-N 0 3 259.353 2.556 20 10 CFCDHN Cn1ccnc1[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000365839261 527458632 /nfs/dbraw/zinc/45/86/32/527458632.db2.gz XTZILNKMHXDFSQ-CQSZACIVSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000365839261 527458636 /nfs/dbraw/zinc/45/86/36/527458636.db2.gz XTZILNKMHXDFSQ-CQSZACIVSA-N 0 3 271.364 2.505 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC12CCC(CO)CC2 ZINC000361051862 527528164 /nfs/dbraw/zinc/52/81/64/527528164.db2.gz LFWFTUXMAIGPJU-UHFFFAOYSA-N 0 3 279.355 2.658 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC12CCC(CO)CC2 ZINC000361051862 527528170 /nfs/dbraw/zinc/52/81/70/527528170.db2.gz LFWFTUXMAIGPJU-UHFFFAOYSA-N 0 3 279.355 2.658 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291335923 527604898 /nfs/dbraw/zinc/60/48/98/527604898.db2.gz VFDQVGFCYBLOCL-GOSISDBHSA-N 0 3 283.371 2.528 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291335923 527604905 /nfs/dbraw/zinc/60/49/05/527604905.db2.gz VFDQVGFCYBLOCL-GOSISDBHSA-N 0 3 283.371 2.528 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C1(CO)CC1 ZINC000753852130 574051180 /nfs/dbraw/zinc/05/11/80/574051180.db2.gz XTEIVXJOUBVFEX-UHFFFAOYSA-N 0 3 269.344 2.674 20 10 CFCDHN CCc1nn(C)c(CC)c1CNCc1cc(C)ccc1O ZINC000754843900 574124156 /nfs/dbraw/zinc/12/41/56/574124156.db2.gz SBXHXYWMSLFZKN-UHFFFAOYSA-N 0 3 287.407 2.849 20 10 CFCDHN CC1CC[NH+](CCCCNC(=O)c2cc([O-])cs2)CC1 ZINC000731869822 574131292 /nfs/dbraw/zinc/13/12/92/574131292.db2.gz OWALDBXORFQHOX-UHFFFAOYSA-N 0 3 296.436 2.696 20 10 CFCDHN Cc1nccn1CCC[N@@H+](C)Cc1cc2c(cc1[O-])CCC2 ZINC000746626213 574159522 /nfs/dbraw/zinc/15/95/22/574159522.db2.gz BYZLGJZUQSGKHP-UHFFFAOYSA-N 0 3 299.418 2.908 20 10 CFCDHN Cc1nccn1CCC[N@H+](C)Cc1cc2c(cc1[O-])CCC2 ZINC000746626213 574159524 /nfs/dbraw/zinc/15/95/24/574159524.db2.gz BYZLGJZUQSGKHP-UHFFFAOYSA-N 0 3 299.418 2.908 20 10 CFCDHN COCCC(C)(C)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000747100263 574179910 /nfs/dbraw/zinc/17/99/10/574179910.db2.gz HSWNZDPMWNTKIG-UHFFFAOYSA-N 0 3 251.370 2.914 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C2CCN(C)CC2)c2c1c(F)ccc2[O-] ZINC000756364593 574229813 /nfs/dbraw/zinc/22/98/13/574229813.db2.gz VEYUKARVBMBWQR-GWCFXTLKSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H](Cn1ccnc1)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756401649 574234022 /nfs/dbraw/zinc/23/40/22/574234022.db2.gz JEVUUCSBYPRGTF-DMDPSCGWSA-N 0 3 289.354 2.954 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417170 574235526 /nfs/dbraw/zinc/23/55/26/574235526.db2.gz KLKYBXRXXFHMAY-CYZMBNFOSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417170 574235530 /nfs/dbraw/zinc/23/55/30/574235530.db2.gz KLKYBXRXXFHMAY-CYZMBNFOSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)c1cc(F)cc(F)c1[O-] ZINC000756417170 574235533 /nfs/dbraw/zinc/23/55/33/574235533.db2.gz KLKYBXRXXFHMAY-CYZMBNFOSA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756432598 574236788 /nfs/dbraw/zinc/23/67/88/574236788.db2.gz JRYZWOSUYNKVLA-NSHDSACASA-N 0 3 277.343 2.777 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCOC2)c2c1c(F)ccc2[O-] ZINC000756455628 574238634 /nfs/dbraw/zinc/23/86/34/574238634.db2.gz ASPGGOSLODWZBE-CKYFFXLPSA-N 0 3 265.328 2.706 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756462955 574239353 /nfs/dbraw/zinc/23/93/53/574239353.db2.gz ZMSRAISRFVMBCK-CYBMUJFWSA-N 0 3 278.396 2.576 20 10 CFCDHN CC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(C)ccc1[O-] ZINC000748241678 574242434 /nfs/dbraw/zinc/24/24/34/574242434.db2.gz DJXCNWSFUFFIKZ-OAHLLOKOSA-N 0 3 265.353 2.522 20 10 CFCDHN COC(=O)N1CCC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000756526881 574243801 /nfs/dbraw/zinc/24/38/01/574243801.db2.gz HXTUJOJYZOSIOP-STQMWFEESA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@@H]([NH2+]CC1(O)CCC1)c1cc2c(cc1[O-])CCCC2 ZINC000756564235 574248206 /nfs/dbraw/zinc/24/82/06/574248206.db2.gz RLZYGHNBBXGXAT-GFCCVEGCSA-N 0 3 275.392 2.837 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000756565192 574248352 /nfs/dbraw/zinc/24/83/52/574248352.db2.gz WJXWMSZMJWMWSJ-MWLCHTKSSA-N 0 3 265.328 2.584 20 10 CFCDHN CC[S@](=O)CC[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756576687 574249894 /nfs/dbraw/zinc/24/98/94/574249894.db2.gz NZTUMXYLENRSGC-YUNKPMOVSA-N 0 3 295.448 2.690 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCNc2ncccn2)c1 ZINC000756642386 574254702 /nfs/dbraw/zinc/25/47/02/574254702.db2.gz NOAXHHROOGVZQH-ZDUSSCGKSA-N 0 3 286.379 2.643 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C=C[C@H](CO)C2)c2c1c(F)ccc2[O-] ZINC000756661219 574256390 /nfs/dbraw/zinc/25/63/90/574256390.db2.gz QEJZOQKMLNZIIY-XZUYRWCXSA-N 0 3 277.339 2.606 20 10 CFCDHN Cc1n[nH]cc1C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756736680 574260136 /nfs/dbraw/zinc/26/01/36/574260136.db2.gz CCNMBCUXJFKVJR-UFBFGSQYSA-N 0 3 275.327 2.901 20 10 CFCDHN Cc1ccc([C@H](C)N[C@H](CO)CC(F)(F)F)c(O)c1C ZINC000756777153 574262235 /nfs/dbraw/zinc/26/22/35/574262235.db2.gz VZXIMQXQKXMWIW-QWRGUYRKSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)CC(F)(F)F)c([O-])c1C ZINC000756777153 574262237 /nfs/dbraw/zinc/26/22/37/574262237.db2.gz VZXIMQXQKXMWIW-QWRGUYRKSA-N 0 3 291.313 2.973 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]2OC)c1 ZINC000756787087 574262790 /nfs/dbraw/zinc/26/27/90/574262790.db2.gz OHJZRMPXHAKNFX-MKBNYLNASA-N 0 3 279.380 2.867 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H]2CCC[C@@H]2OC)c1 ZINC000756787089 574262830 /nfs/dbraw/zinc/26/28/30/574262830.db2.gz OHJZRMPXHAKNFX-OZVIIMIRSA-N 0 3 279.380 2.867 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C2CCC(C)(O)CC2)c1 ZINC000749296736 574288369 /nfs/dbraw/zinc/28/83/69/574288369.db2.gz UUFYUFKZKVWWHB-UHFFFAOYSA-N 0 3 279.380 2.574 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@H]([C@@H]3CCOC3)C1)CCC2 ZINC000749797991 574309475 /nfs/dbraw/zinc/30/94/75/574309475.db2.gz CXRGUVSACIIUEC-JKSUJKDBSA-N 0 3 287.403 2.739 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@H]([C@@H]3CCOC3)C1)CCC2 ZINC000749797991 574309479 /nfs/dbraw/zinc/30/94/79/574309479.db2.gz CXRGUVSACIIUEC-JKSUJKDBSA-N 0 3 287.403 2.739 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCc1ccc(C)o1 ZINC000725847859 574328622 /nfs/dbraw/zinc/32/86/22/574328622.db2.gz UIZZNRJSBVPRCW-UHFFFAOYSA-N 0 3 261.321 2.635 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CC)C[C@@H](C)CO)c([O-])c1 ZINC000743499653 574367006 /nfs/dbraw/zinc/36/70/06/574367006.db2.gz MNKOYAPSDDOTAR-TZMCWYRMSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(CO)CCCCC2)c([O-])c1 ZINC000751509593 574378094 /nfs/dbraw/zinc/37/80/94/574378094.db2.gz LOUPDXOBEDINLB-UHFFFAOYSA-N 0 3 293.407 2.823 20 10 CFCDHN CN(Cc1cccc2c1OCC2)Cc1ccccc1O ZINC000891713403 617723666 /nfs/dbraw/zinc/72/36/66/617723666.db2.gz CBOCBBJFLCASBR-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1C[C@]1(C)Br ZINC000891714051 617724239 /nfs/dbraw/zinc/72/42/39/617724239.db2.gz PZGDLXXBBILMGV-YPMHNXCESA-N 0 3 284.197 2.998 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1C[C@]1(C)Br ZINC000891714051 617724242 /nfs/dbraw/zinc/72/42/42/617724242.db2.gz PZGDLXXBBILMGV-YPMHNXCESA-N 0 3 284.197 2.998 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cncn1C)c1ccc(C)cc1[O-] ZINC000289772210 618130944 /nfs/dbraw/zinc/13/09/44/618130944.db2.gz MHCKBIXLVWOLNG-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN COc1ccc(CN2CCc3ccccc3C2)c(O)c1OC ZINC000891391080 618182523 /nfs/dbraw/zinc/18/25/23/618182523.db2.gz RUZZWNWBIRDZBZ-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN CCOc1cccc(CNCc2ccc(C)o2)c1O ZINC000053035921 618211600 /nfs/dbraw/zinc/21/16/00/618211600.db2.gz BFDTWWBUYQSZLB-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN Cc1cccc(CN2CCc3nc[nH]c3C23CCC3)c1O ZINC000895068601 618255685 /nfs/dbraw/zinc/25/56/85/618255685.db2.gz HVXDVMWEVRCZAW-UHFFFAOYSA-N 0 3 283.375 2.861 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000841889850 618580724 /nfs/dbraw/zinc/58/07/24/618580724.db2.gz DRAJTWXTTVPLHE-OAHLLOKOSA-N 0 3 273.307 2.892 20 10 CFCDHN Oc1ccc(F)cc1CN[C@@H]1COCc2ccccc21 ZINC000841889850 618580726 /nfs/dbraw/zinc/58/07/26/618580726.db2.gz DRAJTWXTTVPLHE-OAHLLOKOSA-N 0 3 273.307 2.892 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000895437476 618585653 /nfs/dbraw/zinc/58/56/53/618585653.db2.gz LYYMWDDXSWGHLE-HUUCEWRRSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000895437476 618585656 /nfs/dbraw/zinc/58/56/56/618585656.db2.gz LYYMWDDXSWGHLE-HUUCEWRRSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](CO)C2)c([O-])c1 ZINC000311717315 618720635 /nfs/dbraw/zinc/72/06/35/618720635.db2.gz TYIQQNLIBBLNOP-IHRRRGAJSA-N 0 3 263.381 2.902 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000311806224 618724029 /nfs/dbraw/zinc/72/40/29/618724029.db2.gz CCDYLGZCUWRRQT-OCCSQVGLSA-N 0 3 262.397 2.699 20 10 CFCDHN COc1cccc(CNCc2ccc(C)c(C)n2)c1O ZINC000313860790 619020397 /nfs/dbraw/zinc/02/03/97/619020397.db2.gz WCLVYIBPSPPVID-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN COc1cc(C)cc(CN[C@H]2CCCc3c[nH]nc32)c1O ZINC000894351960 619345792 /nfs/dbraw/zinc/34/57/92/619345792.db2.gz MYXKHGOOAJUUDB-ZDUSSCGKSA-N 0 3 287.363 2.600 20 10 CFCDHN COc1cc(C)cc(CN(C)Cc2ccncc2)c1O ZINC000894448073 619388641 /nfs/dbraw/zinc/38/86/41/619388641.db2.gz ANFZHZOFRRAADZ-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN COc1cccc(CNCc2cnc(F)cc2C)c1O ZINC000894458075 619389939 /nfs/dbraw/zinc/38/99/39/619389939.db2.gz MRYFLOSAKOGLFB-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN CCn1cc(CN[C@@H](C)c2cc(OC)ccc2O)c(C)n1 ZINC000894501653 619405232 /nfs/dbraw/zinc/40/52/32/619405232.db2.gz FGTJNOKHMKNLFD-LBPRGKRZSA-N 0 3 289.379 2.776 20 10 CFCDHN COc1cccc(CN[C@@H]2CCc3cccnc32)c1O ZINC000894763829 619462311 /nfs/dbraw/zinc/46/23/11/619462311.db2.gz BJNZSHJFIONMMC-CYBMUJFWSA-N 0 3 270.332 2.573 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CC(CC2CCOCC2)C1 ZINC000895615054 619567790 /nfs/dbraw/zinc/56/77/90/619567790.db2.gz GONUHSNKDDJTDA-UHFFFAOYSA-N 0 3 275.392 2.949 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@H](OC)CC[C@H]2C)c([O-])c1 ZINC000895947003 619639258 /nfs/dbraw/zinc/63/92/58/619639258.db2.gz ZWDDRORHNMOYRF-IUODEOHRSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@H](OC)CC[C@H]2C)c([O-])c1 ZINC000895947003 619639259 /nfs/dbraw/zinc/63/92/59/619639259.db2.gz ZWDDRORHNMOYRF-IUODEOHRSA-N 0 3 279.380 2.790 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC000896281271 619709129 /nfs/dbraw/zinc/70/91/29/619709129.db2.gz VKYLFZURVKOXTC-ZWNOBZJWSA-N 0 3 289.297 2.900 20 10 CFCDHN Cn1ccc([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000896493292 619748198 /nfs/dbraw/zinc/74/81/98/619748198.db2.gz NOWSPXXAQIICLH-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN Cn1ccc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000896493292 619748200 /nfs/dbraw/zinc/74/82/00/619748200.db2.gz NOWSPXXAQIICLH-LBPRGKRZSA-N 0 3 289.354 2.644 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](CO)CCc1ccccc1 ZINC000896518085 619755157 /nfs/dbraw/zinc/75/51/57/619755157.db2.gz LVXODTYXALJZNK-INIZCTEOSA-N 0 3 285.387 2.784 20 10 CFCDHN C[C@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)CCO1 ZINC000896577439 619765457 /nfs/dbraw/zinc/76/54/57/619765457.db2.gz LHGJEZMNQUJCKP-RGDDUWESSA-N 0 3 274.408 2.877 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C2CC2)[C@H]2CCCOC2)c([O-])c1 ZINC000897082586 619926583 /nfs/dbraw/zinc/92/65/83/619926583.db2.gz VJEILFZSDZMNNZ-RDJZCZTQSA-N 0 3 275.392 2.995 20 10 CFCDHN CCc1onc(C)c1CNCc1c(C)cccc1O ZINC000897336745 619999804 /nfs/dbraw/zinc/99/98/04/619999804.db2.gz NTMDZDLKPOXROM-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccccc1[O-] ZINC000897815329 620283152 /nfs/dbraw/zinc/28/31/52/620283152.db2.gz VDNXMMXFFFMAAS-XDJSOMLNSA-N 0 3 259.349 2.609 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CCO)C2CCCC2)c([O-])c1 ZINC000897884985 620297668 /nfs/dbraw/zinc/29/76/68/620297668.db2.gz BNRIAYWDHREYDF-MRXNPFEDSA-N 0 3 293.407 2.822 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1[O-] ZINC000898165590 620341533 /nfs/dbraw/zinc/34/15/33/620341533.db2.gz CNHFWMYOORLUSO-KGLIPLIRSA-N 0 3 291.391 2.992 20 10 CFCDHN Cc1ccc(C[NH2+]Cc2ccc(CCO)cc2)c([O-])c1 ZINC000898168405 620342417 /nfs/dbraw/zinc/34/24/17/620342417.db2.gz DHOWWBYKDWLZJY-UHFFFAOYSA-N 0 3 271.360 2.525 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](CN)C2CCCCC2)c([O-])c1 ZINC000841039581 620381053 /nfs/dbraw/zinc/38/10/53/620381053.db2.gz VISKTRWMQQHOCS-INIZCTEOSA-N 0 3 292.423 2.788 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C=C[C@H]3C[C@@H]2CO3)c([O-])c1 ZINC000926936725 620427857 /nfs/dbraw/zinc/42/78/57/620427857.db2.gz MGCDEOHQCLEBMT-BARDWOONSA-N 0 3 273.376 2.942 20 10 CFCDHN COc1nn(C)cc1CN[C@H](C)c1ccc(C)c(C)c1O ZINC000903339611 621334589 /nfs/dbraw/zinc/33/45/89/621334589.db2.gz ZQTBNIPFBDVWJA-GFCCVEGCSA-N 0 3 289.379 2.602 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCOC1CCSCC1)CC2 ZINC000903446816 621384888 /nfs/dbraw/zinc/38/48/88/621384888.db2.gz UZEAQRYZTHXHKM-CQSZACIVSA-N 0 3 293.432 2.881 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]([NH3+])C(C)(C)C2)c(Cl)c1 ZINC000903987184 621499070 /nfs/dbraw/zinc/49/90/70/621499070.db2.gz YCRZXZUIKLOTIW-ZDUSSCGKSA-N 0 3 268.788 2.523 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC1CCCCC1)OCO2 ZINC000042879698 621548750 /nfs/dbraw/zinc/54/87/50/621548750.db2.gz ASVAULDMXPYAJL-UHFFFAOYSA-N 0 3 263.337 2.791 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1ccccc1[O-] ZINC000183615244 625521118 /nfs/dbraw/zinc/52/11/18/625521118.db2.gz UJVGNIAUWGMMDR-ODXCJYRJSA-N 0 3 289.400 2.980 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC2(C)OCCO2)c([O-])c1 ZINC000183889658 625554600 /nfs/dbraw/zinc/55/46/00/625554600.db2.gz BUAXSTFNHJDWOZ-GFCCVEGCSA-N 0 3 265.353 2.504 20 10 CFCDHN C[C@H]([NH2+]CCCCn1ccnc1)c1ccccc1[O-] ZINC000045105515 622964792 /nfs/dbraw/zinc/96/47/92/622964792.db2.gz YVEVFZNBQKBBQX-ZDUSSCGKSA-N 0 3 259.353 2.720 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2CCC(O)CC2)c([O-])c1 ZINC000227657301 623115805 /nfs/dbraw/zinc/11/58/05/623115805.db2.gz JXIKMYFFWGMGDC-HSBZDZAISA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1=O)c1ccccc1[O-] ZINC000822817901 623181276 /nfs/dbraw/zinc/18/12/76/623181276.db2.gz BLABQQOMUBETAN-KBPBESRZSA-N 0 3 290.407 2.832 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)c1ccccc1[O-] ZINC000229556905 623211740 /nfs/dbraw/zinc/21/17/40/623211740.db2.gz BEOXBAKEHHIWOL-GUTXKFCHSA-N 0 3 263.381 2.984 20 10 CFCDHN CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1(C)C ZINC000230665890 623289577 /nfs/dbraw/zinc/28/95/77/623289577.db2.gz WPUIUIWGUOULFR-QCZZGDTMSA-N 0 3 267.344 2.995 20 10 CFCDHN CCCOc1ccc(CN[C@@H]2CCCCNC2=O)cc1C ZINC000211022009 623547872 /nfs/dbraw/zinc/54/78/72/623547872.db2.gz ZAOVTPUYHWONOW-OAHLLOKOSA-N 0 3 290.407 2.542 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](OC)[C@@H](C)C2)c1[O-] ZINC000824814514 623570246 /nfs/dbraw/zinc/57/02/46/623570246.db2.gz ATRFUUUPCLZQCK-GWCFXTLKSA-N 0 3 299.798 2.911 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](OC)[C@@H](C)C2)c1[O-] ZINC000824814514 623570250 /nfs/dbraw/zinc/57/02/50/623570250.db2.gz ATRFUUUPCLZQCK-GWCFXTLKSA-N 0 3 299.798 2.911 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC[C@@H]2CCOC2)c([O-])c1 ZINC000825134139 623637497 /nfs/dbraw/zinc/63/74/97/623637497.db2.gz VPGAEUASINPFNY-CYBMUJFWSA-N 0 3 279.380 2.697 20 10 CFCDHN CCOc1ccc(C[NH2+]CC(C)(C)C(C)(C)O)c([O-])c1 ZINC000825202327 623650348 /nfs/dbraw/zinc/65/03/48/623650348.db2.gz QZXQHLYQJWTTPK-UHFFFAOYSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H](O)C2)c1[O-] ZINC000825316775 623669910 /nfs/dbraw/zinc/66/99/10/623669910.db2.gz SXULEBUVXHHFDD-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](O)C2)c1[O-] ZINC000825316775 623669913 /nfs/dbraw/zinc/66/99/13/623669913.db2.gz SXULEBUVXHHFDD-RNCFNFMXSA-N 0 3 269.772 2.557 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)CC2=CCCOC2)c1[O-] ZINC000827189596 623962134 /nfs/dbraw/zinc/96/21/34/623962134.db2.gz KVQHPAGYKBZTFU-UHFFFAOYSA-N 0 3 297.782 2.833 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)CC2=CCCOC2)c1[O-] ZINC000827189596 623962139 /nfs/dbraw/zinc/96/21/39/623962139.db2.gz KVQHPAGYKBZTFU-UHFFFAOYSA-N 0 3 297.782 2.833 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827698926 624068740 /nfs/dbraw/zinc/06/87/40/624068740.db2.gz CXWAQPNGZCYDAT-ZUZCIYMTSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827698926 624068743 /nfs/dbraw/zinc/06/87/43/624068743.db2.gz CXWAQPNGZCYDAT-ZUZCIYMTSA-N 0 3 299.798 2.505 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834503548 625697015 /nfs/dbraw/zinc/69/70/15/625697015.db2.gz ZRARXZXSDCUUCS-HNNXBMFYSA-N 0 3 285.391 2.562 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc(CO)c(F)c1)CC2 ZINC000834531406 625702662 /nfs/dbraw/zinc/70/26/62/625702662.db2.gz YSDSAXAVVNXCAD-OAHLLOKOSA-N 0 3 287.334 2.801 20 10 CFCDHN C[C@H](NC(=O)CN(C)CC(C)(C)C)c1ccccc1O ZINC000827960063 624139651 /nfs/dbraw/zinc/13/96/51/624139651.db2.gz IHRLMEUTAGUNLO-LBPRGKRZSA-N 0 3 278.396 2.547 20 10 CFCDHN Cc1ncccc1CNCc1ccc(N2CCOCC2)cc1 ZINC000237608528 624965717 /nfs/dbraw/zinc/96/57/17/624965717.db2.gz LQSHEWAZEWVEDN-UHFFFAOYSA-N 0 3 297.402 2.516 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834602773 625735112 /nfs/dbraw/zinc/73/51/12/625735112.db2.gz UVXFNWCAKMQCSC-BZNIZROVSA-N 0 3 299.418 2.951 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H](O)C2)c([O-])c1 ZINC000185538951 625738784 /nfs/dbraw/zinc/73/87/84/625738784.db2.gz VUTAMCDKJDXSRX-IHRRRGAJSA-N 0 3 263.381 2.902 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCOCC1CCC1)CC2 ZINC000834766591 625840978 /nfs/dbraw/zinc/84/09/78/625840978.db2.gz UWSHEPORKCIQLK-AWEZNQCLSA-N 0 3 261.365 2.786 20 10 CFCDHN CCCOc1ccc(CN[C@H](C)C(OC)OC)cc1C ZINC000922314092 626267016 /nfs/dbraw/zinc/26/70/16/626267016.db2.gz IMCLWAKFGBSDCX-CYBMUJFWSA-N 0 3 281.396 2.881 20 10 CFCDHN C[C@@H](N[C@H](CCO)c1ccco1)c1ccccc1O ZINC000186561600 626334304 /nfs/dbraw/zinc/33/43/04/626334304.db2.gz PMHOAAIBPUHQEP-DGCLKSJQSA-N 0 3 261.321 2.760 20 10 CFCDHN CC[C@@H](N[C@@H](C)c1ccn(C)n1)c1ccccc1O ZINC000839192688 626531007 /nfs/dbraw/zinc/53/10/07/626531007.db2.gz VXOOEICTUYXKQS-WCQYABFASA-N 0 3 259.353 2.928 20 10 CFCDHN CCC[N@H+](CCC1(O)CCC1)Cc1ccccc1[O-] ZINC000839497819 626538213 /nfs/dbraw/zinc/53/82/13/626538213.db2.gz FKFUULBCBNXZCE-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN CCC[N@@H+](CCC1(O)CCC1)Cc1ccccc1[O-] ZINC000839497819 626538214 /nfs/dbraw/zinc/53/82/14/626538214.db2.gz FKFUULBCBNXZCE-UHFFFAOYSA-N 0 3 263.381 2.909 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2ccccc2NC1=O)c1ccccc1[O-] ZINC000839539222 626546428 /nfs/dbraw/zinc/54/64/28/626546428.db2.gz RQBNEJSTFWEHLR-BLLLJJGKSA-N 0 3 296.370 2.996 20 10 CFCDHN C[NH2+][C@H]1CCCN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000843048493 626546742 /nfs/dbraw/zinc/54/67/42/626546742.db2.gz BZSFOZKUTVJOBV-NSHDSACASA-N 0 3 268.788 2.538 20 10 CFCDHN CCCCCNC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000839564736 626546756 /nfs/dbraw/zinc/54/67/56/626546756.db2.gz XTVVXTHBFUQXIX-CQSZACIVSA-N 0 3 291.439 2.710 20 10 CFCDHN CCOc1ccc(CN(C)Cc2ccncc2)c(O)c1 ZINC000757889099 626566965 /nfs/dbraw/zinc/56/69/65/626566965.db2.gz OXGUXWGBTOVDFJ-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCc2ccncc2)c([O-])c1 ZINC000757889219 626567068 /nfs/dbraw/zinc/56/70/68/626567068.db2.gz XHPOIIIBAGUEOO-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCc2ccncc2)c([O-])c1 ZINC000757889219 626567069 /nfs/dbraw/zinc/56/70/69/626567069.db2.gz XHPOIIIBAGUEOO-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H](CO)CC(F)F)c2c1c(F)ccc2[O-] ZINC000760037110 626710977 /nfs/dbraw/zinc/71/09/77/626710977.db2.gz HKIDFKHQPBLVRB-WEDXCCLWSA-N 0 3 289.297 2.685 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@H](CO)CC(F)F)c2c1c(F)ccc2[O-] ZINC000760037105 626711082 /nfs/dbraw/zinc/71/10/82/626711082.db2.gz HKIDFKHQPBLVRB-KHQFGBGNSA-N 0 3 289.297 2.685 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(C(=O)OC)CC1)c1ccccc1[O-] ZINC000761498109 626841157 /nfs/dbraw/zinc/84/11/57/626841157.db2.gz GFCLXTPUSDQENI-AWEZNQCLSA-N 0 3 292.379 2.664 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccn1 ZINC000851791695 634531464 /nfs/dbraw/zinc/53/14/64/634531464.db2.gz FNHHJXBKHCQGEV-KRWDZBQOSA-N 0 3 286.375 2.733 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccn1 ZINC000851791695 634531468 /nfs/dbraw/zinc/53/14/68/634531468.db2.gz FNHHJXBKHCQGEV-KRWDZBQOSA-N 0 3 286.375 2.733 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](OC)[C@H]1CCOC1 ZINC000851792374 634531690 /nfs/dbraw/zinc/53/16/90/634531690.db2.gz OCCZXNSCDBQLJG-DOTOQJQBSA-N 0 3 293.407 2.656 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](OC)[C@H]1CCOC1 ZINC000851792374 634531695 /nfs/dbraw/zinc/53/16/95/634531695.db2.gz OCCZXNSCDBQLJG-DOTOQJQBSA-N 0 3 293.407 2.656 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](OC)[C@@H]1CCOC1 ZINC000851792380 634532153 /nfs/dbraw/zinc/53/21/53/634532153.db2.gz OCCZXNSCDBQLJG-WBVHZDCISA-N 0 3 293.407 2.656 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](OC)[C@@H]1CCOC1 ZINC000851792380 634532161 /nfs/dbraw/zinc/53/21/61/634532161.db2.gz OCCZXNSCDBQLJG-WBVHZDCISA-N 0 3 293.407 2.656 20 10 CFCDHN C[N@H+](CCCc1ccncc1)Cc1ccccc1[O-] ZINC000764978414 627110353 /nfs/dbraw/zinc/11/03/53/627110353.db2.gz YPXWAXHDIQAVEC-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN C[N@@H+](CCCc1ccncc1)Cc1ccccc1[O-] ZINC000764978414 627110355 /nfs/dbraw/zinc/11/03/55/627110355.db2.gz YPXWAXHDIQAVEC-UHFFFAOYSA-N 0 3 256.349 2.852 20 10 CFCDHN CC[C@@H](NCc1ccc2c(c1)CCO2)c1cnn(C)c1 ZINC000765609472 627150860 /nfs/dbraw/zinc/15/08/60/627150860.db2.gz OVIFIVSHNNUZTF-OAHLLOKOSA-N 0 3 271.364 2.596 20 10 CFCDHN CCOC(CN(CC)Cc1ccc(N(C)C)cc1)OCC ZINC000767762904 627283348 /nfs/dbraw/zinc/28/33/48/627283348.db2.gz NENGQGRBRVLPLD-UHFFFAOYSA-N 0 3 294.439 2.974 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000767925449 627295659 /nfs/dbraw/zinc/29/56/59/627295659.db2.gz DTEUKNDKKNAGKE-CYBMUJFWSA-N 0 3 291.391 2.982 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@H]2CCSC2)c([O-])c1 ZINC000768263899 627329499 /nfs/dbraw/zinc/32/94/99/627329499.db2.gz YPHXMYLAHFPPKU-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@H]2CCSC2)c([O-])c1 ZINC000768263899 627329504 /nfs/dbraw/zinc/32/95/04/627329504.db2.gz YPHXMYLAHFPPKU-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@H]1CCCCC[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768445085 627342911 /nfs/dbraw/zinc/34/29/11/627342911.db2.gz FDEUGNHNTGETGL-XHDPSFHLSA-N 0 3 277.364 2.583 20 10 CFCDHN C[C@H]1CCCCC[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768445085 627342914 /nfs/dbraw/zinc/34/29/14/627342914.db2.gz FDEUGNHNTGETGL-XHDPSFHLSA-N 0 3 277.364 2.583 20 10 CFCDHN CCC[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768463613 627345181 /nfs/dbraw/zinc/34/51/81/627345181.db2.gz KKUJATQHRAEDPS-BLLLJJGKSA-N 0 3 291.391 2.830 20 10 CFCDHN CCC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768463613 627345183 /nfs/dbraw/zinc/34/51/83/627345183.db2.gz KKUJATQHRAEDPS-BLLLJJGKSA-N 0 3 291.391 2.830 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@@H]2CCOC2)c1[O-] ZINC000768521749 627349107 /nfs/dbraw/zinc/34/91/07/627349107.db2.gz UUDDPAGWJWDJJI-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@@H]2CCOC2)c1[O-] ZINC000768521749 627349111 /nfs/dbraw/zinc/34/91/11/627349111.db2.gz UUDDPAGWJWDJJI-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000768892941 627384212 /nfs/dbraw/zinc/38/42/12/627384212.db2.gz UNRCFOQAWOHDSY-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000768892941 627384213 /nfs/dbraw/zinc/38/42/13/627384213.db2.gz UNRCFOQAWOHDSY-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(OC(C)C)CC1 ZINC000768992804 627392826 /nfs/dbraw/zinc/39/28/26/627392826.db2.gz OBLFMGOSTHHQGU-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+](CC)C[C@@H]2CCCO2)c([O-])c1 ZINC000769029563 627397172 /nfs/dbraw/zinc/39/71/72/627397172.db2.gz KXJSTURKXCUYPQ-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC)C[C@@H]2CCCO2)c([O-])c1 ZINC000769029563 627397173 /nfs/dbraw/zinc/39/71/73/627397173.db2.gz KXJSTURKXCUYPQ-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@H]2CCCOC2)c([O-])c1 ZINC000769339504 627426792 /nfs/dbraw/zinc/42/67/92/627426792.db2.gz QQDJDAPZGZWWQP-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@H]2CCCOC2)c([O-])c1 ZINC000769339504 627426795 /nfs/dbraw/zinc/42/67/95/627426795.db2.gz QQDJDAPZGZWWQP-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CN(C)c1ccc(CN2CCN(C3CCC3)CC2)cc1F ZINC000769412645 627435996 /nfs/dbraw/zinc/43/59/96/627435996.db2.gz OMHXPMXJRBMZPR-UHFFFAOYSA-N 0 3 291.414 2.562 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCSC[C@H]2C)c([O-])c1 ZINC000769429360 627437707 /nfs/dbraw/zinc/43/77/07/627437707.db2.gz YUBVXFCCPYMZQN-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCSC[C@H]2C)c([O-])c1 ZINC000769429360 627437709 /nfs/dbraw/zinc/43/77/09/627437709.db2.gz YUBVXFCCPYMZQN-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(C(F)F)CC1 ZINC000769445215 627439264 /nfs/dbraw/zinc/43/92/64/627439264.db2.gz DGXLQHZLQCPULS-UHFFFAOYSA-N 0 3 271.307 2.878 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](CO)c2ccsc2)c1 ZINC000769990600 627494709 /nfs/dbraw/zinc/49/47/09/627494709.db2.gz VBTXVEQRPUEECJ-HZMBPMFUSA-N 0 3 293.388 2.847 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000769996218 627495194 /nfs/dbraw/zinc/49/51/94/627495194.db2.gz UGFJAYRBERVNFO-MHMHOCFQSA-N 0 3 279.355 2.996 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]3COCC[C@H]32)c([O-])c1 ZINC000770285893 627511648 /nfs/dbraw/zinc/51/16/48/627511648.db2.gz LHIIRKAIWIHXNS-GOEBONIOSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c([O-])c1 ZINC000770285893 627511651 /nfs/dbraw/zinc/51/16/51/627511651.db2.gz LHIIRKAIWIHXNS-GOEBONIOSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(N[C@@H](C)c2ccc(N(C)C)cc2)nc(N)n1 ZINC000772298851 627699322 /nfs/dbraw/zinc/69/93/22/627699322.db2.gz SSINKRASDZOOFE-NSHDSACASA-N 0 3 271.368 2.606 20 10 CFCDHN CC(C)[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N(C)C ZINC000773018930 627769583 /nfs/dbraw/zinc/76/95/83/627769583.db2.gz JKESNTARTHJBIP-CZUORRHYSA-N 0 3 291.439 2.516 20 10 CFCDHN CCN(C)c1ccc(CN2CCN(C(C)C)CC2)cc1 ZINC000773734351 627853037 /nfs/dbraw/zinc/85/30/37/627853037.db2.gz QZOJZEZHIIUHDP-UHFFFAOYSA-N 0 3 275.440 2.669 20 10 CFCDHN C=Cn1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000775015708 627984939 /nfs/dbraw/zinc/98/49/39/627984939.db2.gz ZZPVYOXJBOVYPX-ZDUSSCGKSA-N 0 3 270.380 2.900 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)c1ccco1)c1ccccc1[O-] ZINC000775416270 628023986 /nfs/dbraw/zinc/02/39/86/628023986.db2.gz UEVKBIZNHUBOEC-GXTWGEPZSA-N 0 3 261.321 2.760 20 10 CFCDHN CC[C@H]([NH2+]CCc1nc(C)n[nH]1)c1cc(Cl)ccc1[O-] ZINC000775548420 628035836 /nfs/dbraw/zinc/03/58/36/628035836.db2.gz ZLXOJODXEFUXQN-LBPRGKRZSA-N 0 3 294.786 2.756 20 10 CFCDHN Cc1cc(Cl)cc(C[NH+]2CCC(CCO)CC2)c1[O-] ZINC000775647964 628049290 /nfs/dbraw/zinc/04/92/90/628049290.db2.gz JWKCIUHUOIZIKF-UHFFFAOYSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1ccnc(N2CCN(Cc3cccc(C)c3O)CC2)c1 ZINC000775658195 628051278 /nfs/dbraw/zinc/05/12/78/628051278.db2.gz GQHGVKDHDCBUCA-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CC(C)[C@H](C)NC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775833572 628074201 /nfs/dbraw/zinc/07/42/01/628074201.db2.gz DWJMSWYTZRVAOM-UONOGXRCSA-N 0 3 291.439 2.564 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000776018911 628093721 /nfs/dbraw/zinc/09/37/21/628093721.db2.gz HYLZYKMFTSCLNA-CHWSQXEVSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000776018911 628093724 /nfs/dbraw/zinc/09/37/24/628093724.db2.gz HYLZYKMFTSCLNA-CHWSQXEVSA-N 0 3 298.789 2.901 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@]2(C)CCOC2)c1[O-] ZINC000776175536 628112274 /nfs/dbraw/zinc/11/22/74/628112274.db2.gz SOELNNJYECXOLU-AWEZNQCLSA-N 0 3 269.772 2.870 20 10 CFCDHN CO[C@@H](CN[C@H](C)c1ccc(N(C)C)cc1)C(F)(F)F ZINC000777009011 628191312 /nfs/dbraw/zinc/19/13/12/628191312.db2.gz HMKLMHFTHBCAIP-MFKMUULPSA-N 0 3 290.329 2.981 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@H](C(C)C)C2)c1 ZINC000777969556 628269245 /nfs/dbraw/zinc/26/92/45/628269245.db2.gz SEXHWPJCUMJPEO-HNNXBMFYSA-N 0 3 263.381 2.866 20 10 CFCDHN CC[N@H+](CCc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000779000001 628343823 /nfs/dbraw/zinc/34/38/23/628343823.db2.gz RKRFDTSQTAPTCT-UHFFFAOYSA-N 0 3 274.339 2.991 20 10 CFCDHN CC[N@@H+](CCc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000779000001 628343825 /nfs/dbraw/zinc/34/38/25/628343825.db2.gz RKRFDTSQTAPTCT-UHFFFAOYSA-N 0 3 274.339 2.991 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000779004527 628344990 /nfs/dbraw/zinc/34/49/90/628344990.db2.gz WEFKPIOHGKBJDX-UHFFFAOYSA-N 0 3 287.334 2.838 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000779004527 628345005 /nfs/dbraw/zinc/34/50/05/628345005.db2.gz WEFKPIOHGKBJDX-UHFFFAOYSA-N 0 3 287.334 2.838 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](O)C2(C)C)c2c1c(F)ccc2[O-] ZINC000779066471 628349630 /nfs/dbraw/zinc/34/96/30/628349630.db2.gz XSKMYYAPJQSFDV-UKWYHXRUSA-N 0 3 279.355 2.829 20 10 CFCDHN CC(C)(C)OC(=O)CCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000779087115 628351154 /nfs/dbraw/zinc/35/11/54/628351154.db2.gz MIEREKWXDLUKKW-UHFFFAOYSA-N 0 3 283.343 2.743 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000779154584 628357204 /nfs/dbraw/zinc/35/72/04/628357204.db2.gz WBTBZPOVTLBXTQ-CJNGLKHVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000779154584 628357208 /nfs/dbraw/zinc/35/72/08/628357208.db2.gz WBTBZPOVTLBXTQ-CJNGLKHVSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000783504577 628713868 /nfs/dbraw/zinc/71/38/68/628713868.db2.gz PCGYGNJSDJVXDM-GDBMZVCRSA-N 0 3 285.387 2.894 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000783510722 628714319 /nfs/dbraw/zinc/71/43/19/628714319.db2.gz SHZFKDJVKQTBJT-TZMCWYRMSA-N 0 3 260.381 2.527 20 10 CFCDHN Cc1cnccc1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783519381 628715983 /nfs/dbraw/zinc/71/59/83/628715983.db2.gz SNGFTKJBSPPXPZ-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)N1CCCC1 ZINC000783524155 628716897 /nfs/dbraw/zinc/71/68/97/628716897.db2.gz XXAQAHNHAWNTHY-BBRMVZONSA-N 0 3 290.407 2.690 20 10 CFCDHN CCOc1ccc(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000784686722 628836887 /nfs/dbraw/zinc/83/68/87/628836887.db2.gz NNSAYDKXBKXZIO-IAGOWNOFSA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2[C@H](C)O)c([O-])c1 ZINC000785989097 628928742 /nfs/dbraw/zinc/92/87/42/628928742.db2.gz QVTQLYYPYNJKIU-HEHGZKQESA-N 0 3 293.407 2.772 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2[C@H](C)O)c([O-])c1 ZINC000785989097 628928743 /nfs/dbraw/zinc/92/87/43/628928743.db2.gz QVTQLYYPYNJKIU-HEHGZKQESA-N 0 3 293.407 2.772 20 10 CFCDHN COCC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCOC1 ZINC000787335426 629007993 /nfs/dbraw/zinc/00/79/93/629007993.db2.gz PXULNZLUSKOHGQ-AWEZNQCLSA-N 0 3 299.798 2.591 20 10 CFCDHN COCC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCOC1 ZINC000787335426 629007996 /nfs/dbraw/zinc/00/79/96/629007996.db2.gz PXULNZLUSKOHGQ-AWEZNQCLSA-N 0 3 299.798 2.591 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000790934137 629272454 /nfs/dbraw/zinc/27/24/54/629272454.db2.gz FZAFHDBCYZGUKN-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c([O-])c1 ZINC000790934137 629272457 /nfs/dbraw/zinc/27/24/57/629272457.db2.gz FZAFHDBCYZGUKN-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000790949834 629273745 /nfs/dbraw/zinc/27/37/45/629273745.db2.gz PMSWXSSICMODCV-CHWSQXEVSA-N 0 3 298.789 2.901 20 10 CFCDHN CO[C@@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835026182 629324679 /nfs/dbraw/zinc/32/46/79/629324679.db2.gz RQNFZXPDQZZIOD-UKINESCASA-N 0 3 274.408 2.877 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CCC(C)(O)CC2)cc1 ZINC000835029766 629325860 /nfs/dbraw/zinc/32/58/60/629325860.db2.gz RXHINVUJGJGWGL-PLNGDYQASA-N 0 3 274.408 2.613 20 10 CFCDHN Cc1n[nH]cc1CNC/C=C\c1ccc(N(C)C)cc1 ZINC000835039133 629333078 /nfs/dbraw/zinc/33/30/78/629333078.db2.gz BFZYWOGKRMDUPU-PLNGDYQASA-N 0 3 270.380 2.587 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CC[C@H](O)C(C)(C)C2)cc1 ZINC000835046120 629343170 /nfs/dbraw/zinc/34/31/70/629343170.db2.gz STVWTBHUSALPSK-RTRPANQVSA-N 0 3 288.435 2.859 20 10 CFCDHN CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cc(F)ccc1[O-] ZINC000835077614 629374440 /nfs/dbraw/zinc/37/44/40/629374440.db2.gz UWEOVJKOZFVGHD-UHFFFAOYSA-N 0 3 291.370 2.923 20 10 CFCDHN CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cc(F)ccc1[O-] ZINC000835077614 629374446 /nfs/dbraw/zinc/37/44/46/629374446.db2.gz UWEOVJKOZFVGHD-UHFFFAOYSA-N 0 3 291.370 2.923 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@](C)(OC)CC1 ZINC000793342361 629528936 /nfs/dbraw/zinc/52/89/36/629528936.db2.gz ZMCKBAJLPIRWSF-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@](C)(OC)CC1 ZINC000793342361 629528938 /nfs/dbraw/zinc/52/89/38/629528938.db2.gz ZMCKBAJLPIRWSF-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCc1ccc(CNCc2ccc(OC)cc2O)o1 ZINC000793386420 629535900 /nfs/dbraw/zinc/53/59/00/629535900.db2.gz PQRCLHBNYFXAGZ-UHFFFAOYSA-N 0 3 261.321 2.846 20 10 CFCDHN CC[C@H]1C[C@H](C[NH2+]Cc2ccc(OC)cc2[O-])CCO1 ZINC000793388100 629535984 /nfs/dbraw/zinc/53/59/84/629535984.db2.gz LVKOMCDEWDIAHD-OCCSQVGLSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c([O-])c1 ZINC000793575129 629574064 /nfs/dbraw/zinc/57/40/64/629574064.db2.gz UGUIGELUEFBSBD-HEHGZKQESA-N 0 3 295.423 2.509 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000793607962 629578487 /nfs/dbraw/zinc/57/84/87/629578487.db2.gz GNUNPJFBQXEYFO-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c([O-])c1 ZINC000793607962 629578491 /nfs/dbraw/zinc/57/84/91/629578491.db2.gz GNUNPJFBQXEYFO-RDJZCZTQSA-N 0 3 291.391 2.934 20 10 CFCDHN CC[C@@H]([NH2+]CCC1(C)OCCO1)c1ccc(C)cc1[O-] ZINC000794811973 629689617 /nfs/dbraw/zinc/68/96/17/629689617.db2.gz AWDLTRGTKGXXQN-CQSZACIVSA-N 0 3 279.380 2.894 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cnccn1)c1ccc(C)cc1[O-] ZINC000794814310 629689705 /nfs/dbraw/zinc/68/97/05/629689705.db2.gz CUFAWRXMPNRNET-OAHLLOKOSA-N 0 3 271.364 2.774 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)CC1CC1)c1ccc(C)cc1[O-] ZINC000794818637 629690227 /nfs/dbraw/zinc/69/02/27/629690227.db2.gz UKKUPOQCEPOOES-DZGCQCFKSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCC[C@H]1C(=O)NC)c1ccc(C)cc1[O-] ZINC000794817846 629690544 /nfs/dbraw/zinc/69/05/44/629690544.db2.gz PKEBDQSMHUVLGT-QLFBSQMISA-N 0 3 290.407 2.656 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCC3(CCC3)CC1)[C@@H](O)CO2 ZINC000795713679 629826308 /nfs/dbraw/zinc/82/63/08/629826308.db2.gz JXTRWLKQGCXWCQ-HNNXBMFYSA-N 0 3 289.375 2.584 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCc1cccc(C)n1 ZINC000796448878 629918868 /nfs/dbraw/zinc/91/88/68/629918868.db2.gz OAKMDQRPCBPWHU-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN CCOc1cccc(CNCc2cnn3ccccc23)c1O ZINC000796480180 629924229 /nfs/dbraw/zinc/92/42/29/629924229.db2.gz KSMUNPKAFPOGHK-UHFFFAOYSA-N 0 3 297.358 2.728 20 10 CFCDHN c1[nH]nc2c1[C@@H](NCc1ccc3c(c1)CCO3)CCC2 ZINC000796740177 629958037 /nfs/dbraw/zinc/95/80/37/629958037.db2.gz WORQSYHUAQFOFI-AWEZNQCLSA-N 0 3 269.348 2.512 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000797468999 630070819 /nfs/dbraw/zinc/07/08/19/630070819.db2.gz UCYADWVDZQEFRY-SNVBAGLBSA-N 0 3 271.307 2.926 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](CCO)Cc1ccccc1 ZINC000799740427 630341906 /nfs/dbraw/zinc/34/19/06/630341906.db2.gz ZYCVWCQFPPXCEU-INIZCTEOSA-N 0 3 289.350 2.615 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](CCO)Cc1ccccc1 ZINC000799740428 630342074 /nfs/dbraw/zinc/34/20/74/630342074.db2.gz ZYCVWCQFPPXCEU-MRXNPFEDSA-N 0 3 289.350 2.615 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)COC(C)C ZINC000801597405 630462078 /nfs/dbraw/zinc/46/20/78/630462078.db2.gz GZQAPQALCYGFLL-INIZCTEOSA-N 0 3 295.423 2.780 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)COC(C)C ZINC000801597405 630462080 /nfs/dbraw/zinc/46/20/80/630462080.db2.gz GZQAPQALCYGFLL-INIZCTEOSA-N 0 3 295.423 2.780 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H](OC(F)F)C2)cc1 ZINC000801986750 630497479 /nfs/dbraw/zinc/49/74/79/630497479.db2.gz UCTJVIWWMXSWRU-ZDUSSCGKSA-N 0 3 270.323 2.566 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000808431804 630990812 /nfs/dbraw/zinc/99/08/12/630990812.db2.gz ZJWJADYSPYGOCQ-CQSZACIVSA-N 0 3 291.778 2.911 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCNC(=O)C(C)C)c1[O-] ZINC000808672919 631026925 /nfs/dbraw/zinc/02/69/25/631026925.db2.gz UVXBPMXNWLCQAC-NSHDSACASA-N 0 3 298.814 2.777 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2(O)CCC2)c1[O-] ZINC000808694680 631030138 /nfs/dbraw/zinc/03/01/38/631030138.db2.gz GBFKGZVKNLJZQA-SNVBAGLBSA-N 0 3 269.772 2.920 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCC(=O)N(C)C2)c1[O-] ZINC000808697282 631030525 /nfs/dbraw/zinc/03/05/25/631030525.db2.gz BGADVGVXHDRZSH-JQWIXIFHSA-N 0 3 296.798 2.625 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCN2CCC2)c1[O-] ZINC000808708122 631032142 /nfs/dbraw/zinc/03/21/42/631032142.db2.gz HGCULEGDCVSPTJ-NSHDSACASA-N 0 3 268.788 2.710 20 10 CFCDHN CNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808710434 631032552 /nfs/dbraw/zinc/03/25/52/631032552.db2.gz QJANIBKOTQPZOD-JTQLQIEISA-N 0 3 298.814 2.777 20 10 CFCDHN CC[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000840820656 631231675 /nfs/dbraw/zinc/23/16/75/631231675.db2.gz IMKZKNPEBOSJFV-BHYNMZESSA-N 0 3 253.317 2.749 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccccc1[O-])[C@@H](O)C(C)C ZINC000840882081 631249784 /nfs/dbraw/zinc/24/97/84/631249784.db2.gz MAWOQRAKMOBAIC-WHOFXGATSA-N 0 3 251.370 2.838 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)C(=O)NC(C)C)c1[O-] ZINC000840890895 631253246 /nfs/dbraw/zinc/25/32/46/631253246.db2.gz PHQHDAKYSJTBEH-MNOVXSKESA-N 0 3 298.814 2.918 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@@H](O)C(F)(F)F)c1[O-] ZINC000809743578 631276445 /nfs/dbraw/zinc/27/64/45/631276445.db2.gz WABZKVKMYHIBOT-SNVBAGLBSA-N 0 3 297.704 2.757 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]Cc1cc(C)cc(N)c1 ZINC000841071298 631329460 /nfs/dbraw/zinc/32/94/60/631329460.db2.gz NFXVHXIXEJDERV-UHFFFAOYSA-N 0 3 272.348 2.581 20 10 CFCDHN CC1(C)C[NH2+]CC[C@H]1NCc1c([O-])ccc(Cl)c1F ZINC000841071745 631330717 /nfs/dbraw/zinc/33/07/17/631330717.db2.gz AHCQZQJCEKKBRG-GFCCVEGCSA-N 0 3 286.778 2.662 20 10 CFCDHN C[C@@H]([NH3+])[C@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000841081536 631332755 /nfs/dbraw/zinc/33/27/55/631332755.db2.gz SNINWCPHIWLBHC-RQJHMYQMSA-N 0 3 263.168 2.524 20 10 CFCDHN C[C@H]([NH3+])[C@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000841081448 631332996 /nfs/dbraw/zinc/33/29/96/631332996.db2.gz SNINWCPHIWLBHC-BQBZGAKWSA-N 0 3 263.168 2.524 20 10 CFCDHN NC[C@H]([NH2+]Cc1cc(Cl)ccc1[O-])C1CCCC1 ZINC000841085693 631334331 /nfs/dbraw/zinc/33/43/31/631334331.db2.gz ATPLJLFRFKOJDI-ZDUSSCGKSA-N 0 3 268.788 2.653 20 10 CFCDHN NC[C@@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)C1CCCC1 ZINC000841087177 631334947 /nfs/dbraw/zinc/33/49/47/631334947.db2.gz OVXVTJMAJTZLLA-GFCCVEGCSA-N 0 3 286.778 2.792 20 10 CFCDHN [NH3+]C[C@@H](NCc1c([O-])ccc(Cl)c1F)C1CCCC1 ZINC000841087177 631334952 /nfs/dbraw/zinc/33/49/52/631334952.db2.gz OVXVTJMAJTZLLA-GFCCVEGCSA-N 0 3 286.778 2.792 20 10 CFCDHN C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1C[NH3+] ZINC000841099361 631339634 /nfs/dbraw/zinc/33/96/34/631339634.db2.gz IVFRGUSYLBFPLD-NXEZZACHSA-N 0 3 286.778 2.601 20 10 CFCDHN COCC[C@H](COC)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000810257748 631350949 /nfs/dbraw/zinc/35/09/49/631350949.db2.gz VLBQLPYTXBPJIZ-DMDPSCGWSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC2(N(C)C)CC2)c2c1c(F)ccc2[O-] ZINC000841764319 631468890 /nfs/dbraw/zinc/46/88/90/631468890.db2.gz WDHXZZRVVICIJU-JQWIXIFHSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)C1(O)CCOCC1)c1ccccc1[O-] ZINC000841763029 631469329 /nfs/dbraw/zinc/46/93/29/631469329.db2.gz TWLJFOWKAOFSLY-ZDUSSCGKSA-N 0 3 293.407 2.611 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2COCc3ccccc32)c1 ZINC000841891793 631489160 /nfs/dbraw/zinc/48/91/60/631489160.db2.gz VDUWRVIZZLJYBD-MRXNPFEDSA-N 0 3 285.343 2.762 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@](C)(CO)C(C)C)c1[O-] ZINC000811516625 631575628 /nfs/dbraw/zinc/57/56/28/631575628.db2.gz YNDORDGDTUWWDU-CQSZACIVSA-N 0 3 271.788 2.851 20 10 CFCDHN CCO[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000155436400 650021408 /nfs/dbraw/zinc/02/14/08/650021408.db2.gz KIRRKTDPLPGKIH-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN COc1cc(C)cc(CN2C[C@H](C)OC3(CCC3)C2)c1O ZINC000842641677 631690193 /nfs/dbraw/zinc/69/01/93/631690193.db2.gz DPLREWFVKUEFKV-ZDUSSCGKSA-N 0 3 291.391 2.853 20 10 CFCDHN C[C@H]([NH2+]Cc1c2c(nn1C)CCCC2)c1ccccc1[O-] ZINC000812736432 631765886 /nfs/dbraw/zinc/76/58/86/631765886.db2.gz GCYLXECDUGXNFF-LBPRGKRZSA-N 0 3 285.391 2.855 20 10 CFCDHN [NH3+][C@@H]1CCC[C@@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@@H]21 ZINC000843059416 631822057 /nfs/dbraw/zinc/82/20/57/631822057.db2.gz LIYUYUOQJDUTRH-LJWDBELGSA-N 0 3 298.789 2.744 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@H]1CC[NH2+]C12CCCC2 ZINC000843129079 631849391 /nfs/dbraw/zinc/84/93/91/631849391.db2.gz QPIFKIYHAWTAMQ-AWEZNQCLSA-N 0 3 280.799 2.810 20 10 CFCDHN CC(=O)c1cc(Cl)cc(C[NH2+][C@@](C)(CN)C(C)C)c1[O-] ZINC000843355720 631936050 /nfs/dbraw/zinc/93/60/50/631936050.db2.gz IJLSLGXKBJMERW-HNNXBMFYSA-N 0 3 298.814 2.711 20 10 CFCDHN CC(=O)c1cc(F)cc(CN(C)CC[C@@H]([NH3+])C(C)C)c1[O-] ZINC000843354523 631936220 /nfs/dbraw/zinc/93/62/20/631936220.db2.gz KJDRKCXGGXATNK-OAHLLOKOSA-N 0 3 296.386 2.539 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CO[C@@H](C)C2)c1[O-] ZINC000843433447 631958428 /nfs/dbraw/zinc/95/84/28/631958428.db2.gz ZYHCCUWXGAPSJP-JOYOIKCWSA-N 0 3 255.745 2.621 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1[O-])CN(C)C ZINC000813877317 631971278 /nfs/dbraw/zinc/97/12/78/631971278.db2.gz RPVITWCJTXQAFZ-QWRGUYRKSA-N 0 3 270.804 2.894 20 10 CFCDHN Cc1cc(CN2CCN(C3CCC3)CC2)ccc1N(C)C ZINC000815047817 632190927 /nfs/dbraw/zinc/19/09/27/632190927.db2.gz JSERZONVMAENFR-UHFFFAOYSA-N 0 3 287.451 2.731 20 10 CFCDHN Cc1cc(CNC(C)(C)c2cnn(C)c2)ccc1N(C)C ZINC000815090755 632199459 /nfs/dbraw/zinc/19/94/59/632199459.db2.gz MLHOEAXTMNWKRA-UHFFFAOYSA-N 0 3 286.423 2.819 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccccc1[O-] ZINC000815642521 632303564 /nfs/dbraw/zinc/30/35/64/632303564.db2.gz FBZJNNDMAXRGPZ-WDEREUQCSA-N 0 3 258.321 2.905 20 10 CFCDHN CCC[C@@H](C)[C@H](CO)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000846015208 632614647 /nfs/dbraw/zinc/61/46/47/632614647.db2.gz CEYHCLMUDXYWMN-DOMZBBRYSA-N 0 3 281.396 2.678 20 10 CFCDHN CN1CCC[C@H]1C[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000817417128 632627670 /nfs/dbraw/zinc/62/76/70/632627670.db2.gz DQTVFPJPCILFIK-NSHDSACASA-N 0 3 286.778 2.711 20 10 CFCDHN CN1CCC[C@H]1C[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000817417128 632627673 /nfs/dbraw/zinc/62/76/73/632627673.db2.gz DQTVFPJPCILFIK-NSHDSACASA-N 0 3 286.778 2.711 20 10 CFCDHN COc1cccc([C@H](C)N[C@H](CO)c2ccsc2)c1O ZINC000846164333 632650997 /nfs/dbraw/zinc/65/09/97/632650997.db2.gz NZTGEKDFVZFXJW-GXFFZTMASA-N 0 3 293.388 2.847 20 10 CFCDHN COc1cccc([C@H](C)NC[C@H](OC)C(F)(F)F)c1O ZINC000846163741 632651167 /nfs/dbraw/zinc/65/11/67/632651167.db2.gz QQEFBTJBBVITER-KWQFWETISA-N 0 3 293.285 2.629 20 10 CFCDHN CCN1C[C@H](C[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])CC1=O ZINC000846209688 632660568 /nfs/dbraw/zinc/66/05/68/632660568.db2.gz SDDRPDIRKNEILJ-KGLIPLIRSA-N 0 3 290.407 2.528 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](CO)CCF)c1[O-] ZINC000846209378 632661069 /nfs/dbraw/zinc/66/10/69/632661069.db2.gz QQPZEWZZGHISEY-ONGXEEELSA-N 0 3 275.751 2.725 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCc2cccnc2CC1 ZINC000817574847 632667762 /nfs/dbraw/zinc/66/77/62/632667762.db2.gz SEXLSKUJXGLDLN-HNNXBMFYSA-N 0 3 268.360 2.824 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H]2CC[C@H](C(N)=O)CC2)c1 ZINC000817585229 632671438 /nfs/dbraw/zinc/67/14/38/632671438.db2.gz CUUHTRLJSDDXRI-MGPQQGTHSA-N 0 3 290.407 2.643 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000817588869 632672459 /nfs/dbraw/zinc/67/24/59/632672459.db2.gz RZMYVGSKPUYIHE-ZIAGYGMSSA-N 0 3 293.407 2.935 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CCCCC1)c1ccc(F)cc1[O-] ZINC000817938139 632742810 /nfs/dbraw/zinc/74/28/10/632742810.db2.gz FFTXSWAONIRXIL-LLVKDONJSA-N 0 3 266.360 2.844 20 10 CFCDHN C[C@@H](N[C@H]1CC[NH2+]C1)c1ccc2ccccc2c1[O-] ZINC000817944549 632747806 /nfs/dbraw/zinc/74/78/06/632747806.db2.gz GSKKCWFXNYMFLN-YPMHNXCESA-N 0 3 256.349 2.558 20 10 CFCDHN C[C@@H]([NH2+]CCNC1CC1)c1ccc2ccccc2c1[O-] ZINC000817953753 632753497 /nfs/dbraw/zinc/75/34/97/632753497.db2.gz QLULGKULEBPYBC-GFCCVEGCSA-N 0 3 270.376 2.948 20 10 CFCDHN C[C@H]([NH2+]C[C@H](N)C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817964518 632762796 /nfs/dbraw/zinc/76/27/96/632762796.db2.gz BEZNKIKNCCFMCY-UFBFGSQYSA-N 0 3 288.313 2.799 20 10 CFCDHN CC[C@H]([NH2+]CC1(N)CCC1)c1cc(Cl)ccc1[O-] ZINC000817964647 632762891 /nfs/dbraw/zinc/76/28/91/632762891.db2.gz HAXFOJMIPUMXCE-LBPRGKRZSA-N 0 3 268.788 2.968 20 10 CFCDHN CO[C@H]1C[C@H]2C[C@@H]([NH2+]Cc3ccccc3[O-])C[C@H]2C1 ZINC000818330894 632830626 /nfs/dbraw/zinc/83/06/26/632830626.db2.gz SMVRCQIGPJUGAP-NMWPEEMBSA-N 0 3 261.365 2.685 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)Cc2ccccn2)c([O-])c1 ZINC000848566873 633291306 /nfs/dbraw/zinc/29/13/06/633291306.db2.gz LFUIOGIFLDPBHV-ZDUSSCGKSA-N 0 3 286.375 2.907 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1C[C@H](OC(C)(C)C)C1 ZINC000848567179 633291422 /nfs/dbraw/zinc/29/14/22/633291422.db2.gz QDVZMJSCOZYBDM-HAQNSBGRSA-N 0 3 279.380 2.837 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000848576360 633294338 /nfs/dbraw/zinc/29/43/38/633294338.db2.gz NVEOBIIYEKXDPF-CYBMUJFWSA-N 0 3 291.391 2.982 20 10 CFCDHN CCc1cccc(CN2C[C@H](C)O[C@@H](C3CC3)C2)c1O ZINC000848907692 633393900 /nfs/dbraw/zinc/39/39/00/633393900.db2.gz HDMNDDFZBZIXRG-BLLLJJGKSA-N 0 3 275.392 2.954 20 10 CFCDHN CCc1cccc(C[NH2+][C@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000848913079 633397462 /nfs/dbraw/zinc/39/74/62/633397462.db2.gz NTXHPKSTVNBDPO-MRXNPFEDSA-N 0 3 277.408 2.841 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1ccccc1[O-])C(C)C ZINC000848927880 633411019 /nfs/dbraw/zinc/41/10/19/633411019.db2.gz PTPLBHWAUGQZID-UHFFFAOYSA-N 0 3 265.353 2.556 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1ccccc1[O-])C(C)C ZINC000848927880 633411022 /nfs/dbraw/zinc/41/10/22/633411022.db2.gz PTPLBHWAUGQZID-UHFFFAOYSA-N 0 3 265.353 2.556 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000849353056 633627036 /nfs/dbraw/zinc/62/70/36/633627036.db2.gz XINKKUSQUWESDH-OAHLLOKOSA-N 0 3 284.359 2.760 20 10 CFCDHN Cc1c[nH]c(CN[C@H](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000850328551 633942884 /nfs/dbraw/zinc/94/28/84/633942884.db2.gz VANSSNUPKQXFKG-CYBMUJFWSA-N 0 3 286.423 2.813 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccc(C)cn3)C2)cc1 ZINC000850347424 633949014 /nfs/dbraw/zinc/94/90/14/633949014.db2.gz RXEIHXDPHGDBIC-MRXNPFEDSA-N 0 3 297.402 2.767 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3occc3C)C2)cc1 ZINC000850347771 633949025 /nfs/dbraw/zinc/94/90/25/633949025.db2.gz XBPCUCRZPOAYKL-CQSZACIVSA-N 0 3 286.375 2.965 20 10 CFCDHN COCc1csc(C[NH2+]Cc2c([O-])cccc2OC)c1 ZINC000850377588 633965647 /nfs/dbraw/zinc/96/56/47/633965647.db2.gz LJAJERDWCQBQND-UHFFFAOYSA-N 0 3 293.388 2.899 20 10 CFCDHN Cn1cc(C[C@@H]2CCC[C@@H]2[NH2+]Cc2ccccc2[O-])cn1 ZINC000850383977 633969902 /nfs/dbraw/zinc/96/99/02/633969902.db2.gz GLEGMIYMSMQHFW-HOCLYGCPSA-N 0 3 285.391 2.627 20 10 CFCDHN COc1ccc(CN[C@H]2CCCn3nccc32)cc1C ZINC000850430357 633989420 /nfs/dbraw/zinc/98/94/20/633989420.db2.gz OQDYBEZVJBQKQB-AWEZNQCLSA-N 0 3 271.364 2.825 20 10 CFCDHN COC(=O)CC(C)(C)C[C@H](C)[NH2+]Cc1ccccc1[O-] ZINC000850430389 633989522 /nfs/dbraw/zinc/98/95/22/633989522.db2.gz PHIQOGNZJSQTHR-LBPRGKRZSA-N 0 3 279.380 2.850 20 10 CFCDHN COC1CC(CC[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000850482681 634012144 /nfs/dbraw/zinc/01/21/44/634012144.db2.gz QYPFSUZPGBWFDM-UXUKBGGZSA-N 0 3 261.365 2.784 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C1CCOCC1 ZINC000850493406 634018057 /nfs/dbraw/zinc/01/80/57/634018057.db2.gz HIHRWQWCSQEJFE-BBRMVZONSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@H]([NH2+]C[C@]12OCCC[C@H]1C2(F)F)c1ccccc1[O-] ZINC000850533818 634039662 /nfs/dbraw/zinc/03/96/62/634039662.db2.gz FVRUNZRYXYIMKD-GDLCADMTSA-N 0 3 283.318 2.857 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)CC1CC1)c1cc(F)ccc1[O-] ZINC000850545879 634047453 /nfs/dbraw/zinc/04/74/53/634047453.db2.gz UCRTVKJBSMUOJN-JQWIXIFHSA-N 0 3 267.344 2.591 20 10 CFCDHN Cc1ccc2c(c1)CN(Cc1cc3c(cc1O)OCO3)CC2 ZINC000853533630 635029516 /nfs/dbraw/zinc/02/95/16/635029516.db2.gz LGKBFQLGKUUYSI-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cccnc1 ZINC000115629331 636025238 /nfs/dbraw/zinc/02/52/38/636025238.db2.gz WZVDYHSUSWJDPE-UHFFFAOYSA-N 0 3 255.365 2.746 20 10 CFCDHN COC[C@@H](NCc1cc(F)c(N(C)C)cc1F)C(C)C ZINC000858145516 636138712 /nfs/dbraw/zinc/13/87/12/636138712.db2.gz WVTBPJIRZVZSIV-CQSZACIVSA-N 0 3 286.366 2.791 20 10 CFCDHN COC(C)(C)CNCc1cc(F)c(N(C)C)cc1F ZINC000858146678 636138820 /nfs/dbraw/zinc/13/88/20/636138820.db2.gz LDUFAQZBKILSHF-UHFFFAOYSA-N 0 3 272.339 2.545 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]Cc1cc(C)ccc1O ZINC000858238009 636160632 /nfs/dbraw/zinc/16/06/32/636160632.db2.gz SEQIXFHSPFRXRA-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CCCN1CC(F)F)CC2 ZINC000858479236 636264932 /nfs/dbraw/zinc/26/49/32/636264932.db2.gz MGGBDZAROSKWNY-OLZOCXBDSA-N 0 3 296.361 2.699 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2ccc[nH]c2=O)c2c1c(F)ccc2[O-] ZINC000858563148 636294219 /nfs/dbraw/zinc/29/42/19/636294219.db2.gz QELJSLWDGAEVON-SKDRFNHKSA-N 0 3 288.322 2.970 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)C1 ZINC000858584731 636300662 /nfs/dbraw/zinc/30/06/62/636300662.db2.gz WHBXJKXOYUPLHZ-DNRKLUKYSA-N 0 3 265.328 2.847 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)C1 ZINC000858584732 636300990 /nfs/dbraw/zinc/30/09/90/636300990.db2.gz WHBXJKXOYUPLHZ-GMOBBJLQSA-N 0 3 265.328 2.847 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483663 637398577 /nfs/dbraw/zinc/39/85/77/637398577.db2.gz WNFFCZXJNHTKQI-SFHVURJKSA-N 0 3 283.371 2.876 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483663 637398582 /nfs/dbraw/zinc/39/85/82/637398582.db2.gz WNFFCZXJNHTKQI-SFHVURJKSA-N 0 3 283.371 2.876 20 10 CFCDHN Cc1ccc(O)c(CN2CCc3c(O)cccc3C2)c1 ZINC000862529263 637408090 /nfs/dbraw/zinc/40/80/90/637408090.db2.gz JDBORNGJKOGSJG-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN C[C@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(Br)ccc1[O-] ZINC000863547278 637693399 /nfs/dbraw/zinc/69/33/99/637693399.db2.gz RITPRVSOHTXKQL-HOTUBEGUSA-N 0 3 299.212 2.556 20 10 CFCDHN CCn1ccnc1NCc1c(O)cccc1Br ZINC000865293356 638260973 /nfs/dbraw/zinc/26/09/73/638260973.db2.gz HKTHTUOSNJNWLN-UHFFFAOYSA-N 0 3 296.168 2.983 20 10 CFCDHN CC1(C)CC[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000190254591 650422476 /nfs/dbraw/zinc/42/24/76/650422476.db2.gz PQJOEGRSXZVSEE-LBPRGKRZSA-N 0 3 253.317 2.579 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1C[C@@H]([NH2+]Cc2ccccc2[O-])C1 ZINC000865774826 638565603 /nfs/dbraw/zinc/56/56/03/638565603.db2.gz HCXPRHJLJFRSLC-BETUJISGSA-N 0 3 277.364 2.602 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@@H](O)C2CCCC2)c([O-])c1 ZINC000865876731 638637687 /nfs/dbraw/zinc/63/76/87/638637687.db2.gz XMWGSXLDSGPHAK-MRXNPFEDSA-N 0 3 293.407 2.822 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CC[C@H](O)C(F)F)c2c1c(F)ccc2[O-] ZINC000866442481 638822102 /nfs/dbraw/zinc/82/21/02/638822102.db2.gz MNUKUNCKGHBHMS-ZOFUNIGCSA-N 0 3 289.297 2.685 20 10 CFCDHN CC1(C)CC[C@@H](O)[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000866452584 638825032 /nfs/dbraw/zinc/82/50/32/638825032.db2.gz JXXJORHPVHAEDR-BFHYXJOUSA-N 0 3 275.392 2.909 20 10 CFCDHN CCCOc1ccc(CNCC[S@@](=O)CC)cc1C ZINC000873048975 641996168 /nfs/dbraw/zinc/99/61/68/641996168.db2.gz UFLLBFCNPIKCFC-IBGZPJMESA-N 0 3 283.437 2.642 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)c([O-])c1 ZINC000873156727 642040089 /nfs/dbraw/zinc/04/00/89/642040089.db2.gz MTZPTMQDSDGGHT-ISTRZQFTSA-N 0 3 291.391 2.838 20 10 CFCDHN CCN1CC[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000124596859 642271452 /nfs/dbraw/zinc/27/14/52/642271452.db2.gz NFVMOYCHGLWKFS-NSHDSACASA-N 0 3 268.788 2.572 20 10 CFCDHN CCN1CC[N@@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000124596859 642271458 /nfs/dbraw/zinc/27/14/58/642271458.db2.gz NFVMOYCHGLWKFS-NSHDSACASA-N 0 3 268.788 2.572 20 10 CFCDHN COc1ccc(O)c(CNCc2ccccc2F)c1 ZINC000020091237 642298254 /nfs/dbraw/zinc/29/82/54/642298254.db2.gz CNTHKBKKXHSILL-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN C[C@H]([NH2+]CC1(CO)CCCCC1)c1ccccc1[O-] ZINC000125485454 642648713 /nfs/dbraw/zinc/64/87/13/642648713.db2.gz CIVZQAKIRCZDDF-ZDUSSCGKSA-N 0 3 263.381 2.986 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccccc1[O-] ZINC000085976818 650792844 /nfs/dbraw/zinc/79/28/44/650792844.db2.gz DSVIBOAPIOQPGF-YUELXQCFSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(C2(C)OCCO2)CC1 ZINC000876727397 642984786 /nfs/dbraw/zinc/98/47/86/642984786.db2.gz ZVPBRGBZFCUHJL-UHFFFAOYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000876780285 643004912 /nfs/dbraw/zinc/00/49/12/643004912.db2.gz TXAKATDOQJIVDF-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000876780285 643004920 /nfs/dbraw/zinc/00/49/20/643004920.db2.gz TXAKATDOQJIVDF-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN CN(Cc1ccc[nH]1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876790457 643010513 /nfs/dbraw/zinc/01/05/13/643010513.db2.gz IGAOMKIBAHSITP-UHFFFAOYSA-N 0 3 299.418 2.608 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000876807448 643018555 /nfs/dbraw/zinc/01/85/55/643018555.db2.gz DRPZKIANAKJMKJ-HOCLYGCPSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000876807448 643018562 /nfs/dbraw/zinc/01/85/62/643018562.db2.gz DRPZKIANAKJMKJ-HOCLYGCPSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000876807891 643019084 /nfs/dbraw/zinc/01/90/84/643019084.db2.gz AVZYXDVKSPGADJ-CQSZACIVSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](OCC(C)C)C1 ZINC000876807891 643019088 /nfs/dbraw/zinc/01/90/88/643019088.db2.gz AVZYXDVKSPGADJ-CQSZACIVSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOc1ccccc1 ZINC000876891614 643054547 /nfs/dbraw/zinc/05/45/47/643054547.db2.gz CUUZCPPZVFRTIF-UHFFFAOYSA-N 0 3 257.333 2.869 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](c2ccco2)N(C)C)c([O-])c1 ZINC000876891504 643054588 /nfs/dbraw/zinc/05/45/88/643054588.db2.gz ZODWLVZZDJAFLU-AWEZNQCLSA-N 0 3 274.364 2.686 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876917526 643064218 /nfs/dbraw/zinc/06/42/18/643064218.db2.gz UWLHRTLQPRJLIN-QGZVFWFLSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)c1cccc(F)c1 ZINC000876988990 643095206 /nfs/dbraw/zinc/09/52/06/643095206.db2.gz NWNIPDPODWMMRH-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCNC(=O)OC(C)(C)C ZINC000877016073 643105350 /nfs/dbraw/zinc/10/53/50/643105350.db2.gz BYWPXWQMQSZEPL-UHFFFAOYSA-N 0 3 294.395 2.705 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)[C@H](C)c2ccccc2)c([O-])c1 ZINC000877034472 643113216 /nfs/dbraw/zinc/11/32/16/643113216.db2.gz IFBBMXJEAFFDPG-RHSMWYFYSA-N 0 3 285.387 2.955 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877035373 643114037 /nfs/dbraw/zinc/11/40/37/643114037.db2.gz GMVCKODQOWUAOE-KRWDZBQOSA-N 0 3 287.359 2.532 20 10 CFCDHN Cc1ccc(CN[C@H](CO)c2ccc(F)cc2)c(O)c1 ZINC000877041946 643117384 /nfs/dbraw/zinc/11/73/84/643117384.db2.gz PLMHHTYBJSJYAU-OAHLLOKOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)c2cccs2)c([O-])c1 ZINC000877047519 643119354 /nfs/dbraw/zinc/11/93/54/643119354.db2.gz BPDBGYHFSMMVNY-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)c2cccs2)c([O-])c1 ZINC000877047520 643119688 /nfs/dbraw/zinc/11/96/88/643119688.db2.gz BPDBGYHFSMMVNY-OAHLLOKOSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCOCC1CCOCC1 ZINC000877058668 643126645 /nfs/dbraw/zinc/12/66/45/643126645.db2.gz KZLODMVOTJYCIR-UHFFFAOYSA-N 0 3 293.407 2.624 20 10 CFCDHN COC1CCC(C[NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000877081545 643140376 /nfs/dbraw/zinc/14/03/76/643140376.db2.gz PLKTWRFHRIZJNS-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(C)CCCC[C@@H]1O ZINC000877082239 643141388 /nfs/dbraw/zinc/14/13/88/643141388.db2.gz YYMWFMHIHHGEQQ-HOTGVXAUSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(C)CCCC[C@H]1O ZINC000877082237 643141477 /nfs/dbraw/zinc/14/14/77/643141477.db2.gz YYMWFMHIHHGEQQ-CVEARBPZSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000877089557 643146348 /nfs/dbraw/zinc/14/63/48/643146348.db2.gz OADHVGRVHVISPM-CYBMUJFWSA-N 0 3 261.365 2.892 20 10 CFCDHN CCOCCC1(C[NH2+]Cc2c(C)cccc2[O-])CC1 ZINC000877114610 643157589 /nfs/dbraw/zinc/15/75/89/643157589.db2.gz VPWZMVDCYDFEID-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN COc1ccc2c(c1)OC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])C2 ZINC000877127472 643166222 /nfs/dbraw/zinc/16/62/22/643166222.db2.gz HRHUGSBAHIQKFQ-HNNXBMFYSA-N 0 3 299.370 2.803 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(C)cc2[O-])[C@]12CCCO2 ZINC000877345425 643243905 /nfs/dbraw/zinc/24/39/05/643243905.db2.gz CSXWLHIKIMGDOM-GVDBMIGSSA-N 0 3 291.391 2.517 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877394681 643257564 /nfs/dbraw/zinc/25/75/64/643257564.db2.gz FMRUXOPSBLEBDQ-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877394681 643257569 /nfs/dbraw/zinc/25/75/69/643257569.db2.gz FMRUXOPSBLEBDQ-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877468435 643288358 /nfs/dbraw/zinc/28/83/58/643288358.db2.gz IWNSFGFIPJYLNJ-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CCOCC(F)(F)C(F)F)c([O-])c1 ZINC000877478760 643295767 /nfs/dbraw/zinc/29/57/67/643295767.db2.gz MBJQNABZKGFTLZ-UHFFFAOYSA-N 0 3 295.276 2.707 20 10 CFCDHN COc1ccc(C[NH2+]C[C@@H]2CC2(Cl)Cl)c([O-])c1 ZINC000877494404 643307935 /nfs/dbraw/zinc/30/79/35/643307935.db2.gz WMTCKMOUQPFRTJ-VIFPVBQESA-N 0 3 276.163 2.684 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CCO)Cc2ccccc2)c([O-])c1 ZINC000877499084 643310878 /nfs/dbraw/zinc/31/08/78/643310878.db2.gz YIWRWSDTLQZCEZ-QGZVFWFLSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](CCO)Cc1ccccc1 ZINC000877498531 643311991 /nfs/dbraw/zinc/31/19/91/643311991.db2.gz QUKKCPSRZRLZOS-MRXNPFEDSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000877508323 643318923 /nfs/dbraw/zinc/31/89/23/643318923.db2.gz WWCXKRSPLHVYPH-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000877508323 643318930 /nfs/dbraw/zinc/31/89/30/643318930.db2.gz WWCXKRSPLHVYPH-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000877508324 643319162 /nfs/dbraw/zinc/31/91/62/643319162.db2.gz WWCXKRSPLHVYPH-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000877508324 643319165 /nfs/dbraw/zinc/31/91/65/643319165.db2.gz WWCXKRSPLHVYPH-HOCLYGCPSA-N 0 3 261.365 2.844 20 10 CFCDHN COc1ncc(CN[C@H](C)c2cc(OC)ccc2O)s1 ZINC000877532046 643335047 /nfs/dbraw/zinc/33/50/47/643335047.db2.gz CBPSGOIKJUZMRJ-SECBINFHSA-N 0 3 294.376 2.717 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCO[C@H](C(C)C)C2)c([O-])c1 ZINC000877554722 643354992 /nfs/dbraw/zinc/35/49/92/643354992.db2.gz NSFLAEIEJLWVFY-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCO[C@H](C(C)C)C2)c([O-])c1 ZINC000877554722 643355002 /nfs/dbraw/zinc/35/50/02/643355002.db2.gz NSFLAEIEJLWVFY-INIZCTEOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(CN2C[C@@]3(CCCO3)[C@H]2C2CC2)c(O)c1 ZINC000877555635 643356980 /nfs/dbraw/zinc/35/69/80/643356980.db2.gz YCEPVKOYRNVYCZ-SJORKVTESA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([O-])c1 ZINC000877563338 643362920 /nfs/dbraw/zinc/36/29/20/643362920.db2.gz JOFZNWBAIBQZRR-XHSDSOJGSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([O-])c1 ZINC000877563338 643362924 /nfs/dbraw/zinc/36/29/24/643362924.db2.gz JOFZNWBAIBQZRR-XHSDSOJGSA-N 0 3 275.392 2.826 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]([C@@H](CO)C2CC2)C2CC2)c([O-])c1 ZINC000877566646 643366653 /nfs/dbraw/zinc/36/66/53/643366653.db2.gz LNJAOEOVZOJGJJ-DOTOQJQBSA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c([O-])c1 ZINC000877573437 643371645 /nfs/dbraw/zinc/37/16/45/643371645.db2.gz QQXWSUBKDXODQB-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c([O-])c1 ZINC000877573437 643371651 /nfs/dbraw/zinc/37/16/51/643371651.db2.gz QQXWSUBKDXODQB-AWEZNQCLSA-N 0 3 263.381 2.684 20 10 CFCDHN COCC1(C[NH2+]Cc2c(C)cccc2[O-])CCCC1 ZINC000877574477 643373116 /nfs/dbraw/zinc/37/31/16/643373116.db2.gz LCLNMHOQIDCEME-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(CN2CCO[C@@H](C3CCC3)C2)c(O)c1 ZINC000877588002 643383011 /nfs/dbraw/zinc/38/30/11/643383011.db2.gz UBBCRLJMHOYJMF-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CO)c1ccc(F)cc1 ZINC000877590240 643384028 /nfs/dbraw/zinc/38/40/28/643384028.db2.gz XLBHZPGGOXDQRR-CQSZACIVSA-N 0 3 289.350 2.705 20 10 CFCDHN CC[C@@H](C)C[C@@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605822 643393261 /nfs/dbraw/zinc/39/32/61/643393261.db2.gz JYVRZIWVBYLBCX-RISCZKNCSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cn3c(cccc3C)n2)c([O-])c1 ZINC000877608741 643396169 /nfs/dbraw/zinc/39/61/69/643396169.db2.gz WFJSJMPREANKID-UHFFFAOYSA-N 0 3 295.386 2.989 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877609987 643397495 /nfs/dbraw/zinc/39/74/95/643397495.db2.gz GEAVWORPZVAXBJ-GXTWGEPZSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC([C@H](C)CO)CC1 ZINC000877612867 643399649 /nfs/dbraw/zinc/39/96/49/643399649.db2.gz PQSOVMVWFKCPNY-CYBMUJFWSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)C(=O)OC(C)(C)C)c([O-])c1 ZINC000877618457 643404681 /nfs/dbraw/zinc/40/46/81/643404681.db2.gz VIODRXMBKIVCRY-LBPRGKRZSA-N 0 3 279.380 2.768 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](C)C(=O)OC(C)(C)C ZINC000877618378 643405453 /nfs/dbraw/zinc/40/54/53/643405453.db2.gz REBHKUWBJRVMOW-LBPRGKRZSA-N 0 3 279.380 2.768 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)c2ccccn2)c([O-])c1 ZINC000877620387 643406303 /nfs/dbraw/zinc/40/63/03/643406303.db2.gz HUTIJPUHGSBPTH-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2cnn(C)c2)c([O-])c1 ZINC000877631291 643416602 /nfs/dbraw/zinc/41/66/02/643416602.db2.gz OTEOMSMXTRFXJM-NVXWUHKLSA-N 0 3 299.418 2.935 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@@H]1[NH2+]Cc1c(C)cccc1[O-] ZINC000877639925 643424351 /nfs/dbraw/zinc/42/43/51/643424351.db2.gz SDTWRAAHLFXEHN-DOTOQJQBSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H]2CCSC2)c([O-])c1 ZINC000877661532 643439310 /nfs/dbraw/zinc/43/93/10/643439310.db2.gz DCTMGBPBZROORS-GFCCVEGCSA-N 0 3 251.395 2.933 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000877697127 643459073 /nfs/dbraw/zinc/45/90/73/643459073.db2.gz BOTGOSUJVDFRIP-UHFFFAOYSA-N 0 3 287.334 2.894 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000877728257 643489040 /nfs/dbraw/zinc/48/90/40/643489040.db2.gz MYVDPSZUPSDGPE-ZDUSSCGKSA-N 0 3 279.355 2.828 20 10 CFCDHN COc1ncc(CN[C@H](C)c2ccccc2O)s1 ZINC000877755506 643535216 /nfs/dbraw/zinc/53/52/16/643535216.db2.gz CYVQUOFFRZRTFN-SECBINFHSA-N 0 3 264.350 2.708 20 10 CFCDHN C[C@@H]([NH2+]Cc1cn(C)nc1C(F)F)c1ccccc1[O-] ZINC000877755993 643535236 /nfs/dbraw/zinc/53/52/36/643535236.db2.gz XDGADDNGCCEJBR-SECBINFHSA-N 0 3 281.306 2.914 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc(C2CC2)nc1)c1ccccc1[O-] ZINC000877756015 643537121 /nfs/dbraw/zinc/53/71/21/643537121.db2.gz YVBKYPONYJVVMX-LLVKDONJSA-N 0 3 269.348 2.910 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc(N2CCCC2)nc1)c1ccccc1[O-] ZINC000877757118 643537136 /nfs/dbraw/zinc/53/71/36/643537136.db2.gz HPAFARTWJAEABH-ZDUSSCGKSA-N 0 3 298.390 2.633 20 10 CFCDHN COC(=O)c1cc(CN[C@H](C)c2ccccc2O)oc1C ZINC000877756541 643537255 /nfs/dbraw/zinc/53/72/55/643537255.db2.gz QHLOEKUNIWLSFV-SNVBAGLBSA-N 0 3 289.331 2.931 20 10 CFCDHN COC(=O)c1cc(CN[C@@H](C)c2ccccc2O)c(C)o1 ZINC000877758224 643538878 /nfs/dbraw/zinc/53/88/78/643538878.db2.gz OAQPIFALFDPDMV-JTQLQIEISA-N 0 3 289.331 2.931 20 10 CFCDHN COC(=O)c1cc(C[NH2+][C@@H](C)c2ccccc2[O-])c(C)o1 ZINC000877758224 643538886 /nfs/dbraw/zinc/53/88/86/643538886.db2.gz OAQPIFALFDPDMV-JTQLQIEISA-N 0 3 289.331 2.931 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@@H]2O)c1[O-] ZINC000877777819 643554216 /nfs/dbraw/zinc/55/42/16/643554216.db2.gz GIRHXBRLUPKCCD-OLZOCXBDSA-N 0 3 269.772 2.747 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877818006 643581592 /nfs/dbraw/zinc/58/15/92/643581592.db2.gz WCTNNDPBYYLAHG-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877818006 643581599 /nfs/dbraw/zinc/58/15/99/643581599.db2.gz WCTNNDPBYYLAHG-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN C[C@@H]1CN(Cc2ccccc2O)CC[C@@H](C(F)(F)F)O1 ZINC000877822194 643588330 /nfs/dbraw/zinc/58/83/30/643588330.db2.gz FGWSTVRGYNMBMT-MFKMUULPSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccccc2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877822194 643588337 /nfs/dbraw/zinc/58/83/37/643588337.db2.gz FGWSTVRGYNMBMT-MFKMUULPSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccccc2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877822194 643588340 /nfs/dbraw/zinc/58/83/40/643588340.db2.gz FGWSTVRGYNMBMT-MFKMUULPSA-N 0 3 289.297 2.934 20 10 CFCDHN Cc1ccc(CN[C@@H](C)c2nccnc2C)c(O)c1 ZINC000877828659 643594837 /nfs/dbraw/zinc/59/48/37/643594837.db2.gz NOGRSWCKTXYMBY-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)NC1CCC(C)CC1)c1ccccc1[O-] ZINC000879649025 644362852 /nfs/dbraw/zinc/36/28/52/644362852.db2.gz JATMVQFFVTZKAV-ROKHWSDSSA-N 0 3 290.407 2.738 20 10 CFCDHN C[C@H]([NH2+]CC(=O)NC1CCC(C)CC1)c1ccccc1[O-] ZINC000879651737 644364453 /nfs/dbraw/zinc/36/44/53/644364453.db2.gz JATMVQFFVTZKAV-MOKVOYLWSA-N 0 3 290.407 2.738 20 10 CFCDHN CC(C)CNC(=O)CCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879650132 644364649 /nfs/dbraw/zinc/36/46/49/644364649.db2.gz KIPKRFOSINFGMY-ZDUSSCGKSA-N 0 3 278.396 2.595 20 10 CFCDHN C[C@@H](NC(=O)C[NH2+][C@H](C)c1ccccc1[O-])c1ccccc1 ZINC000879650323 644365240 /nfs/dbraw/zinc/36/52/40/644365240.db2.gz UNHHANCTNFVXRC-ZIAGYGMSSA-N 0 3 298.386 2.920 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)N1CCC(C)CC1 ZINC000879653502 644366593 /nfs/dbraw/zinc/36/65/93/644366593.db2.gz QQILMRMDMSKPOD-KBPBESRZSA-N 0 3 290.407 2.690 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1cc(F)ccc1[O-] ZINC000094617966 650960120 /nfs/dbraw/zinc/96/01/20/650960120.db2.gz OHEQNRNEEQWOQC-VXGBXAGGSA-N 0 3 266.360 2.524 20 10 CFCDHN CCC[C@H](N)c1cn(Cc2ccc(N(C)CC)cc2)nn1 ZINC000881313283 644950071 /nfs/dbraw/zinc/95/00/71/644950071.db2.gz GYQUBBSCVGKMBV-HNNXBMFYSA-N 0 3 287.411 2.582 20 10 CFCDHN CC[C@H]([NH2+]CC[C@H](C)[S@](C)=O)c1ccccc1[O-] ZINC000253024805 651033784 /nfs/dbraw/zinc/03/37/84/651033784.db2.gz MPOGSPFBJRPGKS-FNFWKMNBSA-N 0 3 269.410 2.590 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCN1CC)c1ccc(C)cc1[O-] ZINC000883354772 645759234 /nfs/dbraw/zinc/75/92/34/645759234.db2.gz BTOZLGAMTWVKIV-ZFWWWQNUSA-N 0 3 262.397 2.836 20 10 CFCDHN COc1c(C)cnc(CNCc2ccccc2O)c1C ZINC000134231864 646308895 /nfs/dbraw/zinc/30/88/95/646308895.db2.gz DEDWGNJZDYKOTK-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000134228827 646309176 /nfs/dbraw/zinc/30/91/76/646309176.db2.gz NMCYNBVEDBOTIF-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@](C)(O)C(F)F ZINC000886027741 646826901 /nfs/dbraw/zinc/82/69/01/646826901.db2.gz IAHDAZUETKGHNJ-CQSZACIVSA-N 0 3 273.323 2.620 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@](C)(O)C(F)F ZINC000886027741 646826906 /nfs/dbraw/zinc/82/69/06/646826906.db2.gz IAHDAZUETKGHNJ-CQSZACIVSA-N 0 3 273.323 2.620 20 10 CFCDHN CCCOc1ccc(CN[C@]23C[C@H]2COC3)cc1C ZINC000886198968 646916337 /nfs/dbraw/zinc/91/63/37/646916337.db2.gz GGWKWYLTAIFEJQ-HOCLYGCPSA-N 0 3 261.365 2.662 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])[C@H]1CCCOC1 ZINC000886789658 647137693 /nfs/dbraw/zinc/13/76/93/647137693.db2.gz ZFPFTIDFRGMXDG-DZKIICNBSA-N 0 3 293.407 2.793 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1C=C[C@H]3C[C@@H]1CO3)CC2 ZINC000926936513 648664179 /nfs/dbraw/zinc/66/41/79/648664179.db2.gz OHCLUKKLCWTVGD-XGUBFFRZSA-N 0 3 271.360 2.560 20 10 CFCDHN COC[C@@H](C[NH2+][C@@H](C)c1ccccc1[O-])C(C)C ZINC000927096813 648710498 /nfs/dbraw/zinc/71/04/98/648710498.db2.gz HSAXZGWPNXRBIP-QWHCGFSZSA-N 0 3 251.370 2.961 20 10 CFCDHN CCCC[N@H+](CCc1nnc(C)o1)Cc1ccccc1[O-] ZINC000930352854 649236211 /nfs/dbraw/zinc/23/62/11/649236211.db2.gz ZBMCEHYUZAWRMH-UHFFFAOYSA-N 0 3 289.379 2.928 20 10 CFCDHN CCCC[N@@H+](CCc1nnc(C)o1)Cc1ccccc1[O-] ZINC000930352854 649236214 /nfs/dbraw/zinc/23/62/14/649236214.db2.gz ZBMCEHYUZAWRMH-UHFFFAOYSA-N 0 3 289.379 2.928 20 10 CFCDHN [O-]c1cccc(Cl)c1C[NH2+][C@@H]1CCN(CC2CC2)C1 ZINC000113340026 651192134 /nfs/dbraw/zinc/19/21/34/651192134.db2.gz AISSWFYFPWDRFX-GFCCVEGCSA-N 0 3 280.799 2.620 20 10 CFCDHN C[C@@H]1C[NH2+]C[C@@H](C)N1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001236103413 778694933 /nfs/dbraw/zinc/69/49/33/778694933.db2.gz RCIAHXIRYALVKY-NXEZZACHSA-N 0 3 288.313 2.593 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](COCC2CC2)C1 ZINC001237493103 779691213 /nfs/dbraw/zinc/69/12/13/779691213.db2.gz VLDMSEPQKLANTO-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](COCC2CC2)C1 ZINC001237493103 779691215 /nfs/dbraw/zinc/69/12/15/779691215.db2.gz VLDMSEPQKLANTO-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN CCCCOC(=O)[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC001140056482 770113114 /nfs/dbraw/zinc/11/31/14/770113114.db2.gz YRMNXONPIUIYIW-LBPRGKRZSA-N 0 3 295.354 2.697 20 10 CFCDHN CCCCOC(=O)[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC001140056482 770113117 /nfs/dbraw/zinc/11/31/17/770113117.db2.gz YRMNXONPIUIYIW-LBPRGKRZSA-N 0 3 295.354 2.697 20 10 CFCDHN CCOC1CCC([NH2+]Cc2ccc(O)cc2[O-])CC1 ZINC000707372752 770665647 /nfs/dbraw/zinc/66/56/47/770665647.db2.gz YBJLGSWHQCLJGS-UHFFFAOYSA-N 0 3 265.353 2.535 20 10 CFCDHN CC[C@H]([NH2+]CCO[C@H]1CC1(F)F)c1ccccc1[O-] ZINC000690732695 770837035 /nfs/dbraw/zinc/83/70/35/770837035.db2.gz SNKCFQHOXORJSR-AAEUAGOBSA-N 0 3 271.307 2.857 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCC1SCCS1 ZINC000693779490 773249212 /nfs/dbraw/zinc/24/92/12/773249212.db2.gz HJPIRRHDSZMOAV-UHFFFAOYSA-N 0 3 255.408 2.678 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@H](C)O1 ZINC000694857236 775597887 /nfs/dbraw/zinc/59/78/87/775597887.db2.gz FHMCHDCKZJABJR-MNOVXSKESA-N 0 3 253.317 2.531 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@H](C)O1 ZINC000694857236 775597892 /nfs/dbraw/zinc/59/78/92/775597892.db2.gz FHMCHDCKZJABJR-MNOVXSKESA-N 0 3 253.317 2.531 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)c1[O-] ZINC000690800629 775674872 /nfs/dbraw/zinc/67/48/72/775674872.db2.gz ZWCJUEHJZBJMEY-JQWIXIFHSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1[O-] ZINC000690800629 775674877 /nfs/dbraw/zinc/67/48/77/775674877.db2.gz ZWCJUEHJZBJMEY-JQWIXIFHSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2C[C@@H](C)CC23CC3)c(OC)c1 ZINC001141031022 775796375 /nfs/dbraw/zinc/79/63/75/775796375.db2.gz VUIWVPLNEOZUSL-NSHDSACASA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2C[C@@H](C)CC23CC3)c(OC)c1 ZINC001141031022 775796384 /nfs/dbraw/zinc/79/63/84/775796384.db2.gz VUIWVPLNEOZUSL-NSHDSACASA-N 0 3 277.364 2.784 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H]1CCCC3(CC3)C1)OCO2 ZINC000695691329 775941274 /nfs/dbraw/zinc/94/12/74/775941274.db2.gz SCQTXOUTROWSDN-GFCCVEGCSA-N 0 3 275.348 2.933 20 10 CFCDHN Cn1cc2c(n1)CC[N@@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231588961 777268728 /nfs/dbraw/zinc/26/87/28/777268728.db2.gz ABFXNFQMXLWSIX-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1cc2c(n1)CC[N@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC001231588961 777268739 /nfs/dbraw/zinc/26/87/39/777268739.db2.gz ABFXNFQMXLWSIX-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN CCOC(=O)C1C[NH+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231590083 777269960 /nfs/dbraw/zinc/26/99/60/777269960.db2.gz ILWFUYSCYSIIIO-UHFFFAOYSA-N 0 3 285.343 2.540 20 10 CFCDHN Cc1cccc(CN(C)Cc2cnc3ccccn23)c1O ZINC001231590989 777271705 /nfs/dbraw/zinc/27/17/05/777271705.db2.gz NDXVWZQPINXCDO-UHFFFAOYSA-N 0 3 281.359 2.980 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CCCC12COC2 ZINC001231590310 777271948 /nfs/dbraw/zinc/27/19/48/777271948.db2.gz SDCZYURPGZCAKZ-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CCCC12COC2 ZINC001231590310 777271953 /nfs/dbraw/zinc/27/19/53/777271953.db2.gz SDCZYURPGZCAKZ-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN Cc1cccc(CN2CCC[C@@H]2c2cnccn2)c1O ZINC001231592014 777272056 /nfs/dbraw/zinc/27/20/56/777272056.db2.gz FGCPYYXDOVEYIL-OAHLLOKOSA-N 0 3 269.348 2.828 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCCOC(C)(C)C1 ZINC001231853694 777352506 /nfs/dbraw/zinc/35/25/06/777352506.db2.gz NSNILBBXUXSMHQ-UHFFFAOYSA-N 0 3 292.423 2.762 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@H]2C[C@H]21 ZINC001231858342 777354345 /nfs/dbraw/zinc/35/43/45/777354345.db2.gz UJGBQCGFSXNMJA-SWLSCSKDSA-N 0 3 260.381 2.746 20 10 CFCDHN Cc1cnc2c(c1)CN(Cc1ccc(N(C)C)cc1O)CC2 ZINC001232841967 777690166 /nfs/dbraw/zinc/69/01/66/777690166.db2.gz VXPWXSRABOAAAY-UHFFFAOYSA-N 0 3 297.402 2.720 20 10 CFCDHN Cc1cc(O)cc(CN2CCc3cccc(O)c3C2)c1 ZINC001232885960 777707099 /nfs/dbraw/zinc/70/70/99/777707099.db2.gz OZHHWMVZMWICEE-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001233287901 777870661 /nfs/dbraw/zinc/87/06/61/777870661.db2.gz MFGYTKNWJGBSIR-ZUZCIYMTSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c1[O-] ZINC001233287901 777870671 /nfs/dbraw/zinc/87/06/71/777870671.db2.gz MFGYTKNWJGBSIR-ZUZCIYMTSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@@](C)(O)[C@@H](C)C2)c1O ZINC001233287901 777870682 /nfs/dbraw/zinc/87/06/82/777870682.db2.gz MFGYTKNWJGBSIR-ZUZCIYMTSA-N 0 3 299.798 2.647 20 10 CFCDHN CN(Cc1ccccc1O)Cc1cc(F)c(F)cc1N ZINC001233381700 777925039 /nfs/dbraw/zinc/92/50/39/777925039.db2.gz OSCRPDARTSEBLA-UHFFFAOYSA-N 0 3 278.302 2.885 20 10 CFCDHN C[C@H]1c2ccccc2CCN1Cc1cc(O)c(O)cc1O ZINC001233482905 777961898 /nfs/dbraw/zinc/96/18/98/777961898.db2.gz GRUMWASBKBXDEM-NSHDSACASA-N 0 3 285.343 2.923 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@]34CCOC4)c2c1 ZINC001234569741 778254994 /nfs/dbraw/zinc/25/49/94/778254994.db2.gz RVCTYKOCVYFWCY-GOSISDBHSA-N 0 3 299.370 2.919 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@]34CCOC4)c2c1 ZINC001234569741 778254997 /nfs/dbraw/zinc/25/49/97/778254997.db2.gz RVCTYKOCVYFWCY-GOSISDBHSA-N 0 3 299.370 2.919 20 10 CFCDHN CC[C@@H](COC)Oc1ccc(N2CCN(CC)CC2)cc1 ZINC001234658088 778279817 /nfs/dbraw/zinc/27/98/17/778279817.db2.gz TXIXWXICEJLOQE-INIZCTEOSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1c(C[N@H+]2CC[C@@H](O)C2)cccc1-c1ccccc1 ZINC001234993581 778346328 /nfs/dbraw/zinc/34/63/28/778346328.db2.gz ZEKDBKWMRUWXQZ-OAHLLOKOSA-N 0 3 269.344 2.626 20 10 CFCDHN [O-]c1c(C[N@@H+]2CC[C@@H](O)C2)cccc1-c1ccccc1 ZINC001234993581 778346330 /nfs/dbraw/zinc/34/63/30/778346330.db2.gz ZEKDBKWMRUWXQZ-OAHLLOKOSA-N 0 3 269.344 2.626 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCCC[C@@]12CC[NH2+]C2 ZINC001235125971 778392956 /nfs/dbraw/zinc/39/29/56/778392956.db2.gz QFIBEZZGWDAHIS-HNNXBMFYSA-N 0 3 280.799 2.764 20 10 CFCDHN [O-]c1c(CN2CCC[C@H]3[NH2+]C[C@H]32)cccc1-c1ccccc1 ZINC001235303294 778451172 /nfs/dbraw/zinc/45/11/72/778451172.db2.gz KMJLCXOHCVIDJF-QZTJIDSGSA-N 0 3 294.398 2.995 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCCOCC2)c([O-])c1 ZINC001235674075 778531541 /nfs/dbraw/zinc/53/15/41/778531541.db2.gz DISLMRNBTXODEM-UHFFFAOYSA-N 0 3 263.381 2.912 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCCOCC2)c([O-])c1 ZINC001235674075 778531542 /nfs/dbraw/zinc/53/15/42/778531542.db2.gz DISLMRNBTXODEM-UHFFFAOYSA-N 0 3 263.381 2.912 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](O)C2)c([O-])c1 ZINC001235676823 778534571 /nfs/dbraw/zinc/53/45/71/778534571.db2.gz WBAMEMBLHAAOHI-AWEZNQCLSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@H](O)C2)c([O-])c1 ZINC001235676823 778534575 /nfs/dbraw/zinc/53/45/75/778534575.db2.gz WBAMEMBLHAAOHI-AWEZNQCLSA-N 0 3 263.381 2.646 20 10 CFCDHN CCN(Cc1ccc(Cl)cc1[O-])[C@@H]1CCC[NH2+]C1 ZINC001236007029 778651668 /nfs/dbraw/zinc/65/16/68/778651668.db2.gz MFOSTKDXETWQPL-CYBMUJFWSA-N 0 3 268.788 2.620 20 10 CFCDHN CCN(Cc1cc(Cl)c(C)cc1[O-])[C@@H]1CCC[NH2+]C1 ZINC001236008064 778652789 /nfs/dbraw/zinc/65/27/89/778652789.db2.gz QHNXTDIUYYTCIK-CYBMUJFWSA-N 0 3 282.815 2.928 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@H]2CCCC[C@@H]2[NH3+])c(Cl)c1 ZINC001236214606 778739430 /nfs/dbraw/zinc/73/94/30/778739430.db2.gz GNYNKRDHEZWMRU-KBPBESRZSA-N 0 3 298.814 2.756 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@@H]([NH3+])[C@@H]2C)cc1Cl ZINC001236417637 778811898 /nfs/dbraw/zinc/81/18/98/778811898.db2.gz CKSORMDUWCRGMZ-GXFFZTMASA-N 0 3 268.788 2.666 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@H](CO)CC[C@@H]2C)c([O-])c1 ZINC001236782745 778933346 /nfs/dbraw/zinc/93/33/46/778933346.db2.gz DPVCGAIMHMOTQF-GXTWGEPZSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@H](CO)CC[C@@H]2C)c([O-])c1 ZINC001236782745 778933350 /nfs/dbraw/zinc/93/33/50/778933350.db2.gz DPVCGAIMHMOTQF-GXTWGEPZSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236782840 778933921 /nfs/dbraw/zinc/93/39/21/778933921.db2.gz FNTXOKQPAOSTND-CXAGYDPISA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@](C)(O)CC2)c([O-])c1 ZINC001236782840 778933929 /nfs/dbraw/zinc/93/39/29/778933929.db2.gz FNTXOKQPAOSTND-CXAGYDPISA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCCC[C@](O)(CF)C2)c([O-])c1 ZINC001236782794 778934016 /nfs/dbraw/zinc/93/40/16/778934016.db2.gz FGZSVYLHCLODLS-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCCC[C@](O)(CF)C2)c([O-])c1 ZINC001236782794 778934022 /nfs/dbraw/zinc/93/40/22/778934022.db2.gz FGZSVYLHCLODLS-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001236786630 778934759 /nfs/dbraw/zinc/93/47/59/778934759.db2.gz DDAVSYJFNBNFDR-ZFWWWQNUSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c([O-])c1 ZINC001236786630 778934765 /nfs/dbraw/zinc/93/47/65/778934765.db2.gz DDAVSYJFNBNFDR-ZFWWWQNUSA-N 0 3 273.376 2.756 20 10 CFCDHN CCc1ccc(CN2CCN(c3cccnc3)CC2)c(O)c1 ZINC001236784397 778935030 /nfs/dbraw/zinc/93/50/30/778935030.db2.gz WGPDZFSUMJECMO-UHFFFAOYSA-N 0 3 297.402 2.672 20 10 CFCDHN CCc1ccc(C[N@H+](CC)CCn2ccnc2)c([O-])c1 ZINC001236789242 778937629 /nfs/dbraw/zinc/93/76/29/778937629.db2.gz TYLUVOBSBHCRHZ-UHFFFAOYSA-N 0 3 273.380 2.673 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)CCn2ccnc2)c([O-])c1 ZINC001236789242 778937633 /nfs/dbraw/zinc/93/76/33/778937633.db2.gz TYLUVOBSBHCRHZ-UHFFFAOYSA-N 0 3 273.380 2.673 20 10 CFCDHN CCc1ccc(C[NH+]2CCC3(CCC(=O)O3)CC2)c([O-])c1 ZINC001236793977 778939463 /nfs/dbraw/zinc/93/94/63/778939463.db2.gz IMVXPKUBCIEOOP-UHFFFAOYSA-N 0 3 289.375 2.626 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@]3(C2)CCCCO3)c([O-])c1 ZINC001236808956 778948355 /nfs/dbraw/zinc/94/83/55/778948355.db2.gz SFTMCCCIKYUCQE-KRWDZBQOSA-N 0 3 291.391 2.854 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@]3(C2)CCCCO3)c([O-])c1 ZINC001236808956 778948357 /nfs/dbraw/zinc/94/83/57/778948357.db2.gz SFTMCCCIKYUCQE-KRWDZBQOSA-N 0 3 291.391 2.854 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC001236813499 778951095 /nfs/dbraw/zinc/95/10/95/778951095.db2.gz LAJVYHAMTHJNLB-GFCCVEGCSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@H](CF)C2)c([O-])c1 ZINC001236813499 778951101 /nfs/dbraw/zinc/95/11/01/778951101.db2.gz LAJVYHAMTHJNLB-GFCCVEGCSA-N 0 3 267.344 2.891 20 10 CFCDHN Oc1cc2ccccc2cc1CN1C[C@H]2CC[C@@H](C1)O2 ZINC001236827500 778956614 /nfs/dbraw/zinc/95/66/14/778956614.db2.gz UIKYUHARRJEPIE-IYBDPMFKSA-N 0 3 269.344 2.909 20 10 CFCDHN COC(=O)C1CC[NH+](Cc2cc3ccccc3cc2[O-])CC1 ZINC001236829527 778956732 /nfs/dbraw/zinc/95/67/32/778956732.db2.gz IPGZGQMUUIGTDY-UHFFFAOYSA-N 0 3 299.370 2.930 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC2(COC2)C1 ZINC001236827395 778957067 /nfs/dbraw/zinc/95/70/67/778957067.db2.gz RGKQQTPHBZNJFJ-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC2(COC2)C1 ZINC001236827395 778957075 /nfs/dbraw/zinc/95/70/75/778957075.db2.gz RGKQQTPHBZNJFJ-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCc2nccn2CC1 ZINC001236833015 778958996 /nfs/dbraw/zinc/95/89/96/778958996.db2.gz MLWDRRWCWUOHTB-UHFFFAOYSA-N 0 3 293.370 2.800 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCc2nccn2CC1 ZINC001236833015 778959001 /nfs/dbraw/zinc/95/90/01/778959001.db2.gz MLWDRRWCWUOHTB-UHFFFAOYSA-N 0 3 293.370 2.800 20 10 CFCDHN CN1CC2(C1)CC[N@H+](Cc1cc3ccccc3cc1[O-])C2 ZINC001236837098 778960775 /nfs/dbraw/zinc/96/07/75/778960775.db2.gz NMJAVVBBXFSZOI-UHFFFAOYSA-N 0 3 282.387 2.683 20 10 CFCDHN CN1CC2(C1)CC[N@@H+](Cc1cc3ccccc3cc1[O-])C2 ZINC001236837098 778960779 /nfs/dbraw/zinc/96/07/79/778960779.db2.gz NMJAVVBBXFSZOI-UHFFFAOYSA-N 0 3 282.387 2.683 20 10 CFCDHN CC[N@H+](CCN(C)C)Cc1cc2ccccc2cc1[O-] ZINC001236840885 778962462 /nfs/dbraw/zinc/96/24/62/778962462.db2.gz RZMPSCGFYBBWAG-UHFFFAOYSA-N 0 3 272.392 2.929 20 10 CFCDHN CC[N@@H+](CCN(C)C)Cc1cc2ccccc2cc1[O-] ZINC001236840885 778962467 /nfs/dbraw/zinc/96/24/67/778962467.db2.gz RZMPSCGFYBBWAG-UHFFFAOYSA-N 0 3 272.392 2.929 20 10 CFCDHN Oc1ccc(-c2ccc(F)cc2)cc1CN1CCNC1 ZINC001236851297 778965190 /nfs/dbraw/zinc/96/51/90/778965190.db2.gz SWUQYQSBXNCMDF-UHFFFAOYSA-N 0 3 272.323 2.561 20 10 CFCDHN Clc1cc(N2CCOCC2)ccc1CN1C[C@@H]2C[C@@H]2C1 ZINC001236924071 778981805 /nfs/dbraw/zinc/98/18/05/778981805.db2.gz KRDQZPDMMHFSDR-OKILXGFUSA-N 0 3 292.810 2.628 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CCC(C)(O)CC2)c([O-])c1 ZINC001237044057 778997225 /nfs/dbraw/zinc/99/72/25/778997225.db2.gz ACCGRNKUXYCWQN-UHFFFAOYSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[NH+]2CC3(C2)CCOC3)c([O-])c1 ZINC001237044493 778997368 /nfs/dbraw/zinc/99/73/68/778997368.db2.gz CXOHGCCUBBQKPL-UHFFFAOYSA-N 0 3 261.365 2.738 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCC[C@@H](O)CC2)c([O-])c1 ZINC001237044916 778997740 /nfs/dbraw/zinc/99/77/40/778997740.db2.gz FRUFLSGMUFCHSZ-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCC[C@@H](O)CC2)c([O-])c1 ZINC001237044916 778997742 /nfs/dbraw/zinc/99/77/42/778997742.db2.gz FRUFLSGMUFCHSZ-OAHLLOKOSA-N 0 3 263.381 2.862 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2CO)c([O-])c1 ZINC001237046646 778998845 /nfs/dbraw/zinc/99/88/45/778998845.db2.gz URYPWIKFFSDKKS-WFASDCNBSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@@H](C)C[C@H]2CO)c([O-])c1 ZINC001237046646 778998849 /nfs/dbraw/zinc/99/88/49/778998849.db2.gz URYPWIKFFSDKKS-WFASDCNBSA-N 0 3 263.381 2.718 20 10 CFCDHN COCC[NH+](CCOC)Cc1ccc(C(C)C)cc1[O-] ZINC001237047561 778999222 /nfs/dbraw/zinc/99/92/22/778999222.db2.gz MGMFCLUVQHUBOL-UHFFFAOYSA-N 0 3 281.396 2.610 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056007 779002040 /nfs/dbraw/zinc/00/20/40/779002040.db2.gz UMIVTDDKSMVIKR-INIZCTEOSA-N 0 3 290.407 2.568 20 10 CFCDHN CC(=O)N(C)[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237056007 779002041 /nfs/dbraw/zinc/00/20/41/779002041.db2.gz UMIVTDDKSMVIKR-INIZCTEOSA-N 0 3 290.407 2.568 20 10 CFCDHN CN(Cc1c(O)cccc1OC(F)(F)F)[C@H]1CCOC1 ZINC001237118693 779016219 /nfs/dbraw/zinc/01/62/19/779016219.db2.gz AIVQKWTTXPROTB-VIFPVBQESA-N 0 3 291.269 2.512 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc(C(F)(F)F)ccc1[O-] ZINC001237137227 779023718 /nfs/dbraw/zinc/02/37/18/779023718.db2.gz NKHYMQUAVGBBTP-ZJUUUORDSA-N 0 3 289.297 2.614 20 10 CFCDHN C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(C(F)(F)F)ccc1[O-] ZINC001237137227 779023727 /nfs/dbraw/zinc/02/37/27/779023727.db2.gz NKHYMQUAVGBBTP-ZJUUUORDSA-N 0 3 289.297 2.614 20 10 CFCDHN CC(=O)Nc1ccccc1CN1CCc2cccc(O)c2C1 ZINC001237416231 779103253 /nfs/dbraw/zinc/10/32/53/779103253.db2.gz AXESSKYHYVITSL-UHFFFAOYSA-N 0 3 296.370 2.909 20 10 CFCDHN CO[C@@H]1CCC[C@@H]2C[N@H+](Cc3c(C)cccc3[O-])C[C@@H]21 ZINC001237488214 779119246 /nfs/dbraw/zinc/11/92/46/779119246.db2.gz KBWNLYYCEXJTLN-UKPHBRMFSA-N 0 3 275.392 2.948 20 10 CFCDHN CO[C@@H]1CCC[C@@H]2C[N@@H+](Cc3c(C)cccc3[O-])C[C@@H]21 ZINC001237488214 779119253 /nfs/dbraw/zinc/11/92/53/779119253.db2.gz KBWNLYYCEXJTLN-UKPHBRMFSA-N 0 3 275.392 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCCN(c2cccnc2)CC1 ZINC001237495203 779120578 /nfs/dbraw/zinc/12/05/78/779120578.db2.gz NDWGUCXUGADTPT-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCCN(c2cccnc2)CC1 ZINC001237495203 779120579 /nfs/dbraw/zinc/12/05/79/779120579.db2.gz NDWGUCXUGADTPT-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](O)CC2)c1[O-] ZINC001237682067 779160857 /nfs/dbraw/zinc/16/08/57/779160857.db2.gz WMCDBLSIYCAKSE-HZMBPMFUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](O)CC2)c1[O-] ZINC001237682067 779160861 /nfs/dbraw/zinc/16/08/61/779160861.db2.gz WMCDBLSIYCAKSE-HZMBPMFUSA-N 0 3 283.799 2.947 20 10 CFCDHN C[C@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(O)cc1[O-] ZINC001168458718 779187025 /nfs/dbraw/zinc/18/70/25/779187025.db2.gz INNXMUKZAQBUAU-LLVKDONJSA-N 0 3 275.323 2.958 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H](C)[C@@](C)(O)CC2)c1[O-] ZINC001238057815 779240646 /nfs/dbraw/zinc/24/06/46/779240646.db2.gz NVDKBYAEKBCRBO-LRDDRELGSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H](C)[C@@](C)(O)CC2)c1[O-] ZINC001238057815 779240650 /nfs/dbraw/zinc/24/06/50/779240650.db2.gz NVDKBYAEKBCRBO-LRDDRELGSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC001238058999 779241077 /nfs/dbraw/zinc/24/10/77/779241077.db2.gz XCKPSPDDOUFGPC-HNNXBMFYSA-N 0 3 267.344 2.577 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(O)CC2)c1[O-] ZINC001238058999 779241082 /nfs/dbraw/zinc/24/10/82/779241082.db2.gz XCKPSPDDOUFGPC-HNNXBMFYSA-N 0 3 267.344 2.577 20 10 CFCDHN COC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1[O-] ZINC001238065673 779244585 /nfs/dbraw/zinc/24/45/85/779244585.db2.gz XXTAEXZKSBADPE-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN COC[C@H]1CCCC[N@H+]1Cc1cc(F)cc(C)c1[O-] ZINC001238065673 779244588 /nfs/dbraw/zinc/24/45/88/779244588.db2.gz XXTAEXZKSBADPE-CQSZACIVSA-N 0 3 267.344 2.841 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]([NH3+])C[C@H](C)C2)cc1Cl ZINC001236050963 779449388 /nfs/dbraw/zinc/44/93/88/779449388.db2.gz VEIDVZJIZILJFC-JOYOIKCWSA-N 0 3 268.788 2.523 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@H](OC(C)C)C2)c1[O-] ZINC001238069640 779739273 /nfs/dbraw/zinc/73/92/73/779739273.db2.gz JRTKXZOKEIVBPV-AWEZNQCLSA-N 0 3 267.344 2.839 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@H](OC(C)C)C2)c1[O-] ZINC001238069640 779739275 /nfs/dbraw/zinc/73/92/75/779739275.db2.gz JRTKXZOKEIVBPV-AWEZNQCLSA-N 0 3 267.344 2.839 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H]1CCCC13CC3)OCO2 ZINC000706916293 781209444 /nfs/dbraw/zinc/20/94/44/781209444.db2.gz OZLHOLBYUFEHMT-CQSZACIVSA-N 0 3 261.321 2.543 20 10 CFCDHN [O-]c1c(F)cc(F)cc1C[NH2+]CCCN1CCCCC1 ZINC000708558896 781293942 /nfs/dbraw/zinc/29/39/42/781293942.db2.gz MZYLAYVLHLBPBL-UHFFFAOYSA-N 0 3 284.350 2.636 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H](O)C(F)F ZINC000295030252 199309444 /nfs/dbraw/zinc/30/94/44/199309444.db2.gz LOYDZMRIYVQWJY-JQWIXIFHSA-N 0 3 293.741 2.848 20 10 CFCDHN COC(=O)CCN(C)Cc1ccc(N2CCCCC2)cc1 ZINC000053420226 346546451 /nfs/dbraw/zinc/54/64/51/346546451.db2.gz DPRCHKAJBLITFK-UHFFFAOYSA-N 0 3 290.407 2.672 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])OCO2)C1Cc2ccccc2C1 ZINC000057104128 346619374 /nfs/dbraw/zinc/61/93/74/346619374.db2.gz JYBHVARRYUGAQT-UHFFFAOYSA-N 0 3 297.354 2.720 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])OCO2)C1Cc2ccccc2C1 ZINC000057104128 346619376 /nfs/dbraw/zinc/61/93/76/346619376.db2.gz JYBHVARRYUGAQT-UHFFFAOYSA-N 0 3 297.354 2.720 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](CCO)c1ccccc1 ZINC000077468223 347193898 /nfs/dbraw/zinc/19/38/98/347193898.db2.gz UMMOOCNEWQZPQL-OAHLLOKOSA-N 0 3 257.333 2.606 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000093482570 347676595 /nfs/dbraw/zinc/67/65/95/347676595.db2.gz XOMWIZZGERBZEH-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000093482570 347676597 /nfs/dbraw/zinc/67/65/97/347676597.db2.gz XOMWIZZGERBZEH-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N(C)C(C)C ZINC000175284308 283296929 /nfs/dbraw/zinc/29/69/29/283296929.db2.gz LQXJRHGDFUBKNN-AWEZNQCLSA-N 0 3 292.423 2.860 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N(C)C(C)C ZINC000175284308 283296932 /nfs/dbraw/zinc/29/69/32/283296932.db2.gz LQXJRHGDFUBKNN-AWEZNQCLSA-N 0 3 292.423 2.860 20 10 CFCDHN CC[C@@H]([NH2+]CCN(CC)CC)c1ccccc1[O-] ZINC000019919524 372209571 /nfs/dbraw/zinc/20/95/71/372209571.db2.gz CVALQUDIJSUCGD-CQSZACIVSA-N 0 3 250.386 2.775 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)Cn1ccnc1)c1ccccc1[O-] ZINC000037157344 372659503 /nfs/dbraw/zinc/65/95/03/372659503.db2.gz FWTUSJKDFUYDQE-OCCSQVGLSA-N 0 3 259.353 2.718 20 10 CFCDHN CC[C@H](C)NC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 ZINC000038014108 372768473 /nfs/dbraw/zinc/76/84/73/372768473.db2.gz RDRSAMTWXAOXCM-UONOGXRCSA-N 0 3 291.439 2.708 20 10 CFCDHN C[C@H]1CCCC[C@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879276 372963528 /nfs/dbraw/zinc/96/35/28/372963528.db2.gz XFNRBTYFQFULRZ-CMPLNLGQSA-N 0 3 263.337 2.789 20 10 CFCDHN C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879267 372963808 /nfs/dbraw/zinc/96/38/08/372963808.db2.gz XFNRBTYFQFULRZ-PWSUYJOCSA-N 0 3 263.337 2.789 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCc2ccncc2)c1 ZINC000048261744 373156424 /nfs/dbraw/zinc/15/64/24/373156424.db2.gz AAAGWRHADKWQNA-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(n3ccnc3)CC2)c1 ZINC000092648889 375135945 /nfs/dbraw/zinc/13/59/45/375135945.db2.gz FSBDVKVWTBLEOC-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN CCN(Cc1cnn(C)c1)Cc1cc(C)c(C)cc1O ZINC000092437816 375112612 /nfs/dbraw/zinc/11/26/12/375112612.db2.gz FNBXGPOHJYQDIU-UHFFFAOYSA-N 0 3 273.380 2.765 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CCc2nccs2)c1 ZINC000093844068 375323934 /nfs/dbraw/zinc/32/39/34/375323934.db2.gz JABNVOYMVHAQEP-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CCc2nccs2)c1 ZINC000093844068 375323943 /nfs/dbraw/zinc/32/39/43/375323943.db2.gz JABNVOYMVHAQEP-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(CC)(CO)CC2)c1[O-] ZINC000093591891 375270565 /nfs/dbraw/zinc/27/05/65/375270565.db2.gz UDZZTLAOWUMSNI-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN COC[C@@H]1CCC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000112960129 375978794 /nfs/dbraw/zinc/97/87/94/375978794.db2.gz MFMIEOAXOMZYMU-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN COC[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000112960129 375978800 /nfs/dbraw/zinc/97/88/00/375978800.db2.gz MFMIEOAXOMZYMU-CQSZACIVSA-N 0 3 263.381 2.867 20 10 CFCDHN Oc1ccccc1CN(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000123507874 376955183 /nfs/dbraw/zinc/95/51/83/376955183.db2.gz IQHWHXLNVMKXDZ-KRWDZBQOSA-N 0 3 298.386 2.968 20 10 CFCDHN COCC[N@@H+](Cc1cccc(C)c1[O-])CC(C)C ZINC000124543815 377060971 /nfs/dbraw/zinc/06/09/71/377060971.db2.gz NQJYPUAHKVZZDL-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN COCC[N@H+](Cc1cccc(C)c1[O-])CC(C)C ZINC000124543815 377060980 /nfs/dbraw/zinc/06/09/80/377060980.db2.gz NQJYPUAHKVZZDL-UHFFFAOYSA-N 0 3 251.370 2.805 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@@H+]1CC[C@@H](N2CCCC2)C1 ZINC000124583212 377065377 /nfs/dbraw/zinc/06/53/77/377065377.db2.gz BWBOPVZJGZMJHJ-CYBMUJFWSA-N 0 3 280.799 2.716 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@H+]1CC[C@@H](N2CCCC2)C1 ZINC000124583212 377065382 /nfs/dbraw/zinc/06/53/82/377065382.db2.gz BWBOPVZJGZMJHJ-CYBMUJFWSA-N 0 3 280.799 2.716 20 10 CFCDHN Cc1c([C@@H](C)NCc2cccc(C)c2O)cnn1C ZINC000124705581 377079659 /nfs/dbraw/zinc/07/96/59/377079659.db2.gz ZTQPIBXOSIYDSL-LLVKDONJSA-N 0 3 259.353 2.593 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CCS1 ZINC000131301157 377692361 /nfs/dbraw/zinc/69/23/61/377692361.db2.gz YBMSMVFNYZNVTK-GFCCVEGCSA-N 0 3 250.411 2.690 20 10 CFCDHN CCOc1cccc(CN2CCS[C@H](C)C2)c1O ZINC000131355197 377700392 /nfs/dbraw/zinc/70/03/92/377700392.db2.gz TZQAFJXVWUNDGL-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@@H](O)CN[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000179584808 380560893 /nfs/dbraw/zinc/56/08/93/380560893.db2.gz KENZEGXCAMIDMR-CHWSQXEVSA-N 0 3 280.387 2.847 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC(C)(O)CC2)cc1 ZINC000179727242 380574095 /nfs/dbraw/zinc/57/40/95/380574095.db2.gz SIFWKKFHJKMKBX-UHFFFAOYSA-N 0 3 276.424 2.880 20 10 CFCDHN CO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000179750139 380576788 /nfs/dbraw/zinc/57/67/88/380576788.db2.gz ATFRUQWFWGRDDE-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN CO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000179750139 380576790 /nfs/dbraw/zinc/57/67/90/380576790.db2.gz ATFRUQWFWGRDDE-CYBMUJFWSA-N 0 3 269.772 2.965 20 10 CFCDHN COc1ccc(O)c(C[N@H+](C)Cc2ccccc2[O-])c1 ZINC000179770518 380577688 /nfs/dbraw/zinc/57/76/88/380577688.db2.gz CYHGZRVBKFPJPE-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN COc1ccc(O)c(C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000179770518 380577696 /nfs/dbraw/zinc/57/76/96/380577696.db2.gz CYHGZRVBKFPJPE-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN Cc1noc(C2CC[NH+](Cc3cccc(C)c3[O-])CC2)n1 ZINC000179756103 380578612 /nfs/dbraw/zinc/57/86/12/380578612.db2.gz WJOFRXHLBLHZNB-UHFFFAOYSA-N 0 3 287.363 2.772 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000180204058 380632388 /nfs/dbraw/zinc/63/23/88/380632388.db2.gz VEFZZXFRMQAIOV-CQSZACIVSA-N 0 3 292.398 2.839 20 10 CFCDHN CC[C@H]1CN(Cc2cc(OC)ccc2O)CCS1 ZINC000180312600 380644948 /nfs/dbraw/zinc/64/49/48/380644948.db2.gz IXKGNQGVURNZJA-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2cc(OC)ccc2[O-])CCS1 ZINC000180312600 380644957 /nfs/dbraw/zinc/64/49/57/380644957.db2.gz IXKGNQGVURNZJA-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2cc(OC)ccc2[O-])CCS1 ZINC000180312600 380644963 /nfs/dbraw/zinc/64/49/63/380644963.db2.gz IXKGNQGVURNZJA-ZDUSSCGKSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1noc(C)c1CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000179882148 380591599 /nfs/dbraw/zinc/59/15/99/380591599.db2.gz NVQIEYIHBNWSAA-JTQLQIEISA-N 0 3 260.337 2.890 20 10 CFCDHN CC(C)(C)C[N@H+](CCCO)Cc1cc(F)ccc1[O-] ZINC000180088432 380618554 /nfs/dbraw/zinc/61/85/54/380618554.db2.gz LPWIXZJELICWTH-UHFFFAOYSA-N 0 3 269.360 2.762 20 10 CFCDHN CC(C)(C)C[N@@H+](CCCO)Cc1cc(F)ccc1[O-] ZINC000180088432 380618559 /nfs/dbraw/zinc/61/85/59/380618559.db2.gz LPWIXZJELICWTH-UHFFFAOYSA-N 0 3 269.360 2.762 20 10 CFCDHN C[C@@H]1SCC[N@H+](Cc2cc(F)ccc2[O-])[C@H]1C ZINC000180172057 380628578 /nfs/dbraw/zinc/62/85/78/380628578.db2.gz JIDDVCDTGLJGEY-UWVGGRQHSA-N 0 3 255.358 2.857 20 10 CFCDHN C[C@@H]1SCC[N@@H+](Cc2cc(F)ccc2[O-])[C@H]1C ZINC000180172057 380628584 /nfs/dbraw/zinc/62/85/84/380628584.db2.gz JIDDVCDTGLJGEY-UWVGGRQHSA-N 0 3 255.358 2.857 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCC(=O)OC(C)(C)C)c1[O-] ZINC000180479124 380666613 /nfs/dbraw/zinc/66/66/13/380666613.db2.gz WGMGFFDHSJYSMC-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCC(=O)OC(C)(C)C)c1[O-] ZINC000180479124 380666618 /nfs/dbraw/zinc/66/66/18/380666618.db2.gz WGMGFFDHSJYSMC-UHFFFAOYSA-N 0 3 279.380 2.864 20 10 CFCDHN CC1(C)C[C@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000180890446 380710447 /nfs/dbraw/zinc/71/04/47/380710447.db2.gz JCULEOAVADSCJQ-GFCCVEGCSA-N 0 3 253.317 2.579 20 10 CFCDHN CC1(C)C[C@H]([NH2+]Cc2cc(F)ccc2[O-])C(C)(C)O1 ZINC000181054449 380730062 /nfs/dbraw/zinc/73/00/62/380730062.db2.gz QFEICTHLKVJKHF-ZDUSSCGKSA-N 0 3 267.344 2.967 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1COC2(CCCCCC2)O1 ZINC000181096381 380738093 /nfs/dbraw/zinc/73/80/93/380738093.db2.gz POKLPHNYGNIXBC-HNNXBMFYSA-N 0 3 291.391 2.948 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOC[C@H]1CCOC ZINC000368270295 380977996 /nfs/dbraw/zinc/97/79/96/380977996.db2.gz VESOARYNCMRQRW-HIFRSBDPSA-N 0 3 279.380 2.581 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOC[C@H]1CCOC ZINC000368270295 380977999 /nfs/dbraw/zinc/97/79/99/380977999.db2.gz VESOARYNCMRQRW-HIFRSBDPSA-N 0 3 279.380 2.581 20 10 CFCDHN C[C@@H]1Oc2ccccc2[C@H]1NCc1cc2c(cc1O)OCO2 ZINC000288623869 381017796 /nfs/dbraw/zinc/01/77/96/381017796.db2.gz RYJMJUPBSAVYCO-BTDLBPIBSA-N 0 3 299.326 2.733 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCc2cccc(C)n2)c1 ZINC000289114147 381024575 /nfs/dbraw/zinc/02/45/75/381024575.db2.gz CYQCXQHJDPJLPJ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H]2COc3ccccc32)c1[O-] ZINC000289223800 381029017 /nfs/dbraw/zinc/02/90/17/381029017.db2.gz AGAVPFAPDHUBID-AWEZNQCLSA-N 0 3 269.344 2.966 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2c(C)noc2C)c1 ZINC000182358167 381073011 /nfs/dbraw/zinc/07/30/11/381073011.db2.gz AULFYAKRWCECEI-SNVBAGLBSA-N 0 3 290.363 2.899 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@H](O)C1 ZINC000182995062 381194845 /nfs/dbraw/zinc/19/48/45/381194845.db2.gz OOYVNMASJXRXAN-INIZCTEOSA-N 0 3 299.370 2.538 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[N@@H+]1CC[C@H](O)C1 ZINC000182995062 381194853 /nfs/dbraw/zinc/19/48/53/381194853.db2.gz OOYVNMASJXRXAN-INIZCTEOSA-N 0 3 299.370 2.538 20 10 CFCDHN CC[C@H]([NH2+]Cc1cccc(C(=O)NC)c1)c1ccccc1[O-] ZINC000183345292 381258075 /nfs/dbraw/zinc/25/80/75/381258075.db2.gz XYFFZTVZGYLEJV-INIZCTEOSA-N 0 3 298.386 2.993 20 10 CFCDHN CC[C@H]([NH2+]CCCCCCO)c1ccccc1[O-] ZINC000183350007 381260296 /nfs/dbraw/zinc/26/02/96/381260296.db2.gz SNWSAGSPVLTKOW-AWEZNQCLSA-N 0 3 251.370 2.986 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296132440 381268560 /nfs/dbraw/zinc/26/85/60/381268560.db2.gz VVAXLIQVVLQVRT-AWEZNQCLSA-N 0 3 271.364 2.564 20 10 CFCDHN CN(C)[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000296048518 381229328 /nfs/dbraw/zinc/22/93/28/381229328.db2.gz RABHESISDNGVDE-KBPBESRZSA-N 0 3 286.375 2.865 20 10 CFCDHN COc1cc(C[NH2+][C@@H]2CCc3cccc([O-])c32)ccn1 ZINC000296066643 381239631 /nfs/dbraw/zinc/23/96/31/381239631.db2.gz RXQKJXZAXLZKQU-CYBMUJFWSA-N 0 3 270.332 2.573 20 10 CFCDHN COc1ccccc1[C@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183436260 381272358 /nfs/dbraw/zinc/27/23/58/381272358.db2.gz AGQIBNCQEWRLKN-BLLLJJGKSA-N 0 3 287.359 2.785 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(CO)c(F)c1)c1ccccc1[O-] ZINC000183443203 381273355 /nfs/dbraw/zinc/27/33/55/381273355.db2.gz UKFSMKWDITWZMF-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccccc1[O-] ZINC000183487376 381277310 /nfs/dbraw/zinc/27/73/10/381277310.db2.gz DKQVDWWUYIFLOJ-BLLLJJGKSA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccccc1[O-] ZINC000183527781 381283737 /nfs/dbraw/zinc/28/37/37/381283737.db2.gz WWIQGAKHDRGSPO-WCUVEOEZSA-N 0 3 261.365 2.856 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000296393571 381376046 /nfs/dbraw/zinc/37/60/46/381376046.db2.gz JZDOWZXJSVEMFT-IRXDYDNUSA-N 0 3 297.398 2.881 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)CCc1ccccc1)CC2 ZINC000296515757 381430261 /nfs/dbraw/zinc/43/02/61/381430261.db2.gz QSIFBPAJMBGGPI-SJORKVTESA-N 0 3 297.398 2.963 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)CCc1ccccc1)CC2 ZINC000296515746 381430374 /nfs/dbraw/zinc/43/03/74/381430374.db2.gz QSIFBPAJMBGGPI-IAGOWNOFSA-N 0 3 297.398 2.963 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC[C@@H]([NH+](C)C)C2)c1[O-] ZINC000184687207 381460758 /nfs/dbraw/zinc/46/07/58/381460758.db2.gz XSEKTAJQUYGGRX-CYBMUJFWSA-N 0 3 298.814 2.580 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCN(c3ccccn3)C1)CC2 ZINC000297144860 381553424 /nfs/dbraw/zinc/55/34/24/381553424.db2.gz ZRLPZHHHYPYUFT-HUUCEWRRSA-N 0 3 295.386 2.643 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](CCO)C(C)(C)C)c1 ZINC000185196578 381561484 /nfs/dbraw/zinc/56/14/84/381561484.db2.gz VKCKBGFNWTZPGJ-IAQYHMDHSA-N 0 3 281.396 2.849 20 10 CFCDHN COc1ccc(O)c(CN2CC(COc3ccccc3)C2)c1 ZINC000297489277 381562568 /nfs/dbraw/zinc/56/25/68/381562568.db2.gz UXZCIJUERGHHDC-UHFFFAOYSA-N 0 3 299.370 2.912 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297562427 381565007 /nfs/dbraw/zinc/56/50/07/381565007.db2.gz GFQNAGKOCNUJNS-IUODEOHRSA-N 0 3 285.391 2.810 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccc(O)c2)c1 ZINC000185300126 381589549 /nfs/dbraw/zinc/58/95/49/381589549.db2.gz QVTJZSSTRAIEAP-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185483250 381647949 /nfs/dbraw/zinc/64/79/49/381647949.db2.gz PRMRVHNJUYCVGZ-JQWIXIFHSA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c([O-])c1 ZINC000185475574 381643844 /nfs/dbraw/zinc/64/38/44/381643844.db2.gz YFWSAZNZXRZESX-HXPMCKFVSA-N 0 3 283.437 2.898 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCCC[C@@H]1Cn1cccn1 ZINC000371529770 381651110 /nfs/dbraw/zinc/65/11/10/381651110.db2.gz UYURRLKYQFGPBV-OAHLLOKOSA-N 0 3 271.364 2.643 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCCC[C@@H]1Cn1cccn1 ZINC000371529770 381651117 /nfs/dbraw/zinc/65/11/17/381651117.db2.gz UYURRLKYQFGPBV-OAHLLOKOSA-N 0 3 271.364 2.643 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)CCO)c1 ZINC000185608692 381681722 /nfs/dbraw/zinc/68/17/22/381681722.db2.gz VHXZXPCUPVIMLO-LBPRGKRZSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672013 381699292 /nfs/dbraw/zinc/69/92/92/381699292.db2.gz JULNFZHBOKVGFW-MELADBBJSA-N 0 3 274.408 2.976 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672173 381699458 /nfs/dbraw/zinc/69/94/58/381699458.db2.gz GYXVUFZSAMXEHD-AVGNSLFASA-N 0 3 290.407 2.677 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H]2c3ccccc3C[C@@H]2O)c1 ZINC000185674433 381701087 /nfs/dbraw/zinc/70/10/87/381701087.db2.gz MYRQYUSMWNDKJE-VQTKTOELSA-N 0 3 299.370 2.710 20 10 CFCDHN C/C=C/C[C@@H](CO)NCc1ccc(OC)c(COCC)c1 ZINC000185810696 381739412 /nfs/dbraw/zinc/73/94/12/381739412.db2.gz KIZKWYFVAAEPHL-NBUZRDOWSA-N 0 3 293.407 2.648 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c1 ZINC000185736025 381719655 /nfs/dbraw/zinc/71/96/55/381719655.db2.gz MMIYNRXJHBUQBX-RWMBFGLXSA-N 0 3 279.380 2.603 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCc2cccc(C(N)=O)c2)c1 ZINC000185983352 381795316 /nfs/dbraw/zinc/79/53/16/381795316.db2.gz GTLSFIBWCZOVQY-ZDUSSCGKSA-N 0 3 298.386 2.693 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCNC(=O)C2CCC2)c([O-])c1 ZINC000186091984 381821827 /nfs/dbraw/zinc/82/18/27/381821827.db2.gz WFVPBCIBGSWYJG-ZDUSSCGKSA-N 0 3 290.407 2.658 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000186143979 381833994 /nfs/dbraw/zinc/83/39/94/381833994.db2.gz JCKUZXRROMQVJR-ZYHUDNBSSA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1ccc(O)c([C@H](C)NCCS(=O)(=O)C(C)(C)C)c1 ZINC000186027657 381806441 /nfs/dbraw/zinc/80/64/41/381806441.db2.gz LOFFNXKHOLUBPY-LBPRGKRZSA-N 0 3 299.436 2.565 20 10 CFCDHN C[C@@H]([NH2+]CCCOC1CCOCC1)c1cc(F)ccc1[O-] ZINC000186074694 381818670 /nfs/dbraw/zinc/81/86/70/381818670.db2.gz VNPCHBPEQMWMFC-GFCCVEGCSA-N 0 3 297.370 2.768 20 10 CFCDHN C[NH+](C)[C@H]1CCCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000372969717 381898985 /nfs/dbraw/zinc/89/89/85/381898985.db2.gz ZAINERQZEFBMSJ-ZDUSSCGKSA-N 0 3 282.815 2.962 20 10 CFCDHN CN(C)[C@H]1CCC[N@H+](Cc2cccc(Cl)c2[O-])CC1 ZINC000372969717 381898991 /nfs/dbraw/zinc/89/89/91/381898991.db2.gz ZAINERQZEFBMSJ-ZDUSSCGKSA-N 0 3 282.815 2.962 20 10 CFCDHN CN(C)[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2[O-])CC1 ZINC000372969717 381898999 /nfs/dbraw/zinc/89/89/99/381898999.db2.gz ZAINERQZEFBMSJ-ZDUSSCGKSA-N 0 3 282.815 2.962 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@@H](CC)c2ccccc2[O-])C1 ZINC000186424523 381906997 /nfs/dbraw/zinc/90/69/97/381906997.db2.gz VKSCDHSRDCXONR-OCCSQVGLSA-N 0 3 292.379 2.664 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@H](CC)c2ccccc2[O-])C1 ZINC000186424540 381907774 /nfs/dbraw/zinc/90/77/74/381907774.db2.gz VKSCDHSRDCXONR-TZMCWYRMSA-N 0 3 292.379 2.664 20 10 CFCDHN Cc1cnn(C2CC[NH+](Cc3ccccc3[O-])CC2)c1 ZINC000373238707 381958017 /nfs/dbraw/zinc/95/80/17/381958017.db2.gz FQTWYCPKDJLYMH-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000186531253 381939548 /nfs/dbraw/zinc/93/95/48/381939548.db2.gz DCXATLDSTZFJBU-ITDFMYJTSA-N 0 3 269.772 2.771 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000373223650 381952760 /nfs/dbraw/zinc/95/27/60/381952760.db2.gz KDJZABBNQBPOJP-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000373223650 381952769 /nfs/dbraw/zinc/95/27/69/381952769.db2.gz KDJZABBNQBPOJP-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968637 382112790 /nfs/dbraw/zinc/11/27/90/382112790.db2.gz NGZVINRBWHRKHQ-QJPTWQEYSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968637 382112798 /nfs/dbraw/zinc/11/27/98/382112798.db2.gz NGZVINRBWHRKHQ-QJPTWQEYSA-N 0 3 296.361 2.948 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)c1ccc(F)c(F)c1[O-] ZINC000375968637 382112804 /nfs/dbraw/zinc/11/28/04/382112804.db2.gz NGZVINRBWHRKHQ-QJPTWQEYSA-N 0 3 296.361 2.948 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@@]23CCOC3)cc1C ZINC000375311562 382078915 /nfs/dbraw/zinc/07/89/15/382078915.db2.gz VNXQBURHBCHCJK-INIZCTEOSA-N 0 3 261.365 2.764 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@@]23CCOC3)cc1C ZINC000375311562 382078927 /nfs/dbraw/zinc/07/89/27/382078927.db2.gz VNXQBURHBCHCJK-INIZCTEOSA-N 0 3 261.365 2.764 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000293693173 382236997 /nfs/dbraw/zinc/23/69/97/382236997.db2.gz LHGNBYRASCWXPY-NEPJUHHUSA-N 0 3 296.386 2.734 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H](C)CO ZINC000293650209 382215245 /nfs/dbraw/zinc/21/52/45/382215245.db2.gz MXGBLYFSFORORT-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@@H](C)CO ZINC000293650209 382215250 /nfs/dbraw/zinc/21/52/50/382215250.db2.gz MXGBLYFSFORORT-JTQLQIEISA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](O)C23CCCC3)c1 ZINC000293808396 382287997 /nfs/dbraw/zinc/28/79/97/382287997.db2.gz DUHACRYRECVKNO-OAHLLOKOSA-N 0 3 261.365 2.580 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](O)C23CCCC3)c1 ZINC000293808396 382288005 /nfs/dbraw/zinc/28/80/05/382288005.db2.gz DUHACRYRECVKNO-OAHLLOKOSA-N 0 3 261.365 2.580 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](n3cncn3)C2)cc1 ZINC000377282379 382247761 /nfs/dbraw/zinc/24/77/61/382247761.db2.gz FAFHBHROYJNCRT-QGZVFWFLSA-N 0 3 299.422 2.571 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@]3(C2)CCCN(C)C3)c1 ZINC000293748123 382263005 /nfs/dbraw/zinc/26/30/05/382263005.db2.gz WOWQXTIZLLFMQO-QGZVFWFLSA-N 0 3 274.408 2.618 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@]3(C2)CCCN(C)C3)c1 ZINC000293748123 382263008 /nfs/dbraw/zinc/26/30/08/382263008.db2.gz WOWQXTIZLLFMQO-QGZVFWFLSA-N 0 3 274.408 2.618 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCC[C@@H]2CCO)c1 ZINC000188009403 382324211 /nfs/dbraw/zinc/32/42/11/382324211.db2.gz DVGGBEWPGPXISH-JMSVASOKSA-N 0 3 279.380 2.603 20 10 CFCDHN COc1ccc(O)c(CN[C@@H]2C[C@@H](CO)c3ccccc32)c1 ZINC000364540421 382324809 /nfs/dbraw/zinc/32/48/09/382324809.db2.gz CVMBGASOLCTHSD-SUMWQHHRSA-N 0 3 299.370 2.711 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2C[C@@H](CO)c3ccccc32)c1 ZINC000364540421 382324812 /nfs/dbraw/zinc/32/48/12/382324812.db2.gz CVMBGASOLCTHSD-SUMWQHHRSA-N 0 3 299.370 2.711 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000188121121 382349544 /nfs/dbraw/zinc/34/95/44/382349544.db2.gz YDTSTUYRRTUXEM-NWDGAFQWSA-N 0 3 263.381 2.957 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000294028625 382385168 /nfs/dbraw/zinc/38/51/68/382385168.db2.gz NZEITIPESXFYJL-IAGOWNOFSA-N 0 3 273.376 2.844 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](C)[C@H](OC)C2)c1 ZINC000188333490 382395431 /nfs/dbraw/zinc/39/54/31/382395431.db2.gz AMPNXSAAYIDURQ-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](C)[C@H](OC)C2)c1 ZINC000188333490 382395433 /nfs/dbraw/zinc/39/54/33/382395433.db2.gz AMPNXSAAYIDURQ-MLGOLLRUSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@H](O)Cc2ccccc2)c1[O-] ZINC000293941232 382346579 /nfs/dbraw/zinc/34/65/79/382346579.db2.gz OGXMRQWBVGSYLR-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c1[O-] ZINC000293941232 382346582 /nfs/dbraw/zinc/34/65/82/382346582.db2.gz OGXMRQWBVGSYLR-QGZVFWFLSA-N 0 3 285.387 2.736 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c1[O-] ZINC000378333369 382438920 /nfs/dbraw/zinc/43/89/20/382438920.db2.gz LEUWEWOFCJRTLD-CYBMUJFWSA-N 0 3 299.374 2.570 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1[O-] ZINC000378333369 382438924 /nfs/dbraw/zinc/43/89/24/382438924.db2.gz LEUWEWOFCJRTLD-CYBMUJFWSA-N 0 3 299.374 2.570 20 10 CFCDHN COC[C@@]1(C)CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000294175067 382445939 /nfs/dbraw/zinc/44/59/39/382445939.db2.gz JROTYKYXDKNGPC-HNNXBMFYSA-N 0 3 299.798 2.913 20 10 CFCDHN COC[C@@]1(C)CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000294175067 382445945 /nfs/dbraw/zinc/44/59/45/382445945.db2.gz JROTYKYXDKNGPC-HNNXBMFYSA-N 0 3 299.798 2.913 20 10 CFCDHN [O-]c1ccc(Cl)cc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000378164144 382410464 /nfs/dbraw/zinc/41/04/64/382410464.db2.gz KXPKIVSKGPVLMS-LBPRGKRZSA-N 0 3 277.755 2.936 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000378371894 382449718 /nfs/dbraw/zinc/44/97/18/382449718.db2.gz AIBBFVNHBRACCI-CFVMTHIKSA-N 0 3 261.365 2.638 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000378371894 382449725 /nfs/dbraw/zinc/44/97/25/382449725.db2.gz AIBBFVNHBRACCI-CFVMTHIKSA-N 0 3 261.365 2.638 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c1[O-] ZINC000378439870 382460761 /nfs/dbraw/zinc/46/07/61/382460761.db2.gz WJOLJISQVOFBPR-AWEZNQCLSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1[O-] ZINC000378439870 382460765 /nfs/dbraw/zinc/46/07/65/382460765.db2.gz WJOLJISQVOFBPR-AWEZNQCLSA-N 0 3 283.375 2.870 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000294223467 382466903 /nfs/dbraw/zinc/46/69/03/382466903.db2.gz LZZYSVKYFMOKOC-ZIAGYGMSSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000294223467 382466904 /nfs/dbraw/zinc/46/69/04/382466904.db2.gz LZZYSVKYFMOKOC-ZIAGYGMSSA-N 0 3 298.789 2.901 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000378499015 382474647 /nfs/dbraw/zinc/47/46/47/382474647.db2.gz SSJXITOTUNJKOL-BPLDGKMQSA-N 0 3 279.355 2.777 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000378499015 382474650 /nfs/dbraw/zinc/47/46/50/382474650.db2.gz SSJXITOTUNJKOL-BPLDGKMQSA-N 0 3 279.355 2.777 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c1 ZINC000367028874 382556422 /nfs/dbraw/zinc/55/64/22/382556422.db2.gz XQTFDTWAJOSQMF-ZDUSSCGKSA-N 0 3 299.374 2.951 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c1 ZINC000367028874 382556427 /nfs/dbraw/zinc/55/64/27/382556427.db2.gz XQTFDTWAJOSQMF-ZDUSSCGKSA-N 0 3 299.374 2.951 20 10 CFCDHN CC[C@H](COCC(F)(F)F)[NH2+]Cc1cc(F)ccc1[O-] ZINC000295208210 382584924 /nfs/dbraw/zinc/58/49/24/382584924.db2.gz ZRNBSDBDIOTVBP-LLVKDONJSA-N 0 3 295.276 2.978 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)cc1C ZINC000295211785 382586270 /nfs/dbraw/zinc/58/62/70/382586270.db2.gz LSUUUGHOQIPDKY-OAHLLOKOSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)cc1C ZINC000295211785 382586273 /nfs/dbraw/zinc/58/62/73/382586273.db2.gz LSUUUGHOQIPDKY-OAHLLOKOSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)OC(C)(C)C2)c1 ZINC000189658691 382633081 /nfs/dbraw/zinc/63/30/81/382633081.db2.gz BNFDVZLCULAPGO-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](SC)C2)c1 ZINC000295141640 382578198 /nfs/dbraw/zinc/57/81/98/382578198.db2.gz ZSPLAALMFWSSSS-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](SC)C2)c1 ZINC000295141640 382578202 /nfs/dbraw/zinc/57/82/02/382578202.db2.gz ZSPLAALMFWSSSS-CYBMUJFWSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@@H+]2CCS[C@H](C)CC2)c1[O-] ZINC000190694618 382678245 /nfs/dbraw/zinc/67/82/45/382678245.db2.gz ILWDELQTGPZPHJ-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCS[C@H](C)CC2)c1[O-] ZINC000190694618 382678246 /nfs/dbraw/zinc/67/82/46/382678246.db2.gz ILWDELQTGPZPHJ-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CCO)C(C)C)c1 ZINC000230664126 382861619 /nfs/dbraw/zinc/86/16/19/382861619.db2.gz DWMVYDPZGUSVEL-JSGCOSHPSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)[C@H]2CCCO2)c1 ZINC000248528774 383253564 /nfs/dbraw/zinc/25/35/64/383253564.db2.gz JSWAZCLCWIIPLE-ZIBATOQPSA-N 0 3 265.353 2.619 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c([O-])c1 ZINC000249465973 383346787 /nfs/dbraw/zinc/34/67/87/383346787.db2.gz GQUDZUUJLLSUFU-UXLLHSPISA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc(O)c(CNc2ccc3c(c2)OCCNC3)c1 ZINC000530182041 383767657 /nfs/dbraw/zinc/76/76/57/383767657.db2.gz QLXFWRVLMJMWJM-UHFFFAOYSA-N 0 3 284.359 2.795 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+]C12CCC2)c1ccc(F)cc1[O-] ZINC000530215904 383768765 /nfs/dbraw/zinc/76/87/65/383768765.db2.gz KDGVPNIYRWGAQJ-UKRRQHHQSA-N 0 3 278.371 2.857 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCNC12CCC2)c1ccc(F)cc1[O-] ZINC000530215904 383768768 /nfs/dbraw/zinc/76/87/68/383768768.db2.gz KDGVPNIYRWGAQJ-UKRRQHHQSA-N 0 3 278.371 2.857 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCc2nccs2)c1[O-] ZINC000265655655 383969850 /nfs/dbraw/zinc/96/98/50/383969850.db2.gz YLGDVADOXTWJFR-UHFFFAOYSA-N 0 3 292.404 2.970 20 10 CFCDHN Cc1cc(O)c(CN[C@H]2CCCc3c[nH]nc32)cc1C ZINC000268850648 384676024 /nfs/dbraw/zinc/67/60/24/384676024.db2.gz POADJFHGZMRVAF-AWEZNQCLSA-N 0 3 271.364 2.899 20 10 CFCDHN CC(C)[C@@H](C(=O)NCc1ccccc1O)N1CCCCC1 ZINC000269145213 384729727 /nfs/dbraw/zinc/72/97/27/384729727.db2.gz NVEAIBVYIGWMLV-INIZCTEOSA-N 0 3 290.407 2.519 20 10 CFCDHN Cn1cccc1CNCc1ccc2c(c1)CCCN2C ZINC000118942013 412994612 /nfs/dbraw/zinc/99/46/12/412994612.db2.gz ZJFNYGQBOPQBKG-UHFFFAOYSA-N 0 3 269.392 2.697 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CCCSC)c1 ZINC000281117780 385184825 /nfs/dbraw/zinc/18/48/25/385184825.db2.gz BVZIGCAVFNHXOA-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CCCSC)c1 ZINC000281117780 385184830 /nfs/dbraw/zinc/18/48/30/385184830.db2.gz BVZIGCAVFNHXOA-UHFFFAOYSA-N 0 3 269.410 2.976 20 10 CFCDHN CO[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 ZINC000282123058 385218598 /nfs/dbraw/zinc/21/85/98/385218598.db2.gz AYCKHJATAJYONJ-GXTWGEPZSA-N 0 3 280.387 2.891 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1cc(F)ccc1[O-] ZINC000282279413 385268497 /nfs/dbraw/zinc/26/84/97/385268497.db2.gz BBZUIWWJXBJTGH-IINYFYTJSA-N 0 3 289.354 2.993 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c1[O-] ZINC000282367601 385295390 /nfs/dbraw/zinc/29/53/90/385295390.db2.gz QCVKUIVTXUMPOX-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](OC)C[C@H]2C)c1[O-] ZINC000282367601 385295393 /nfs/dbraw/zinc/29/53/93/385295393.db2.gz QCVKUIVTXUMPOX-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1cccc(C)c1[O-] ZINC000271709500 385389063 /nfs/dbraw/zinc/38/90/63/385389063.db2.gz AKWVPPZJDCRROU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1cccc(C)c1[O-] ZINC000271709500 385389067 /nfs/dbraw/zinc/38/90/67/385389067.db2.gz AKWVPPZJDCRROU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000271715249 385389079 /nfs/dbraw/zinc/38/90/79/385389079.db2.gz WPGMXBLTTUXXSX-LBPRGKRZSA-N 0 3 259.353 2.638 20 10 CFCDHN CCC1(O)CCN(Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000271169065 385360501 /nfs/dbraw/zinc/36/05/01/385360501.db2.gz DCSMXIYRJOYVKI-UHFFFAOYSA-N 0 3 280.387 2.629 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(O)(CC)CC2)c1[O-] ZINC000271220475 385377303 /nfs/dbraw/zinc/37/73/03/385377303.db2.gz YSKKDIVFJBFRIS-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2cnn(C)c2)ccc1N(C)C ZINC000271542982 385385611 /nfs/dbraw/zinc/38/56/11/385385611.db2.gz UQAWHTMMCGOZLU-ZDUSSCGKSA-N 0 3 272.396 2.645 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(O)CCc3ccccc32)c1[O-] ZINC000271786699 385392679 /nfs/dbraw/zinc/39/26/79/385392679.db2.gz FQXZHRDJGCUDTA-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@](C)(O)c2ccccc2)c1[O-] ZINC000271815814 385393404 /nfs/dbraw/zinc/39/34/04/385393404.db2.gz LYZPLQQXKGFPKT-KRWDZBQOSA-N 0 3 271.360 2.698 20 10 CFCDHN CCCC[N@H+](CCc1ccnn1C)Cc1ccccc1[O-] ZINC000282950014 385414568 /nfs/dbraw/zinc/41/45/68/385414568.db2.gz DAUKZCCLIWKIJQ-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN CCCC[N@@H+](CCc1ccnn1C)Cc1ccccc1[O-] ZINC000282950014 385414573 /nfs/dbraw/zinc/41/45/73/385414573.db2.gz DAUKZCCLIWKIJQ-UHFFFAOYSA-N 0 3 287.407 2.971 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H](O)c1cccc(F)c1 ZINC000272239336 385484748 /nfs/dbraw/zinc/48/47/48/385484748.db2.gz AJZOTPNQNWZXLJ-HWPZZCPQSA-N 0 3 293.313 2.882 20 10 CFCDHN CCC[N@H+](Cc1cc(F)ccc1[O-])CC(C)(C)O ZINC000272332563 385512523 /nfs/dbraw/zinc/51/25/23/385512523.db2.gz WTLNSBSLXXPIMM-UHFFFAOYSA-N 0 3 255.333 2.514 20 10 CFCDHN CCC[N@@H+](Cc1cc(F)ccc1[O-])CC(C)(C)O ZINC000272332563 385512527 /nfs/dbraw/zinc/51/25/27/385512527.db2.gz WTLNSBSLXXPIMM-UHFFFAOYSA-N 0 3 255.333 2.514 20 10 CFCDHN CCOCc1cc(CNC2(COC)CCC2)ccc1OC ZINC000283912915 385512586 /nfs/dbraw/zinc/51/25/86/385512586.db2.gz IHSGINLXYWOLRP-UHFFFAOYSA-N 0 3 293.407 2.890 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284301643 385547788 /nfs/dbraw/zinc/54/77/88/385547788.db2.gz BPKUHTSWIVBOIC-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000284301643 385547792 /nfs/dbraw/zinc/54/77/92/385547792.db2.gz BPKUHTSWIVBOIC-NVXWUHKLSA-N 0 3 291.391 2.934 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000285003883 385551628 /nfs/dbraw/zinc/55/16/28/385551628.db2.gz GXSINURAIKUWFK-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000285236368 385552847 /nfs/dbraw/zinc/55/28/47/385552847.db2.gz SIKFZEGDUHUGKK-DZGCQCFKSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000285236368 385552850 /nfs/dbraw/zinc/55/28/50/385552850.db2.gz SIKFZEGDUHUGKK-DZGCQCFKSA-N 0 3 265.328 2.675 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])C1 ZINC000285336363 385554024 /nfs/dbraw/zinc/55/40/24/385554024.db2.gz UOAAORYMAOBZMG-UONOGXRCSA-N 0 3 290.407 2.671 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2([S@@](C)=O)CC2)c([O-])c1 ZINC000285298390 385554618 /nfs/dbraw/zinc/55/46/18/385554618.db2.gz RXSAPPWXEMBWIE-CWTRNNRKSA-N 0 3 281.421 2.571 20 10 CFCDHN COc1cccc(C[NH2+]CCCc2cccc(C)n2)c1[O-] ZINC000285473852 385555286 /nfs/dbraw/zinc/55/52/86/385555286.db2.gz HPPVCTRFZIETRD-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000272683485 385588714 /nfs/dbraw/zinc/58/87/14/385588714.db2.gz VVPSSNXOTRTXMT-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000272683485 385588717 /nfs/dbraw/zinc/58/87/17/385588717.db2.gz VVPSSNXOTRTXMT-DZGCQCFKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273179990 385672997 /nfs/dbraw/zinc/67/29/97/385672997.db2.gz OBRRGFJALDFZGH-KBPBESRZSA-N 0 3 263.381 2.995 20 10 CFCDHN C[C@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000273175469 385673461 /nfs/dbraw/zinc/67/34/61/385673461.db2.gz NBXVTJQJSOSDMC-RYUDHWBXSA-N 0 3 267.344 2.826 20 10 CFCDHN CCn1cc(CN[C@@H](C)c2cc(C)ccc2O)cn1 ZINC000273354507 385679459 /nfs/dbraw/zinc/67/94/59/385679459.db2.gz CJPRWQKUCFAKJQ-LBPRGKRZSA-N 0 3 259.353 2.768 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]Cc2cccn2C)c1 ZINC000273364328 385679533 /nfs/dbraw/zinc/67/95/33/385679533.db2.gz BDXMIIRWERUKNI-LLVKDONJSA-N 0 3 260.337 2.590 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccn2C)c1 ZINC000273364328 385679535 /nfs/dbraw/zinc/67/95/35/385679535.db2.gz BDXMIIRWERUKNI-LLVKDONJSA-N 0 3 260.337 2.590 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000273442744 385682745 /nfs/dbraw/zinc/68/27/45/385682745.db2.gz WSIHPRARTVVGJH-UONOGXRCSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1[O-] ZINC000273442744 385682749 /nfs/dbraw/zinc/68/27/49/385682749.db2.gz WSIHPRARTVVGJH-UONOGXRCSA-N 0 3 293.407 2.630 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000273540943 385687667 /nfs/dbraw/zinc/68/76/67/385687667.db2.gz YICZVWPQUQSROK-CKYFFXLPSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 ZINC000372397401 393448338 /nfs/dbraw/zinc/44/83/38/393448338.db2.gz DGHXRAJXZAKDFM-NUEKZKHPSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 ZINC000372397401 393448343 /nfs/dbraw/zinc/44/83/43/393448343.db2.gz DGHXRAJXZAKDFM-NUEKZKHPSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000372434981 393449455 /nfs/dbraw/zinc/44/94/55/393449455.db2.gz HFACYQIQIVLHHE-AWEZNQCLSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000372434981 393449461 /nfs/dbraw/zinc/44/94/61/393449461.db2.gz HFACYQIQIVLHHE-AWEZNQCLSA-N 0 3 283.375 2.870 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374095461 393482747 /nfs/dbraw/zinc/48/27/47/393482747.db2.gz SYEFOOJLGQFIAK-GDBMZVCRSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374095461 393482749 /nfs/dbraw/zinc/48/27/49/393482749.db2.gz SYEFOOJLGQFIAK-GDBMZVCRSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOc1ccc(O)c(CN2CCSC[C@H]2C)c1 ZINC000179665240 393469148 /nfs/dbraw/zinc/46/91/48/393469148.db2.gz NRKLZMLAJLYEAS-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000374253853 393489085 /nfs/dbraw/zinc/48/90/85/393489085.db2.gz KKRVVMKWOGHIQM-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1 ZINC000374253853 393489090 /nfs/dbraw/zinc/48/90/90/393489090.db2.gz KKRVVMKWOGHIQM-GOEBONIOSA-N 0 3 261.365 2.844 20 10 CFCDHN COc1cccc(C[NH+]2CCC(c3cn[nH]c3)CC2)c1[O-] ZINC000374306086 393492591 /nfs/dbraw/zinc/49/25/91/393492591.db2.gz BSGVRTVVUOKDAO-UHFFFAOYSA-N 0 3 287.363 2.504 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CC(=O)N3CCCC[C@@H]23)c1 ZINC000374509419 393498592 /nfs/dbraw/zinc/49/85/92/393498592.db2.gz XWHOJABOBHULMB-QEJZJMRPSA-N 0 3 288.391 2.505 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CC(=O)N3CCCC[C@H]23)c1 ZINC000374509416 393498649 /nfs/dbraw/zinc/49/86/49/393498649.db2.gz XWHOJABOBHULMB-AEGPPILISA-N 0 3 288.391 2.505 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CC(F)(F)F ZINC000189480873 393572816 /nfs/dbraw/zinc/57/28/16/393572816.db2.gz BKYLVYJSZNGIIJ-LBPRGKRZSA-N 0 3 291.313 2.918 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CC(F)(F)F ZINC000189480873 393572820 /nfs/dbraw/zinc/57/28/20/393572820.db2.gz BKYLVYJSZNGIIJ-LBPRGKRZSA-N 0 3 291.313 2.918 20 10 CFCDHN C[C@@H](C(=O)N(C)Cc1ccccc1O)[C@H](N)c1ccccc1 ZINC000237689706 393793810 /nfs/dbraw/zinc/79/38/10/393793810.db2.gz GMVBPLPGBFTCFA-DYVFJYSZSA-N 0 3 298.386 2.687 20 10 CFCDHN CN(CCC[NH2+]Cc1ccccc1[O-])C(=O)OC(C)(C)C ZINC000105436030 393863550 /nfs/dbraw/zinc/86/35/50/393863550.db2.gz KAXZYOGBMFOYKT-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN CC[C@H](CO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263643207 393964178 /nfs/dbraw/zinc/96/41/78/393964178.db2.gz ANJFIOGIWUFFAU-MRXNPFEDSA-N 0 3 271.360 2.920 20 10 CFCDHN CN(C)c1ccc(CN(C)CCCO)c(C(F)(F)F)c1 ZINC000281844307 394082702 /nfs/dbraw/zinc/08/27/02/394082702.db2.gz TYSWXFVDHJKQOD-UHFFFAOYSA-N 0 3 290.329 2.586 20 10 CFCDHN CN(C)[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000296048534 394305255 /nfs/dbraw/zinc/30/52/55/394305255.db2.gz RABHESISDNGVDE-ZIAGYGMSSA-N 0 3 286.375 2.865 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)cnn1C ZINC000296179853 394306609 /nfs/dbraw/zinc/30/66/09/394306609.db2.gz YALBKNTZGJIWEM-IINYFYTJSA-N 0 3 271.364 2.772 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1[O-] ZINC000527804465 394409917 /nfs/dbraw/zinc/40/99/17/394409917.db2.gz PVCCUVZJYUFASZ-YXMPFFBPSA-N 0 3 279.380 2.692 20 10 CFCDHN COC(CN(Cc1ccc(N(C)C)cc1)C(C)C)OC ZINC000275719322 292078714 /nfs/dbraw/zinc/07/87/14/292078714.db2.gz XBTJCIXAFDTMGY-UHFFFAOYSA-N 0 3 280.412 2.582 20 10 CFCDHN CC[C@@H]([NH2+]CCCN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952063 286906594 /nfs/dbraw/zinc/90/65/94/286906594.db2.gz BTJRKOZNLKTEQL-OAHLLOKOSA-N 0 3 290.407 2.754 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)CC)c1ccc(C)cc1[O-] ZINC000280263907 286907238 /nfs/dbraw/zinc/90/72/38/286907238.db2.gz XJTJCVUMBGMALI-CQSZACIVSA-N 0 3 250.386 2.693 20 10 CFCDHN CC[C@H]([NH2+]CCCN1CCCC1)c1ccccc1[O-] ZINC000020129086 171016347 /nfs/dbraw/zinc/01/63/47/171016347.db2.gz IHXXXCJNRXBBCY-HNNXBMFYSA-N 0 3 262.397 2.919 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccnc2)c1 ZINC000020140978 171027467 /nfs/dbraw/zinc/02/74/67/171027467.db2.gz SZBSKTOOSKTSTJ-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000035628701 172307791 /nfs/dbraw/zinc/30/77/91/172307791.db2.gz IJMACXIEDMCDRM-UONOGXRCSA-N 0 3 262.397 2.836 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000292711082 263133922 /nfs/dbraw/zinc/13/39/22/263133922.db2.gz ORBDLKITMLJWFI-GFCCVEGCSA-N 0 3 292.423 2.651 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC3(CCO3)CC2)cc1C ZINC000367244435 266178416 /nfs/dbraw/zinc/17/84/16/266178416.db2.gz QALZYLKTLAWAST-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[NH+]1CC([C@@H]2CCOC2)C1 ZINC000368038749 267139757 /nfs/dbraw/zinc/13/97/57/267139757.db2.gz CZHUQNWSIUCAJI-DOMZBBRYSA-N 0 3 261.365 2.812 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1[O-])C2 ZINC000368315601 267161768 /nfs/dbraw/zinc/16/17/68/267161768.db2.gz LAHQRJZXUXKYND-UONOGXRCSA-N 0 3 285.391 2.871 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C2 ZINC000368316270 267161836 /nfs/dbraw/zinc/16/18/36/267161836.db2.gz ORBUIJHMDOTLEC-YPMHNXCESA-N 0 3 289.354 2.702 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1CO ZINC000372773178 267600101 /nfs/dbraw/zinc/60/01/01/267600101.db2.gz QMDBZNGGVTZNJV-CRAIPNDOSA-N 0 3 283.371 2.778 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC3(CCO3)CC2)c1 ZINC000374378018 267786385 /nfs/dbraw/zinc/78/63/85/267786385.db2.gz PSJGXIDZPDLTOM-UHFFFAOYSA-N 0 3 277.364 2.546 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000376285157 267956190 /nfs/dbraw/zinc/95/61/90/267956190.db2.gz PQTJNOOZVIYLMC-AXLMJIKWSA-N 0 3 275.392 2.936 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000376285157 267956194 /nfs/dbraw/zinc/95/61/94/267956194.db2.gz PQTJNOOZVIYLMC-AXLMJIKWSA-N 0 3 275.392 2.936 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](O)[C@@H]2CCCO2)c1[O-] ZINC000527954369 270561444 /nfs/dbraw/zinc/56/14/44/270561444.db2.gz JMNPRYAKOPVJQG-GDLCADMTSA-N 0 3 299.798 2.545 20 10 CFCDHN CC1(C)C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CCO1 ZINC000296979721 275861880 /nfs/dbraw/zinc/86/18/80/275861880.db2.gz RWNZFOBKFUQUQQ-QWHCGFSZSA-N 0 3 261.365 2.927 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000280193701 276118395 /nfs/dbraw/zinc/11/83/95/276118395.db2.gz SKIYOOUVFAHEFU-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCc3c2cnn3C)cc1 ZINC000030908578 276883596 /nfs/dbraw/zinc/88/35/96/276883596.db2.gz CLRUDTBNPLCOLR-MRXNPFEDSA-N 0 3 284.407 2.653 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000156092295 277084173 /nfs/dbraw/zinc/08/41/73/277084173.db2.gz XZIJPZZQSAQDIR-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000156092295 277084174 /nfs/dbraw/zinc/08/41/74/277084174.db2.gz XZIJPZZQSAQDIR-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccccc1[O-] ZINC000183543837 278352647 /nfs/dbraw/zinc/35/26/47/278352647.db2.gz LDFBZFYDMKXVFI-UHOFOFEASA-N 0 3 263.381 2.984 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1cc(F)ccc1[O-] ZINC000282279419 278383810 /nfs/dbraw/zinc/38/38/10/278383810.db2.gz BBZUIWWJXBJTGH-YGRLFVJLSA-N 0 3 289.354 2.993 20 10 CFCDHN CC(C)N(C)CCC[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000230658157 279354778 /nfs/dbraw/zinc/35/47/78/279354778.db2.gz VQAMWYDGUMOSBK-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN CC(C)[N@H+](C)CCCN[C@@H](C)c1ccc(F)cc1[O-] ZINC000230658157 279354780 /nfs/dbraw/zinc/35/47/80/279354780.db2.gz VQAMWYDGUMOSBK-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN CC(C)[N@@H+](C)CCCN[C@@H](C)c1ccc(F)cc1[O-] ZINC000230658157 279354782 /nfs/dbraw/zinc/35/47/82/279354782.db2.gz VQAMWYDGUMOSBK-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@H]1CCCCO1 ZINC000294864615 279548836 /nfs/dbraw/zinc/54/88/36/279548836.db2.gz YIMPDWZNAAAGPJ-CORIIIEPSA-N 0 3 261.365 2.927 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@H](C)O[C@]2(CCOC2)C1 ZINC000377700758 281025526 /nfs/dbraw/zinc/02/55/26/281025526.db2.gz RTZJNWJMXYTHNS-YSVLISHTSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@H](C)O[C@]2(CCOC2)C1 ZINC000377700758 281025529 /nfs/dbraw/zinc/02/55/29/281025529.db2.gz RTZJNWJMXYTHNS-YSVLISHTSA-N 0 3 291.391 2.723 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1[O-] ZINC000292763008 281216849 /nfs/dbraw/zinc/21/68/49/281216849.db2.gz JQRBZKHHTTVVCH-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1[O-] ZINC000292763008 281216850 /nfs/dbraw/zinc/21/68/50/281216850.db2.gz JQRBZKHHTTVVCH-INIZCTEOSA-N 0 3 275.392 2.949 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CCN(C)C)c1ccccc1[O-] ZINC000049553307 522689353 /nfs/dbraw/zinc/68/93/53/522689353.db2.gz MUPSZENNNWUWFW-JSGCOSHPSA-N 0 3 250.386 2.773 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cccc(Cl)c3[O-])[C@H]2C1 ZINC000272540668 290232785 /nfs/dbraw/zinc/23/27/85/290232785.db2.gz BWRXYVPIYIPRTH-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cccc(Cl)c3[O-])[C@H]2C1 ZINC000272540668 290232788 /nfs/dbraw/zinc/23/27/88/290232788.db2.gz BWRXYVPIYIPRTH-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1c3ccccc3C[C@@H]1O)CC2 ZINC000295771428 304845908 /nfs/dbraw/zinc/84/59/08/304845908.db2.gz AHEAWXPBPQQZEN-UWWQBHOKSA-N 0 3 281.355 2.627 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC000403521213 327906398 /nfs/dbraw/zinc/90/63/98/327906398.db2.gz LDGHMMRNARKHAA-UPJWGTAASA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC1(c2ccccn2)CCC1 ZINC000368607765 328939008 /nfs/dbraw/zinc/93/90/08/328939008.db2.gz ZWEDIYSFPQVVQR-UHFFFAOYSA-N 0 3 268.360 2.999 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)c1 ZINC000527659261 330273562 /nfs/dbraw/zinc/27/35/62/330273562.db2.gz IZFDWUKZXQPPSH-LKTVYLICSA-N 0 3 261.365 2.925 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@]23C[C@@H]2COC3(C)C)cc1C ZINC000527767331 330281781 /nfs/dbraw/zinc/28/17/81/330281781.db2.gz UOOSVYICFKEMOH-CJNGLKHVSA-N 0 3 261.365 2.666 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc1C ZINC000527804649 330284383 /nfs/dbraw/zinc/28/43/83/330284383.db2.gz RCNZKYPPEIOKMG-FOCJUVANSA-N 0 3 263.381 2.911 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c([O-])c1 ZINC000527804514 330284452 /nfs/dbraw/zinc/28/44/52/330284452.db2.gz QKOXAVHLHBDPNB-YWDSYVAPSA-N 0 3 279.380 2.692 20 10 CFCDHN Cc1ccc([C@H](C)N[C@H]2CC[NH2+]C23CCC3)c([O-])c1 ZINC000530217053 333528554 /nfs/dbraw/zinc/52/85/54/333528554.db2.gz SBESJRYVFALFCG-WFASDCNBSA-N 0 3 260.381 2.636 20 10 CFCDHN CC[C@@H](N[C@H]1CC[NH2+]C12CCC2)c1ccccc1[O-] ZINC000530216951 333528571 /nfs/dbraw/zinc/52/85/71/333528571.db2.gz RACPKOSTWZJLSA-HIFRSBDPSA-N 0 3 260.381 2.718 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2cc(C)ccc2[O-])C1 ZINC000290225331 520965362 /nfs/dbraw/zinc/96/53/62/520965362.db2.gz SGDNFAZBIPGPSZ-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2cc(C)ccc2[O-])C1 ZINC000290225331 520965373 /nfs/dbraw/zinc/96/53/73/520965373.db2.gz SGDNFAZBIPGPSZ-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(OC)c1[O-])C[C@H](C)OC ZINC000291120779 521288921 /nfs/dbraw/zinc/28/89/21/521288921.db2.gz UVAMMIWREZIVOD-JTQLQIEISA-N 0 3 287.787 2.911 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(OC)c1[O-])C[C@H](C)OC ZINC000291120779 521288930 /nfs/dbraw/zinc/28/89/30/521288930.db2.gz UVAMMIWREZIVOD-JTQLQIEISA-N 0 3 287.787 2.911 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+]Cc1cccc(C)c1[O-] ZINC000224831110 521609188 /nfs/dbraw/zinc/60/91/88/521609188.db2.gz UCTBSRJADZBTAM-AWEZNQCLSA-N 0 3 251.370 2.587 20 10 CFCDHN CCC(O)(CC)CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000276439953 521651217 /nfs/dbraw/zinc/65/12/17/521651217.db2.gz UEIWKXMSCILXCJ-UHFFFAOYSA-N 0 3 255.333 2.562 20 10 CFCDHN CC[C@H](COC)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228675264 522262064 /nfs/dbraw/zinc/26/20/64/522262064.db2.gz ZRNOBKUXPGGFRR-LLVKDONJSA-N 0 3 273.760 2.569 20 10 CFCDHN CC[C@H]([NH2+]CCC(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000280299573 522576234 /nfs/dbraw/zinc/57/62/34/522576234.db2.gz ZTQXWLVGTOODNB-AWEZNQCLSA-N 0 3 278.396 2.656 20 10 CFCDHN CC(C)[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 ZINC000173476190 519804626 /nfs/dbraw/zinc/80/46/26/519804626.db2.gz LRDOUATUAIONFR-HNNXBMFYSA-N 0 3 295.404 2.694 20 10 CFCDHN CCC1(C[NH2+]Cc2cc(OC)ccc2[O-])CCOCC1 ZINC000272975039 519842437 /nfs/dbraw/zinc/84/24/37/519842437.db2.gz XNQVWHPCZAGURQ-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCOC[C@@H]1CC[N@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000093839324 520132409 /nfs/dbraw/zinc/13/24/09/520132409.db2.gz FVVVMPBLZWXTEI-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOC[C@@H]1CC[N@@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000093839324 520132419 /nfs/dbraw/zinc/13/24/19/520132419.db2.gz FVVVMPBLZWXTEI-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CCCCCO)c([O-])c1 ZINC000279463380 520346493 /nfs/dbraw/zinc/34/64/93/520346493.db2.gz RIXGECQEWOAFCS-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CCCCCO)c([O-])c1 ZINC000279463380 520346499 /nfs/dbraw/zinc/34/64/99/520346499.db2.gz RIXGECQEWOAFCS-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](CO)CC2CCC2)c([O-])c1 ZINC000279631501 520371995 /nfs/dbraw/zinc/37/19/95/520371995.db2.gz BWBFGYUKTNHRPS-OAHLLOKOSA-N 0 3 293.407 2.822 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCOC[C@H]2C)c([O-])c1 ZINC000278041596 520373194 /nfs/dbraw/zinc/37/31/94/520373194.db2.gz XMMCSTRYJFVPIB-IUODEOHRSA-N 0 3 279.380 2.696 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000293613785 520998998 /nfs/dbraw/zinc/99/89/98/520998998.db2.gz FHKFETNYUKHZLM-ZFWWWQNUSA-N 0 3 292.423 2.985 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280457837 521142141 /nfs/dbraw/zinc/14/21/41/521142141.db2.gz LZJSYYRZPFUSIC-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280457837 521142146 /nfs/dbraw/zinc/14/21/46/521142146.db2.gz LZJSYYRZPFUSIC-ZFWWWQNUSA-N 0 3 293.407 2.916 20 10 CFCDHN CCN(Cc1ccc(N(C)C)cc1)CC1=CCCOC1 ZINC000156847178 521320455 /nfs/dbraw/zinc/32/04/55/521320455.db2.gz MUAVEMKTOPAAMR-UHFFFAOYSA-N 0 3 274.408 2.921 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000290198957 521320567 /nfs/dbraw/zinc/32/05/67/521320567.db2.gz PLJVVFFAIRFIQA-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2cc(OCC)ccc2[O-])C1 ZINC000290198957 521320573 /nfs/dbraw/zinc/32/05/73/521320573.db2.gz PLJVVFFAIRFIQA-KRWDZBQOSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290464736 521339872 /nfs/dbraw/zinc/33/98/72/521339872.db2.gz NFLUJHVYHZRPMU-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290464736 521339880 /nfs/dbraw/zinc/33/98/80/521339880.db2.gz NFLUJHVYHZRPMU-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCOCC2CC2)c1[O-] ZINC000020190625 521362519 /nfs/dbraw/zinc/36/25/19/521362519.db2.gz UGDRHIUXGHVNKL-UHFFFAOYSA-N 0 3 279.380 2.697 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](O)CC(C)(C)C)c1[O-] ZINC000227374843 521363877 /nfs/dbraw/zinc/36/38/77/521363877.db2.gz UCSDTPIJUNLFDP-CYBMUJFWSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+]CCOc2ccccc2)c1[O-] ZINC000042895607 521364589 /nfs/dbraw/zinc/36/45/89/521364589.db2.gz KXSRMEMTNGIZRP-UHFFFAOYSA-N 0 3 287.359 2.960 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1cc(OC)ccc1[O-])OC ZINC000292737902 521441910 /nfs/dbraw/zinc/44/19/10/521441910.db2.gz HASORPTYDBXFQI-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CCN1CCC([NH2+][C@H](C)c2cc(F)ccc2[O-])CC1 ZINC000094617796 521579674 /nfs/dbraw/zinc/57/96/74/521579674.db2.gz QUHBWZLCPVMLBQ-LLVKDONJSA-N 0 3 266.360 2.666 20 10 CFCDHN CN(C)c1ccc(CN(CCOCC(F)F)C2CC2)cc1 ZINC000276411971 522172809 /nfs/dbraw/zinc/17/28/09/522172809.db2.gz VUOLUASFOASUDZ-UHFFFAOYSA-N 0 3 298.377 2.999 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@H](CO)c2ccccc2)cc1 ZINC000278332684 522174265 /nfs/dbraw/zinc/17/42/65/522174265.db2.gz DSCMETJUPUCOMZ-GOSISDBHSA-N 0 3 284.403 2.918 20 10 CFCDHN CN(C)c1ccc(CNC(C)(C)CO)c(C(F)(F)F)c1 ZINC000279786208 522206860 /nfs/dbraw/zinc/20/68/60/522206860.db2.gz BIHASNWBUYBNLK-UHFFFAOYSA-N 0 3 290.329 2.632 20 10 CFCDHN COC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H]1CCCO1 ZINC000279339368 522359754 /nfs/dbraw/zinc/35/97/54/522359754.db2.gz DXHWQJDSZARCQM-ZIAGYGMSSA-N 0 3 299.798 2.638 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC[C@H]2O)c1[O-] ZINC000228675069 522540789 /nfs/dbraw/zinc/54/07/89/522540789.db2.gz MUNDOULEHBCCEJ-GXFFZTMASA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H]2C2CC2)c1[O-] ZINC000230935401 522541524 /nfs/dbraw/zinc/54/15/24/522541524.db2.gz PNXLCKAFBHZUFW-IUODEOHRSA-N 0 3 297.782 2.711 20 10 CFCDHN COC1(CC[NH2+][C@@H]2CCc3cccc([O-])c32)CCC1 ZINC000297263978 522596489 /nfs/dbraw/zinc/59/64/89/522596489.db2.gz KEHMUSUMNKQTMQ-CYBMUJFWSA-N 0 3 261.365 2.928 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@H]1CCCO1)c1ccccc1[O-] ZINC000278946037 522748776 /nfs/dbraw/zinc/74/87/76/522748776.db2.gz YUPFRDRZGYVUME-SQWLQELKSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CC=CCC1)c1ccccc1[O-] ZINC000280852026 522833317 /nfs/dbraw/zinc/83/33/17/522833317.db2.gz BPDISPXJYOVISA-OAHLLOKOSA-N 0 3 260.381 2.695 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)C(F)(F)F)c1ccc(C)cc1[O-] ZINC000280121775 522861326 /nfs/dbraw/zinc/86/13/26/522861326.db2.gz OHGLBYFQMNRZKK-PWSUYJOCSA-N 0 3 277.286 2.665 20 10 CFCDHN COCC1(CC[NH2+]Cc2cc(C)ccc2[O-])CCC1 ZINC000293053085 522862799 /nfs/dbraw/zinc/86/27/99/522862799.db2.gz UBXOLFOXCHOLQO-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CC[C@@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1ccccc1[O-] ZINC000274783144 522866685 /nfs/dbraw/zinc/86/66/85/522866685.db2.gz PPORFCHAHKPOOV-PWSUYJOCSA-N 0 3 277.286 2.746 20 10 CFCDHN COCC1(C[NH2+]Cc2cc(C)c(C)cc2[O-])CCOCC1 ZINC000291737311 522900710 /nfs/dbraw/zinc/90/07/10/522900710.db2.gz ONLWJSXDBGQJBS-UHFFFAOYSA-N 0 3 293.407 2.542 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000365836040 523104211 /nfs/dbraw/zinc/10/42/11/523104211.db2.gz GYPYUMZTQPPFAM-HIFRSBDPSA-N 0 3 271.364 2.987 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000365836040 523104221 /nfs/dbraw/zinc/10/42/21/523104221.db2.gz GYPYUMZTQPPFAM-HIFRSBDPSA-N 0 3 271.364 2.987 20 10 CFCDHN COc1ccc(CN[C@@H]2CCCc3nn(C)cc32)cc1C ZINC000280126100 524086539 /nfs/dbraw/zinc/08/65/39/524086539.db2.gz OPPURSMTSJWREK-OAHLLOKOSA-N 0 3 285.391 2.904 20 10 CFCDHN Cc1cccc(CC[NH2+][C@H](C)c2ccccc2[O-])n1 ZINC000280064151 524364023 /nfs/dbraw/zinc/36/40/23/524364023.db2.gz KPZJHVZIMPIOOX-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCCOC(C)C)c1[O-] ZINC000271741507 524375955 /nfs/dbraw/zinc/37/59/55/524375955.db2.gz ABTUXKBAHSZHKN-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCCOC(C)C)c1[O-] ZINC000271741507 524375966 /nfs/dbraw/zinc/37/59/66/524375966.db2.gz ABTUXKBAHSZHKN-UHFFFAOYSA-N 0 3 251.370 2.948 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290577409 524395997 /nfs/dbraw/zinc/39/59/97/524395997.db2.gz UGDRVBBQYKLLOW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@]2(C)CCCO)c1[O-] ZINC000290577409 524396005 /nfs/dbraw/zinc/39/60/05/524396005.db2.gz UGDRVBBQYKLLOW-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN C[C@@H]1CCC[C@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000044418158 524409775 /nfs/dbraw/zinc/40/97/75/524409775.db2.gz DZTPNOBOHRGNRR-PWSUYJOCSA-N 0 3 263.337 2.789 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H]2CCCSC2)c1[O-] ZINC000290166004 524432178 /nfs/dbraw/zinc/43/21/78/524432178.db2.gz MIFXICRELHVIGL-GFCCVEGCSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)c1[O-] ZINC000290273419 524434622 /nfs/dbraw/zinc/43/46/22/524434622.db2.gz YDNOQDBVNWWIBL-GUYCJALGSA-N 0 3 271.360 2.912 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1ccccc1[O-])CN1CCCC1 ZINC000062077557 524749457 /nfs/dbraw/zinc/74/94/57/524749457.db2.gz DOPAMAJBKGHAMK-KBPBESRZSA-N 0 3 262.397 2.775 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCc2nccs2)c1 ZINC000271957933 524749794 /nfs/dbraw/zinc/74/97/94/524749794.db2.gz FBUYDURWOGFAQS-UHFFFAOYSA-N 0 3 278.377 2.580 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)SC)c1 ZINC000168851152 524763585 /nfs/dbraw/zinc/76/35/85/524763585.db2.gz OSKAUDJWFCPLHN-VHSXEESVSA-N 0 3 255.383 2.803 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccnc(OC)c2)c1 ZINC000062057812 524765892 /nfs/dbraw/zinc/76/58/92/524765892.db2.gz HYYJIMWHJCZVDJ-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCCSC2)c1 ZINC000168815832 524766859 /nfs/dbraw/zinc/76/68/59/524766859.db2.gz MMFDPCFUXMQVPF-GHMZBOCLSA-N 0 3 267.394 2.947 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(O)CCCCC2)c1 ZINC000087017794 524770236 /nfs/dbraw/zinc/77/02/36/524770236.db2.gz BVRMUEHIWTUYKE-LBPRGKRZSA-N 0 3 279.380 2.747 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](C)c2cnn(C)c2)c1 ZINC000273618422 524775348 /nfs/dbraw/zinc/77/53/48/524775348.db2.gz YIFSMDFRIGOOJB-MNOVXSKESA-N 0 3 275.352 2.546 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CCCCO)c1[O-] ZINC000276733868 524860377 /nfs/dbraw/zinc/86/03/77/524860377.db2.gz YCVTVKRDRVYTNA-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CCCCO)c1[O-] ZINC000276733868 524860384 /nfs/dbraw/zinc/86/03/84/524860384.db2.gz YCVTVKRDRVYTNA-UHFFFAOYSA-N 0 3 257.761 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)C(C)(C)C)c1[O-] ZINC000278689609 524871437 /nfs/dbraw/zinc/87/14/37/524871437.db2.gz MRZXDZHPDJDHQL-LBPRGKRZSA-N 0 3 271.788 2.851 20 10 CFCDHN COc1ncccc1CN[C@H](C)c1ccccc1O ZINC000037650397 525063500 /nfs/dbraw/zinc/06/35/00/525063500.db2.gz UKTTZJPXJWPONT-LLVKDONJSA-N 0 3 258.321 2.647 20 10 CFCDHN COc1ncccc1CN[C@H](C)c1cc(C)ccc1O ZINC000037650318 525063920 /nfs/dbraw/zinc/06/39/20/525063920.db2.gz LIHTVZOUHROTAK-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@H](C3OCCO3)C2)cc1C ZINC000172490315 525315943 /nfs/dbraw/zinc/31/59/43/525315943.db2.gz JNVZOHGFBNSPMU-AWEZNQCLSA-N 0 3 291.391 2.594 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@H](C3OCCO3)C2)cc1C ZINC000172490315 525315953 /nfs/dbraw/zinc/31/59/53/525315953.db2.gz JNVZOHGFBNSPMU-AWEZNQCLSA-N 0 3 291.391 2.594 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@]3(CCOC3)C2)cc1C ZINC000151296758 525318474 /nfs/dbraw/zinc/31/84/74/525318474.db2.gz WNHBETFLECKPBT-INIZCTEOSA-N 0 3 261.365 2.621 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@]3(CCOC3)C2)cc1C ZINC000151296758 525318480 /nfs/dbraw/zinc/31/84/80/525318480.db2.gz WNHBETFLECKPBT-INIZCTEOSA-N 0 3 261.365 2.621 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](CO)CC2CCC2)cc1C ZINC000279676578 525322973 /nfs/dbraw/zinc/32/29/73/525322973.db2.gz IMOYMKUVEFTEKP-OAHLLOKOSA-N 0 3 263.381 2.650 20 10 CFCDHN C[C@H](NCCC[NH+]1CCCC1)c1ccc(F)c(F)c1[O-] ZINC000191188443 525335494 /nfs/dbraw/zinc/33/54/94/525335494.db2.gz QGBPJOBCLWXRMS-NSHDSACASA-N 0 3 284.350 2.807 20 10 CFCDHN Cc1ccc(O)c(CN(CCN(C)C)Cc2ccco2)c1 ZINC000289470535 525340417 /nfs/dbraw/zinc/34/04/17/525340417.db2.gz PMLICGXPCHTNGH-UHFFFAOYSA-N 0 3 288.391 2.857 20 10 CFCDHN Cc1ccc(O)c(CN2C[C@H](C)O[C@@H](C3CC3)C2)c1 ZINC000279773617 525347136 /nfs/dbraw/zinc/34/71/36/525347136.db2.gz ALORZYAJJPFSEF-BLLLJJGKSA-N 0 3 261.365 2.700 20 10 CFCDHN C[C@]12CC[N@H+](Cc3ccccc3[O-])C[C@H]1C2(F)F ZINC000292744235 525347849 /nfs/dbraw/zinc/34/78/49/525347849.db2.gz HWCQPJVSUDCJPL-OLZOCXBDSA-N 0 3 253.292 2.869 20 10 CFCDHN C[C@]12CC[N@@H+](Cc3ccccc3[O-])C[C@H]1C2(F)F ZINC000292744235 525347856 /nfs/dbraw/zinc/34/78/56/525347856.db2.gz HWCQPJVSUDCJPL-OLZOCXBDSA-N 0 3 253.292 2.869 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCN(C)C2CCCC2)c1 ZINC000071409426 525350052 /nfs/dbraw/zinc/35/00/52/525350052.db2.gz QAODTPYQDCQMJB-UHFFFAOYSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C)c1 ZINC000227684965 525353361 /nfs/dbraw/zinc/35/33/61/525353361.db2.gz YNULHZQRQPGPIO-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)c1 ZINC000037649019 525358758 /nfs/dbraw/zinc/35/87/58/525358758.db2.gz UQVBBUDVRYXAIR-KGLIPLIRSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCN2CCCCC2)c1 ZINC000049574804 525359900 /nfs/dbraw/zinc/35/99/00/525359900.db2.gz XZGZYDFGXZDYHZ-CQSZACIVSA-N 0 3 262.397 2.837 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c1 ZINC000228615516 525364803 /nfs/dbraw/zinc/36/48/03/525364803.db2.gz JCEHAGNKGJBIBC-PZROIBLQSA-N 0 3 269.410 2.508 20 10 CFCDHN C[C@H]([NH2+]CCc1ccc(O)cc1)c1ccccc1[O-] ZINC000040735488 525366317 /nfs/dbraw/zinc/36/63/17/525366317.db2.gz MUMIYTSWHXZNGX-LBPRGKRZSA-N 0 3 257.333 2.991 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCCO1)c1cc(F)ccc1[O-] ZINC000094617931 525386433 /nfs/dbraw/zinc/38/64/33/525386433.db2.gz DKNLKIIHQDKCBT-JQWIXIFHSA-N 0 3 253.317 2.751 20 10 CFCDHN C[C@@H]([NH2+]CCCOCC1CC1)c1cc(F)ccc1[O-] ZINC000094616976 525438459 /nfs/dbraw/zinc/43/84/59/525438459.db2.gz QAYGKSQGCYTJQO-LLVKDONJSA-N 0 3 267.344 2.999 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCc3nccn3C2)c([O-])c1 ZINC000278952746 525925268 /nfs/dbraw/zinc/92/52/68/525925268.db2.gz LNSLBUFJXDFGAN-UONOGXRCSA-N 0 3 285.391 2.810 20 10 CFCDHN COc1cccc(C[NH2+]CC2CC(F)(F)C2)c1[O-] ZINC000291653405 526013457 /nfs/dbraw/zinc/01/34/57/526013457.db2.gz CYSMUODORZSFML-UHFFFAOYSA-N 0 3 257.280 2.536 20 10 CFCDHN COc1cccc(C[NH2+]CCOCCC(C)C)c1[O-] ZINC000045093899 526017245 /nfs/dbraw/zinc/01/72/45/526017245.db2.gz ZCUVPKDXMZIJHQ-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN Cc1cc(Br)cc(C[NH2+][C@@H](C)CF)c1[O-] ZINC000290187351 526156647 /nfs/dbraw/zinc/15/66/47/526156647.db2.gz OGPGSVRHANNKOM-QMMMGPOBSA-N 0 3 276.149 2.911 20 10 CFCDHN Cc1cc(C(=O)N2CCCNCC2)c(C)n1-c1ccccc1 ZINC000237685834 526244919 /nfs/dbraw/zinc/24/49/19/526244919.db2.gz VJVWOXNMHYAABQ-UHFFFAOYSA-N 0 3 297.402 2.530 20 10 CFCDHN O[C@H](CNCc1ccc2c(c1)CCO2)c1ccsc1 ZINC000219099620 526278508 /nfs/dbraw/zinc/27/85/08/526278508.db2.gz FMEVGRNWAXDAAZ-CQSZACIVSA-N 0 3 275.373 2.506 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000226562113 526350067 /nfs/dbraw/zinc/35/00/67/526350067.db2.gz WYFIQCLWOZSXGQ-UHFFFAOYSA-N 0 3 292.398 2.982 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCCSC1 ZINC000290062574 526350860 /nfs/dbraw/zinc/35/08/60/526350860.db2.gz FHUQYTUFLKZTLF-SNVBAGLBSA-N 0 3 255.358 2.764 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1[C@H]2Cc3ccccc3[C@@H]12 ZINC000290570231 526351684 /nfs/dbraw/zinc/35/16/84/526351684.db2.gz TUJFVQKFLVTITL-USXIJHARSA-N 0 3 269.319 2.959 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCO[C@@]2(CCSC2)C1 ZINC000134000356 526374434 /nfs/dbraw/zinc/37/44/34/526374434.db2.gz JVZOJUPKLUVYPO-ZFWWWQNUSA-N 0 3 279.405 2.537 20 10 CFCDHN c1ccc(OCCNCc2ccc3c(c2)CCO3)cc1 ZINC000042255793 526486395 /nfs/dbraw/zinc/48/63/95/526486395.db2.gz GYIHNZKYKKMJMD-UHFFFAOYSA-N 0 3 269.344 2.790 20 10 CFCDHN Cn1cc(CNCc2ccc(N3CCCCC3)cc2)cn1 ZINC000041159000 527218171 /nfs/dbraw/zinc/21/81/71/527218171.db2.gz MELGSUWGNGAOPV-UHFFFAOYSA-N 0 3 284.407 2.700 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCc1nccs1 ZINC000736642411 574063689 /nfs/dbraw/zinc/06/36/89/574063689.db2.gz ZIZSFHFHNTWPQK-UHFFFAOYSA-N 0 3 278.377 2.580 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCCN(C)C2)c2c1c(F)ccc2[O-] ZINC000756445259 574117103 /nfs/dbraw/zinc/11/71/03/574117103.db2.gz MKOMOYVEOOTECS-WZRBSPASSA-N 0 3 278.371 2.763 20 10 CFCDHN C[C@H](CC(=O)OC(C)(C)C)NCc1ccc2c(c1)CCO2 ZINC000731452533 574121479 /nfs/dbraw/zinc/12/14/79/574121479.db2.gz CAHGQZNAIGSCOL-GFCCVEGCSA-N 0 3 291.391 2.831 20 10 CFCDHN C[N@H+](CCCNC(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000732268913 574148455 /nfs/dbraw/zinc/14/84/55/574148455.db2.gz SBSXMKUJPFLPEA-UHFFFAOYSA-N 0 3 296.436 2.838 20 10 CFCDHN C[N@@H+](CCCNC(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000732268913 574148458 /nfs/dbraw/zinc/14/84/58/574148458.db2.gz SBSXMKUJPFLPEA-UHFFFAOYSA-N 0 3 296.436 2.838 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000732284734 574150206 /nfs/dbraw/zinc/15/02/06/574150206.db2.gz AKJGVARXRPVUME-LBPRGKRZSA-N 0 3 294.420 2.544 20 10 CFCDHN CN(C)c1ccc(CN(C)CCOC(C)(C)C)cc1 ZINC000746651382 574159935 /nfs/dbraw/zinc/15/99/35/574159935.db2.gz SJYSARVUISEZBJ-UHFFFAOYSA-N 0 3 264.413 3.000 20 10 CFCDHN Cn1ccnc1[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000755789651 574187771 /nfs/dbraw/zinc/18/77/71/574187771.db2.gz ISNVXCMPBFWIDD-OAHLLOKOSA-N 0 3 297.402 2.604 20 10 CFCDHN Cn1ccnc1[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000755789651 574187772 /nfs/dbraw/zinc/18/77/72/574187772.db2.gz ISNVXCMPBFWIDD-OAHLLOKOSA-N 0 3 297.402 2.604 20 10 CFCDHN Cc1ccc(O)c(CNCc2cccc(C(=O)N(C)C)c2)c1 ZINC000733323937 574221107 /nfs/dbraw/zinc/22/11/07/574221107.db2.gz AMSGAKKZXGYVRG-UHFFFAOYSA-N 0 3 298.386 2.692 20 10 CFCDHN COC[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756339762 574226712 /nfs/dbraw/zinc/22/67/12/574226712.db2.gz FYMPKTKJFPFAGR-YWVKMMECSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756397263 574233660 /nfs/dbraw/zinc/23/36/60/574233660.db2.gz QDTNULQWLVAZMV-YPMHNXCESA-N 0 3 289.354 2.956 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c1 ZINC000756431311 574236809 /nfs/dbraw/zinc/23/68/09/574236809.db2.gz BWZAHRLOAKEAPU-WFASDCNBSA-N 0 3 262.397 2.691 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccccn2)c([O-])c1 ZINC000756478230 574239957 /nfs/dbraw/zinc/23/99/57/574239957.db2.gz GYGWBSZJNOHIQA-ZDUSSCGKSA-N 0 3 299.374 2.775 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCN(C)C1)c1cc2c(cc1[O-])CCCC2 ZINC000756536313 574244277 /nfs/dbraw/zinc/24/42/77/574244277.db2.gz UWHPCZKWGPFUFL-DOMZBBRYSA-N 0 3 274.408 2.626 20 10 CFCDHN CC[C@](C)(O)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756552545 574246339 /nfs/dbraw/zinc/24/63/39/574246339.db2.gz GFXNJGPSRVJTNC-ZSGNIPIJSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000756551713 574246452 /nfs/dbraw/zinc/24/64/52/574246452.db2.gz ALLIJQBASXQTAI-FOGDFJRCSA-N 0 3 265.328 2.848 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCN2CCCCC2=O)c([O-])c1 ZINC000756557393 574246846 /nfs/dbraw/zinc/24/68/46/574246846.db2.gz SIFLJOSFCMVELH-AWEZNQCLSA-N 0 3 290.407 2.754 20 10 CFCDHN C[C@H](NCc1cc[nH]n1)c1ccc(Br)cc1O ZINC000756553417 574247312 /nfs/dbraw/zinc/24/73/12/574247312.db2.gz KWUXPTLRPGRUBE-QMMMGPOBSA-N 0 3 296.168 2.729 20 10 CFCDHN C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(Br)cc1[O-] ZINC000756553417 574247315 /nfs/dbraw/zinc/24/73/15/574247315.db2.gz KWUXPTLRPGRUBE-QMMMGPOBSA-N 0 3 296.168 2.729 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@H]2CCCO2)c([O-])c1 ZINC000756585111 574250298 /nfs/dbraw/zinc/25/02/98/574250298.db2.gz XHJCDNASPUAGRT-ZIAGYGMSSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOC[C@@H]2CCCO2)c([O-])c1 ZINC000756585108 574250612 /nfs/dbraw/zinc/25/06/12/574250612.db2.gz XHJCDNASPUAGRT-KBPBESRZSA-N 0 3 279.380 2.547 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCOC[C@H]2CCCO2)c1 ZINC000756583893 574250658 /nfs/dbraw/zinc/25/06/58/574250658.db2.gz RKRZBFYQRKGNPE-UONOGXRCSA-N 0 3 279.380 2.547 20 10 CFCDHN CCC[N@H+](CCn1cc(C)cn1)Cc1ccccc1[O-] ZINC000730087386 574252212 /nfs/dbraw/zinc/25/22/12/574252212.db2.gz XSMJKYRHKIEGEJ-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN CCC[N@@H+](CCn1cc(C)cn1)Cc1ccccc1[O-] ZINC000730087386 574252213 /nfs/dbraw/zinc/25/22/13/574252213.db2.gz XSMJKYRHKIEGEJ-UHFFFAOYSA-N 0 3 273.380 2.809 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](C)CCO)c1cc2c(cc1[O-])CCCC2 ZINC000756620635 574252241 /nfs/dbraw/zinc/25/22/41/574252241.db2.gz LLFVXSCATWVASQ-QWHCGFSZSA-N 0 3 277.408 2.940 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756643986 574254798 /nfs/dbraw/zinc/25/47/98/574254798.db2.gz WVTCMZLCISKZBQ-ZMLRMANQSA-N 0 3 267.344 2.686 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cc(F)cc(F)c1[O-] ZINC000756645504 574255437 /nfs/dbraw/zinc/25/54/37/574255437.db2.gz GJFGYQNJFTWGQX-KWQFWETISA-N 0 3 293.317 2.602 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)CO)c([O-])c1C ZINC000756762338 574261397 /nfs/dbraw/zinc/26/13/97/574261397.db2.gz XVIFRACOSBXSNW-LBPRGKRZSA-N 0 3 251.370 2.678 20 10 CFCDHN COC[C@@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756778832 574262265 /nfs/dbraw/zinc/26/22/65/574262265.db2.gz FYMPKTKJFPFAGR-NGZCFLSTSA-N 0 3 253.317 2.704 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2ccc(C)c(C)c2O)ncn1 ZINC000756777120 574262330 /nfs/dbraw/zinc/26/23/30/574262330.db2.gz VBDCAULUSWXBEX-ZDUSSCGKSA-N 0 3 271.364 2.958 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H](C)Cc2cnccn2)cc1C ZINC000742369314 574278437 /nfs/dbraw/zinc/27/84/37/574278437.db2.gz UJBAPDDQAIFRPZ-ZDUSSCGKSA-N 0 3 271.364 2.520 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000743500271 574307527 /nfs/dbraw/zinc/30/75/27/574307527.db2.gz VGPAJCXCSWEBEK-XHDPSFHLSA-N 0 3 265.397 2.896 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)N(C)C ZINC000749923978 574316084 /nfs/dbraw/zinc/31/60/84/574316084.db2.gz NSGGKXGPDGIJCH-CYBMUJFWSA-N 0 3 298.386 2.626 20 10 CFCDHN CO[C@@H](CNCc1cc(C)c(C)cc1O)C(F)(F)F ZINC000742370684 574325054 /nfs/dbraw/zinc/32/50/54/574325054.db2.gz IWVUEZSSNKYNTC-LBPRGKRZSA-N 0 3 277.286 2.676 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCN(C)[C@@H](C)C2)cc1C ZINC000742375350 574325800 /nfs/dbraw/zinc/32/58/00/574325800.db2.gz PZMMLPFMTFWWOT-DZGCQCFKSA-N 0 3 262.397 2.581 20 10 CFCDHN CCC[N@H+](Cc1ccn(C)c(=O)c1)Cc1ccccc1[O-] ZINC000750875736 574358524 /nfs/dbraw/zinc/35/85/24/574358524.db2.gz WMUPTJMDQTUFKS-UHFFFAOYSA-N 0 3 286.375 2.503 20 10 CFCDHN CCC[N@@H+](Cc1ccn(C)c(=O)c1)Cc1ccccc1[O-] ZINC000750875736 574358526 /nfs/dbraw/zinc/35/85/26/574358526.db2.gz WMUPTJMDQTUFKS-UHFFFAOYSA-N 0 3 286.375 2.503 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCC(F)(F)F ZINC000743495770 574366822 /nfs/dbraw/zinc/36/68/22/574366822.db2.gz JOOZPUKCAXSGSU-UHFFFAOYSA-N 0 3 263.259 2.833 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@H]2CCOC2)c1[O-] ZINC000753592117 574405736 /nfs/dbraw/zinc/40/57/36/574405736.db2.gz WMJCKFFRMQVUCU-NSHDSACASA-N 0 3 269.772 2.870 20 10 CFCDHN C[C@]1(Br)C[C@@H]1C[NH2+]Cc1ccccc1[O-] ZINC000892790586 618746570 /nfs/dbraw/zinc/74/65/70/618746570.db2.gz GAJYIAMXAXJLHZ-PWSUYJOCSA-N 0 3 270.170 2.655 20 10 CFCDHN CC1(C)CNCC[C@@H]1[NH2+]Cc1cccc(Cl)c1[O-] ZINC000841072009 620758994 /nfs/dbraw/zinc/75/89/94/620758994.db2.gz DPKGFBPYLUITCB-LBPRGKRZSA-N 0 3 268.788 2.523 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cccc(C)n2)c1 ZINC000051573990 618020867 /nfs/dbraw/zinc/02/08/67/618020867.db2.gz DIIZITSHZUDZJH-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1cc(CN(C)Cc2cccn2C)c(O)cc1C ZINC000160412555 618059833 /nfs/dbraw/zinc/05/98/33/618059833.db2.gz GYTOZBJJVRDMNB-UHFFFAOYSA-N 0 3 274.364 2.680 20 10 CFCDHN Cc1cccc(CC[NH2+]Cc2cc(F)ccc2[O-])n1 ZINC000280542002 618230323 /nfs/dbraw/zinc/23/03/23/618230323.db2.gz JIFNCZUFSUASDK-UHFFFAOYSA-N 0 3 260.312 2.567 20 10 CFCDHN COc1ccc(CN[C@H](C)c2ccccn2)c(O)c1OC ZINC000892430231 618262491 /nfs/dbraw/zinc/26/24/91/618262491.db2.gz BKBBAFYGNTVFNR-LLVKDONJSA-N 0 3 288.347 2.655 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CCO)C2)c1[O-] ZINC000775681808 618332375 /nfs/dbraw/zinc/33/23/75/618332375.db2.gz TYACTGLSLIVTKC-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CCO)C2)c1[O-] ZINC000775681808 618332386 /nfs/dbraw/zinc/33/23/86/618332386.db2.gz TYACTGLSLIVTKC-LBPRGKRZSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccc(N(C)C)nc1 ZINC000162613297 618426707 /nfs/dbraw/zinc/42/67/07/618426707.db2.gz ZVYRBULYVIYVKX-UHFFFAOYSA-N 0 3 298.434 2.812 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCC[C@@H](CO)C1)c1ccccc1[O-] ZINC000311420850 618711089 /nfs/dbraw/zinc/71/10/89/618711089.db2.gz NWPOPCGZSNXQSA-IPYPFGDCSA-N 0 3 263.381 2.984 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)COc1ccccc1 ZINC000892696711 618715979 /nfs/dbraw/zinc/71/59/79/618715979.db2.gz OYKNJSQOVXZORT-ZDUSSCGKSA-N 0 3 287.359 2.958 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCC[C@@H](CO)C2)c1 ZINC000311711629 618720292 /nfs/dbraw/zinc/72/02/92/618720292.db2.gz SEDFNXMYQVCZRK-BFHYXJOUSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H]1CCCO1)c1cc(F)ccc1[O-] ZINC000094617794 619132847 /nfs/dbraw/zinc/13/28/47/619132847.db2.gz BFQLZGXQAHJPHL-ZYHUDNBSSA-N 0 3 253.317 2.751 20 10 CFCDHN CO[C@]1(C(F)(F)F)CCN(Cc2cccc(C)c2O)C1 ZINC000895578241 619559845 /nfs/dbraw/zinc/55/98/45/619559845.db2.gz XGBTUIDCSBNEKO-CYBMUJFWSA-N 0 3 289.297 2.854 20 10 CFCDHN CC(C)([NH2+]Cc1ccccc1[O-])[C@H](O)c1ccccc1 ZINC000895658130 619577151 /nfs/dbraw/zinc/57/71/51/619577151.db2.gz HLLNQAVZIFXVDS-MRXNPFEDSA-N 0 3 271.360 2.994 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC3(CCC3)CO2)c([O-])c1 ZINC000895789025 619606930 /nfs/dbraw/zinc/60/69/30/619606930.db2.gz KHUABOZZROWCDS-AWEZNQCLSA-N 0 3 261.365 2.749 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CSC[C@@H]3C2)c1[O-] ZINC000895780014 619608585 /nfs/dbraw/zinc/60/85/85/619608585.db2.gz ZOIKWCMOFBBYNF-PHIMTYICSA-N 0 3 299.823 2.849 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c1[O-] ZINC000895780014 619608586 /nfs/dbraw/zinc/60/85/86/619608586.db2.gz ZOIKWCMOFBBYNF-PHIMTYICSA-N 0 3 299.823 2.849 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC[C@@H]1CC(C)(C)CO1 ZINC000895802799 619611772 /nfs/dbraw/zinc/61/17/72/619611772.db2.gz PZVMFNVRFYACTI-CYBMUJFWSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1(C2(O)CCC2)CCC1 ZINC000895869398 619626932 /nfs/dbraw/zinc/62/69/32/619626932.db2.gz XYHYSKMVLXUYGP-UHFFFAOYSA-N 0 3 275.392 2.876 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000896495007 619748705 /nfs/dbraw/zinc/74/87/05/619748705.db2.gz KIQLBGKORLLBNP-UHFFFAOYSA-N 0 3 285.391 2.814 20 10 CFCDHN C[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)CCO1 ZINC000896577437 619765676 /nfs/dbraw/zinc/76/56/76/619765676.db2.gz LHGJEZMNQUJCKP-FOSCPCJNSA-N 0 3 274.408 2.877 20 10 CFCDHN CC[C@@](O)(CCC(F)(F)F)C[NH2+]Cc1ccccc1[O-] ZINC000897523207 620204020 /nfs/dbraw/zinc/20/40/20/620204020.db2.gz RSOKBMKWWMJKAE-CYBMUJFWSA-N 0 3 291.313 2.965 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](CCO)C1CCCC1 ZINC000897883186 620297611 /nfs/dbraw/zinc/29/76/11/620297611.db2.gz XRRRDUAZNKFRTP-HNNXBMFYSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(O)c(CN[C@H]2c3ccccc3OC[C@H]2CO)c1 ZINC000897950332 620309608 /nfs/dbraw/zinc/30/96/08/620309608.db2.gz BQOLTPJRAWEKSP-RDTXWAMCSA-N 0 3 299.370 2.532 20 10 CFCDHN CCOc1ccc(C[NH2+]CCN2CCC(C)(C)C2)c([O-])c1 ZINC000898035746 620327871 /nfs/dbraw/zinc/32/78/71/620327871.db2.gz ZITGEKKJCKKJDH-UHFFFAOYSA-N 0 3 292.423 2.612 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H]2C=C[C@H]3C[C@@H]2CO3)c([O-])c1 ZINC000926936729 620427705 /nfs/dbraw/zinc/42/77/05/620427705.db2.gz MGCDEOHQCLEBMT-XQLPTFJDSA-N 0 3 273.376 2.942 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1ccccc1[O-] ZINC000926964391 620433925 /nfs/dbraw/zinc/43/39/25/620433925.db2.gz RNESEZQWVUGPCU-GXFFZTMASA-N 0 3 290.329 2.925 20 10 CFCDHN CCC[C@@H](O)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000927019960 620440233 /nfs/dbraw/zinc/44/02/33/620440233.db2.gz VBYUDJREOXYRBW-CMPLNLGQSA-N 0 3 255.333 2.733 20 10 CFCDHN C[C@]12CSC[C@H]1C[N@H+](Cc1cc(F)ccc1[O-])C2 ZINC000898423558 620462407 /nfs/dbraw/zinc/46/24/07/620462407.db2.gz YHQQUEKUXQXSSY-RISCZKNCSA-N 0 3 267.369 2.716 20 10 CFCDHN C[C@]12CSC[C@H]1C[N@@H+](Cc1cc(F)ccc1[O-])C2 ZINC000898423558 620462408 /nfs/dbraw/zinc/46/24/08/620462408.db2.gz YHQQUEKUXQXSSY-RISCZKNCSA-N 0 3 267.369 2.716 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CC1)c1cc(Cl)c(Cl)cc1[O-] ZINC000902403716 621068816 /nfs/dbraw/zinc/06/88/16/621068816.db2.gz APZFYQZNIJHRTB-ZETCQYMHSA-N 0 3 275.179 2.841 20 10 CFCDHN C[C@@H](NC[C@H]1CCCCC[NH2+]1)c1ccc(F)cc1[O-] ZINC000902484531 621110996 /nfs/dbraw/zinc/11/09/96/621110996.db2.gz WCXRRIYCKOYJSV-DGCLKSJQSA-N 0 3 266.360 2.714 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC(CC(N)=O)C2)c1[O-] ZINC000903255179 621300654 /nfs/dbraw/zinc/30/06/54/621300654.db2.gz XVBNARUABUBJMR-BMQDGWLCSA-N 0 3 296.798 2.659 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(C3(O)CCC3)CC1)CC2 ZINC000903257386 621301073 /nfs/dbraw/zinc/30/10/73/621301073.db2.gz FTPNXQWKLLHPCW-ZDUSSCGKSA-N 0 3 273.376 2.664 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c2c1c(F)ccc2[O-] ZINC000903286228 621318063 /nfs/dbraw/zinc/31/80/63/621318063.db2.gz DUQDQFKLMHLKTC-YRVIWUBHSA-N 0 3 289.350 2.845 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H](CO)CCc1ccccc1)CC2 ZINC000903287078 621318603 /nfs/dbraw/zinc/31/86/03/621318603.db2.gz BFDAYESCLCEZMJ-IRXDYDNUSA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@H](NCc1cn(C)nc1OC)c1ccc(C)cc1O ZINC000903338355 621333900 /nfs/dbraw/zinc/33/39/00/621333900.db2.gz QMCRWUQOENEEMC-AWEZNQCLSA-N 0 3 289.379 2.684 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2COC[C@@H]2C)c2c1c(F)ccc2[O-] ZINC000903397775 621350323 /nfs/dbraw/zinc/35/03/23/621350323.db2.gz ZISCDPAQVKFXBA-QCZKYFFMSA-N 0 3 265.328 2.704 20 10 CFCDHN Cc1ccc(C[NH2+]CC2CCSCC2)c([O-])c1 ZINC000877028621 623018327 /nfs/dbraw/zinc/01/83/27/623018327.db2.gz BGZUUODHPQEWTA-UHFFFAOYSA-N 0 3 251.395 2.933 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@H](C)C2)c([O-])c1 ZINC000157749775 623056299 /nfs/dbraw/zinc/05/62/99/623056299.db2.gz FNYJZEBOAYAFNF-HZSPNIEDSA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1csc(CC[NH2+]Cc2cc(F)ccc2[O-])n1 ZINC000226584510 623083792 /nfs/dbraw/zinc/08/37/92/623083792.db2.gz IUNFCBQDTLOUPG-UHFFFAOYSA-N 0 3 266.341 2.629 20 10 CFCDHN COCCOCCCC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000168750576 623102542 /nfs/dbraw/zinc/10/25/42/623102542.db2.gz RAZBGPDHKKMJLL-AWEZNQCLSA-N 0 3 281.396 2.794 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)[C@H]2CCOC2)c1[O-] ZINC000169090412 623113484 /nfs/dbraw/zinc/11/34/84/623113484.db2.gz CJRSURDUOQKFJZ-ZJUUUORDSA-N 0 3 285.771 2.569 20 10 CFCDHN C[C@@H]1CCC[C@H]1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000230650193 623288514 /nfs/dbraw/zinc/28/85/14/623288514.db2.gz SBDWMNWQXHOPPF-MNOVXSKESA-N 0 3 263.337 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](O)CC(C)C)c1[O-] ZINC000230934274 623310305 /nfs/dbraw/zinc/31/03/05/623310305.db2.gz NDZIBFLKSUOFGG-GFCCVEGCSA-N 0 3 287.787 2.551 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@]2(C)CCCOC2)c1[O-] ZINC000230935611 623310396 /nfs/dbraw/zinc/31/03/96/623310396.db2.gz QQZBRWXGFHXCLB-CQSZACIVSA-N 0 3 285.771 2.713 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@H]2CCOC2)c1[O-] ZINC000230935825 623312868 /nfs/dbraw/zinc/31/28/68/623312868.db2.gz LBLWKZITTGCCJA-JTQLQIEISA-N 0 3 285.771 2.570 20 10 CFCDHN CCN(C)c1ccc(CN2CCC[C@@H](n3ccnn3)C2)cc1 ZINC000823469356 623328302 /nfs/dbraw/zinc/32/83/02/623328302.db2.gz VVFRIGMCZOWUNF-QGZVFWFLSA-N 0 3 299.422 2.571 20 10 CFCDHN NC(=O)c1cccc(CN(Cc2ccccc2O)C2CC2)c1 ZINC000824608167 623532327 /nfs/dbraw/zinc/53/23/27/623532327.db2.gz BVJQHWUFVPBEEF-UHFFFAOYSA-N 0 3 296.370 2.656 20 10 CFCDHN CCC[N@H+](Cc1cnn2c1CCC2)Cc1ccccc1[O-] ZINC000824649285 623539074 /nfs/dbraw/zinc/53/90/74/623539074.db2.gz CQGSLJVIXRJSRD-UHFFFAOYSA-N 0 3 285.391 2.947 20 10 CFCDHN CCC[N@@H+](Cc1cnn2c1CCC2)Cc1ccccc1[O-] ZINC000824649285 623539075 /nfs/dbraw/zinc/53/90/75/623539075.db2.gz CQGSLJVIXRJSRD-UHFFFAOYSA-N 0 3 285.391 2.947 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCO[C@H](C(C)C)C1 ZINC000824799323 623567688 /nfs/dbraw/zinc/56/76/88/623567688.db2.gz MOGJRLOPMSKBGU-GUYCJALGSA-N 0 3 293.407 2.942 20 10 CFCDHN CO[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104069 623631615 /nfs/dbraw/zinc/63/16/15/623631615.db2.gz LYXMHSSYMXRVOF-LSDHHAIUSA-N 0 3 261.365 2.782 20 10 CFCDHN CO[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104069 623631619 /nfs/dbraw/zinc/63/16/19/623631619.db2.gz LYXMHSSYMXRVOF-LSDHHAIUSA-N 0 3 261.365 2.782 20 10 CFCDHN Cc1nn(C)c(C)c1CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000184941068 625664529 /nfs/dbraw/zinc/66/45/29/625664529.db2.gz HDEBNDVLSJZKGO-SNVBAGLBSA-N 0 3 291.370 2.775 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@H]2C2CC2)c([O-])c1 ZINC000825244896 623657445 /nfs/dbraw/zinc/65/74/45/623657445.db2.gz AMOKGOQAZIDOFT-ZFWWWQNUSA-N 0 3 261.365 2.927 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000827197020 623963591 /nfs/dbraw/zinc/96/35/91/623963591.db2.gz ULVSFAKATKDIBH-ZWKOTPCHSA-N 0 3 297.398 2.990 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000827197020 623963594 /nfs/dbraw/zinc/96/35/94/623963594.db2.gz ULVSFAKATKDIBH-ZWKOTPCHSA-N 0 3 297.398 2.990 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827285073 623980763 /nfs/dbraw/zinc/98/07/63/623980763.db2.gz XVCYVKBKYLBAMA-SWLSCSKDSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827285073 623980769 /nfs/dbraw/zinc/98/07/69/623980769.db2.gz XVCYVKBKYLBAMA-SWLSCSKDSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827285072 623981370 /nfs/dbraw/zinc/98/13/70/623981370.db2.gz XVCYVKBKYLBAMA-IUODEOHRSA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1[O-] ZINC000827285072 623981372 /nfs/dbraw/zinc/98/13/72/623981372.db2.gz XVCYVKBKYLBAMA-IUODEOHRSA-N 0 3 281.783 2.822 20 10 CFCDHN COc1ccc2c(c1)CC[N@@H+](Cc1ccccc1[O-])C2 ZINC000827305132 623985013 /nfs/dbraw/zinc/98/50/13/623985013.db2.gz NCVJOJRPZQHZLH-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN COc1ccc2c(c1)CC[N@H+](Cc1ccccc1[O-])C2 ZINC000827305132 623985018 /nfs/dbraw/zinc/98/50/18/623985018.db2.gz NCVJOJRPZQHZLH-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN C[C@@H](NC(=O)[C@@H](C)N1CCCCCC1)c1ccccc1O ZINC000827937194 624131415 /nfs/dbraw/zinc/13/14/15/624131415.db2.gz OBHHKLXPJDPQCN-ZIAGYGMSSA-N 0 3 290.407 2.834 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](c1ccncc1)C1(CO)CCC1 ZINC000827933637 624131468 /nfs/dbraw/zinc/13/14/68/624131468.db2.gz AATNBCCZHKAZOD-KRWDZBQOSA-N 0 3 298.386 2.781 20 10 CFCDHN [O-]c1c(F)cccc1C[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000827947644 624136283 /nfs/dbraw/zinc/13/62/83/624136283.db2.gz ALROBHXEFWNXPS-AWEZNQCLSA-N 0 3 292.398 2.743 20 10 CFCDHN Cc1n[nH]cc1[C@H](C)NCc1ccc2c(c1)CCCN2C ZINC000180331483 625016770 /nfs/dbraw/zinc/01/67/70/625016770.db2.gz ZGLQUBVONFKVJC-LBPRGKRZSA-N 0 3 284.407 2.951 20 10 CFCDHN CC[C@H]1CN(Cc2cccc(C)c2O)CCN1CC(F)F ZINC000180543082 625028523 /nfs/dbraw/zinc/02/85/23/625028523.db2.gz SDPBFPWOVNAGKI-AWEZNQCLSA-N 0 3 298.377 2.862 20 10 CFCDHN CO[C@@]1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000180816933 625041973 /nfs/dbraw/zinc/04/19/73/625041973.db2.gz OGDYJTWVIWROGV-HIFRSBDPSA-N 0 3 267.344 2.825 20 10 CFCDHN C[C@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(F)ccc1[O-] ZINC000185369470 625719936 /nfs/dbraw/zinc/71/99/36/625719936.db2.gz MMVAVKNNJIJYOH-QWRGUYRKSA-N 0 3 266.360 2.665 20 10 CFCDHN C[C@H](C[C@H]1CCOC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834624325 625740927 /nfs/dbraw/zinc/74/09/27/625740927.db2.gz JMNOSUUFOCXRPE-BZPMIXESSA-N 0 3 261.365 2.784 20 10 CFCDHN Cc1cncc(C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000834694855 625788227 /nfs/dbraw/zinc/78/82/27/625788227.db2.gz YJHOEMADRLCQCZ-CQSZACIVSA-N 0 3 254.333 2.873 20 10 CFCDHN Cc1cncc(C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000834694775 625788554 /nfs/dbraw/zinc/78/85/54/625788554.db2.gz YJHOEMADRLCQCZ-AWEZNQCLSA-N 0 3 254.333 2.873 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1ccc(O)cc1 ZINC000083445916 625850077 /nfs/dbraw/zinc/85/00/77/625850077.db2.gz PUYGJRFJEOFIDG-UHFFFAOYSA-N 0 3 261.296 2.569 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[C@H]2O)c([O-])c1 ZINC000834906302 625917900 /nfs/dbraw/zinc/91/79/00/625917900.db2.gz OOZJDILASUPWMH-MELADBBJSA-N 0 3 263.381 2.821 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](O)C1CCC1)c1ccc(C)cc1[O-] ZINC000834906968 625918904 /nfs/dbraw/zinc/91/89/04/625918904.db2.gz VGJINXQFYTWBSR-GOEBONIOSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2cnc(C)cn2)c([O-])c1 ZINC000834908135 625919983 /nfs/dbraw/zinc/91/99/83/625919983.db2.gz HBIVLILDHQFJNS-CYBMUJFWSA-N 0 3 271.364 2.692 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CN)C1CC1)c1cc(Br)ccc1[O-] ZINC000817960758 625964216 /nfs/dbraw/zinc/96/42/16/625964216.db2.gz RDDCOCCCHGPLLB-PELKAZGASA-N 0 3 299.212 2.543 20 10 CFCDHN OCc1ccccc1CNCc1ccc2c(c1)CCCO2 ZINC000921585393 625991568 /nfs/dbraw/zinc/99/15/68/625991568.db2.gz PZLCYMMXMWOXRD-UHFFFAOYSA-N 0 3 283.371 2.794 20 10 CFCDHN CC[C@H]([NH2+]C[C@](C)(O)C(C)C)c1ccccc1[O-] ZINC000186189168 626011921 /nfs/dbraw/zinc/01/19/21/626011921.db2.gz CUJHOACGYZHJQP-ZFWWWQNUSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H](CNC(=O)OC(C)(C)C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000227685749 626012265 /nfs/dbraw/zinc/01/22/65/626012265.db2.gz YGWQRTSFWBYXOT-NEPJUHHUSA-N 0 3 294.395 2.956 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1cnn(C2CCC2)c1 ZINC000921652822 626047835 /nfs/dbraw/zinc/04/78/35/626047835.db2.gz RTQSIGSSIPXYOG-UHFFFAOYSA-N 0 3 257.337 2.604 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCc1nc2c(s1)CCC2 ZINC000922718208 626350344 /nfs/dbraw/zinc/35/03/44/626350344.db2.gz PFVSQWKDIICBLF-UHFFFAOYSA-N 0 3 274.389 2.670 20 10 CFCDHN Oc1cc2c(cc1CN[C@@H]1CCCc3cccnc31)OCO2 ZINC000922883912 626387472 /nfs/dbraw/zinc/38/74/72/626387472.db2.gz VRUFUQDDBPIAAP-CYBMUJFWSA-N 0 3 298.342 2.683 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cccc3c2OCC3)c([O-])c1 ZINC000922944554 626429539 /nfs/dbraw/zinc/42/95/39/626429539.db2.gz PCLJPOIPUTTYPX-UHFFFAOYSA-N 0 3 285.343 2.626 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1CCC2(CCC2)O1 ZINC000922969963 626436474 /nfs/dbraw/zinc/43/64/74/626436474.db2.gz XZUBFYVCMXZLCK-ZDUSSCGKSA-N 0 3 291.391 2.982 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)C1CC1 ZINC000838983036 626518545 /nfs/dbraw/zinc/51/85/45/626518545.db2.gz KKPNSEDPHCDEAP-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)C1CC1 ZINC000838983036 626518546 /nfs/dbraw/zinc/51/85/46/626518546.db2.gz KKPNSEDPHCDEAP-INIZCTEOSA-N 0 3 263.381 2.765 20 10 CFCDHN CCN(CC)c1ccc(CN2CC(C(C)(C)O)C2)cc1 ZINC000839139656 626528416 /nfs/dbraw/zinc/52/84/16/626528416.db2.gz JENJKNJTQFGMPR-UHFFFAOYSA-N 0 3 276.424 2.736 20 10 CFCDHN CC[C@@H](N[C@H](C)c1ccn(C)n1)c1ccccc1O ZINC000839192686 626530950 /nfs/dbraw/zinc/53/09/50/626530950.db2.gz VXOOEICTUYXKQS-DGCLKSJQSA-N 0 3 259.353 2.928 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000761223933 626817066 /nfs/dbraw/zinc/81/70/66/626817066.db2.gz VIZJQSBIXPXROI-UONOGXRCSA-N 0 3 299.798 2.638 20 10 CFCDHN CCO[C@H]1COCC[C@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000761223932 626817512 /nfs/dbraw/zinc/81/75/12/626817512.db2.gz VIZJQSBIXPXROI-KGLIPLIRSA-N 0 3 299.798 2.638 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCC2CC(O)C2)c2c1c(F)ccc2[O-] ZINC000762652153 626928524 /nfs/dbraw/zinc/92/85/24/626928524.db2.gz WAXZGDOKSVEAGO-ZUYNKMSQSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCC2CC(O)C2)c2c1c(F)ccc2[O-] ZINC000762652150 626928623 /nfs/dbraw/zinc/92/86/23/626928623.db2.gz WAXZGDOKSVEAGO-HHISKICNSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000765452343 627139142 /nfs/dbraw/zinc/13/91/42/627139142.db2.gz FEXSWMIHXXCZAT-MJBXVCDLSA-N 0 3 291.439 2.706 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCOCC2CCC2)c1[O-] ZINC000765679545 627154172 /nfs/dbraw/zinc/15/41/72/627154172.db2.gz RMDDATNTKABAGS-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000767728790 627280216 /nfs/dbraw/zinc/28/02/16/627280216.db2.gz SGDVETKBVZFJLG-OAHLLOKOSA-N 0 3 269.344 2.745 20 10 CFCDHN Oc1cc2c(cc1CN1CC[C@@H]1c1ccccc1)[C@H](O)CO2 ZINC000768439931 627342432 /nfs/dbraw/zinc/34/24/32/627342432.db2.gz QGEGIQKAVLKWPO-NVXWUHKLSA-N 0 3 297.354 2.765 20 10 CFCDHN CC(C)CC[N@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC1 ZINC000768441468 627343109 /nfs/dbraw/zinc/34/31/09/627343109.db2.gz LUJWWTHDXFJZPU-INIZCTEOSA-N 0 3 291.391 2.829 20 10 CFCDHN CC(C)CC[N@@H+](Cc1cc2c(cc1[O-])OC[C@@H]2O)C1CC1 ZINC000768441468 627343113 /nfs/dbraw/zinc/34/31/13/627343113.db2.gz LUJWWTHDXFJZPU-INIZCTEOSA-N 0 3 291.391 2.829 20 10 CFCDHN CCC[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768463615 627345530 /nfs/dbraw/zinc/34/55/30/627345530.db2.gz KKUJATQHRAEDPS-MLGOLLRUSA-N 0 3 291.391 2.830 20 10 CFCDHN CCC[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768463615 627345534 /nfs/dbraw/zinc/34/55/34/627345534.db2.gz KKUJATQHRAEDPS-MLGOLLRUSA-N 0 3 291.391 2.830 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCSC[C@@H]2C)c([O-])c1 ZINC000769429362 627437797 /nfs/dbraw/zinc/43/77/97/627437797.db2.gz YUBVXFCCPYMZQN-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCSC[C@@H]2C)c([O-])c1 ZINC000769429362 627437799 /nfs/dbraw/zinc/43/77/99/627437799.db2.gz YUBVXFCCPYMZQN-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000769451517 627440756 /nfs/dbraw/zinc/44/07/56/627440756.db2.gz MRKSRUGVXUZJNW-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000769451517 627440760 /nfs/dbraw/zinc/44/07/60/627440760.db2.gz MRKSRUGVXUZJNW-TZMCWYRMSA-N 0 3 279.380 2.526 20 10 CFCDHN C[C@H](N[C@@H](CO)c1ccsc1)c1ccccc1O ZINC000769987939 627494492 /nfs/dbraw/zinc/49/44/92/627494492.db2.gz WKFOJYIKXPKUQH-GWCFXTLKSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1ccsc1)c1ccccc1[O-] ZINC000769987939 627494498 /nfs/dbraw/zinc/49/44/98/627494498.db2.gz WKFOJYIKXPKUQH-GWCFXTLKSA-N 0 3 263.362 2.838 20 10 CFCDHN CN(CC(F)F)C1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000770504430 627526025 /nfs/dbraw/zinc/52/60/25/627526025.db2.gz FXPDRICYTMEKIJ-UHFFFAOYSA-N 0 3 284.350 2.554 20 10 CFCDHN COC(=O)CCC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000770510176 627526725 /nfs/dbraw/zinc/52/67/25/627526725.db2.gz LJOBIKHZAIIAJC-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN CCN(C)c1ccc(CN[C@@H](C)c2cnn(C)c2)cc1 ZINC000773840011 627862748 /nfs/dbraw/zinc/86/27/48/627862748.db2.gz PGGUNEBMPYEXJJ-ZDUSSCGKSA-N 0 3 272.396 2.727 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000775587253 628043239 /nfs/dbraw/zinc/04/32/39/628043239.db2.gz VFLMTYAUSGJZHW-WKSBVSIWSA-N 0 3 279.355 2.973 20 10 CFCDHN Cn1cnc2cc(C[N@H+](C)Cc3ccccc3[O-])ccc21 ZINC000775656197 628050249 /nfs/dbraw/zinc/05/02/49/628050249.db2.gz PVBQCYHKERQJER-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN Cn1cnc2cc(C[N@@H+](C)Cc3ccccc3[O-])ccc21 ZINC000775656197 628050252 /nfs/dbraw/zinc/05/02/52/628050252.db2.gz PVBQCYHKERQJER-UHFFFAOYSA-N 0 3 281.359 2.911 20 10 CFCDHN COC(=O)/C(C)=C/CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775836634 628074026 /nfs/dbraw/zinc/07/40/26/628074026.db2.gz OQMKKBRYDVVXGL-XSNHNAGMSA-N 0 3 276.380 2.523 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)CC(F)(F)F)c1[O-] ZINC000776252842 628122731 /nfs/dbraw/zinc/12/27/31/628122731.db2.gz GDAUKNQQARKYBQ-JTQLQIEISA-N 0 3 297.704 2.757 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1([C@H](C)CCO)CCC1 ZINC000776258326 628123056 /nfs/dbraw/zinc/12/30/56/628123056.db2.gz WCQHAORJUIUJJH-CYBMUJFWSA-N 0 3 293.407 2.679 20 10 CFCDHN CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2ccccc2[O-])CCO1 ZINC000778630914 628321579 /nfs/dbraw/zinc/32/15/79/628321579.db2.gz GZCCWNQFBWEFPJ-BBRMVZONSA-N 0 3 263.381 2.933 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000779025246 628346989 /nfs/dbraw/zinc/34/69/89/628346989.db2.gz FEGFNTJHVWBFHI-INIZCTEOSA-N 0 3 279.355 2.924 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000779025246 628346990 /nfs/dbraw/zinc/34/69/90/628346990.db2.gz FEGFNTJHVWBFHI-INIZCTEOSA-N 0 3 279.355 2.924 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000779062159 628349083 /nfs/dbraw/zinc/34/90/83/628349083.db2.gz PXHBPXJKLSGIEZ-GXTWGEPZSA-N 0 3 271.364 2.644 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCn2ccnc2C1)c1ccccc1[O-] ZINC000779062161 628349090 /nfs/dbraw/zinc/34/90/90/628349090.db2.gz PXHBPXJKLSGIEZ-JSGCOSHPSA-N 0 3 271.364 2.644 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCn3ccnc3C2)c([O-])c1 ZINC000779066594 628349340 /nfs/dbraw/zinc/34/93/40/628349340.db2.gz SKLDMQLQWFFPJU-QWHCGFSZSA-N 0 3 271.364 2.563 20 10 CFCDHN C[C@H](Cc1cccc(O)c1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779072811 628349945 /nfs/dbraw/zinc/34/99/45/628349945.db2.gz LPDMHEJPPKMAHJ-LLVKDONJSA-N 0 3 275.323 2.958 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@@H]1COc2ccccc2O1 ZINC000779092458 628351887 /nfs/dbraw/zinc/35/18/87/628351887.db2.gz BIOCTCRYFVDBJV-CQSZACIVSA-N 0 3 285.343 2.712 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000783510719 628714528 /nfs/dbraw/zinc/71/45/28/628714528.db2.gz SHZFKDJVKQTBJT-GXTWGEPZSA-N 0 3 260.381 2.527 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC(CCCO)CC2)c([O-])c1 ZINC000783600267 628725549 /nfs/dbraw/zinc/72/55/49/628725549.db2.gz XVWXWERLKLCSEH-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000784036302 628767738 /nfs/dbraw/zinc/76/77/38/628767738.db2.gz SSVORPOUPAYVTB-IUODEOHRSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000784036302 628767741 /nfs/dbraw/zinc/76/77/41/628767741.db2.gz SSVORPOUPAYVTB-IUODEOHRSA-N 0 3 291.391 2.686 20 10 CFCDHN COCC[C@@H](Cc1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000784626303 628832121 /nfs/dbraw/zinc/83/21/21/628832121.db2.gz YTDIQMNIJITNOO-AWEZNQCLSA-N 0 3 275.348 2.723 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000790617827 629252761 /nfs/dbraw/zinc/25/27/61/629252761.db2.gz CVZBSRSEKRYPDH-UHFFFAOYSA-N 0 3 297.358 2.609 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCOC(C)(C)C1 ZINC000835059947 629361677 /nfs/dbraw/zinc/36/16/77/629361677.db2.gz MGYPWZSECCBDHB-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOC(=O)C1(C[NH2+]Cc2cc(F)ccc2[O-])CCCC1 ZINC000792194422 629408518 /nfs/dbraw/zinc/40/85/18/629408518.db2.gz CTMHWNJGIVFUHO-UHFFFAOYSA-N 0 3 295.354 2.744 20 10 CFCDHN CCOC(=O)C1(C[NH2+]Cc2ccccc2[O-])CCCC1 ZINC000792196945 629409391 /nfs/dbraw/zinc/40/93/91/629409391.db2.gz YESRXOHPHFEFGF-UHFFFAOYSA-N 0 3 277.364 2.605 20 10 CFCDHN FC1(CNCc2ccc(N3CCSCC3)cc2)CC1 ZINC000792921574 629466169 /nfs/dbraw/zinc/46/61/69/629466169.db2.gz QCWBQONNVGMQAO-UHFFFAOYSA-N 0 3 280.412 2.832 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc3ccc(C)cn23)c([O-])c1 ZINC000793388155 629536070 /nfs/dbraw/zinc/53/60/70/629536070.db2.gz NMOTUGWGDBTZQU-UHFFFAOYSA-N 0 3 297.358 2.647 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC000793620154 629579950 /nfs/dbraw/zinc/57/99/50/629579950.db2.gz MBXPMNVKEHFPIU-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC000793620154 629579953 /nfs/dbraw/zinc/57/99/53/629579953.db2.gz MBXPMNVKEHFPIU-QGZVFWFLSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCn2ccnc2C1)c1ccc(C)cc1[O-] ZINC000794812382 629689482 /nfs/dbraw/zinc/68/94/82/629689482.db2.gz CDUHLXBKNFFTBV-UKRRQHHQSA-N 0 3 285.391 2.953 20 10 CFCDHN CC[C@H]([NH2+]C[C@@]1(OC)CCOC1)c1ccc(C)cc1[O-] ZINC000794813907 629689752 /nfs/dbraw/zinc/68/97/52/629689752.db2.gz KGIKGRSQTQPCJP-HOCLYGCPSA-N 0 3 279.380 2.547 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794812052 629689781 /nfs/dbraw/zinc/68/97/81/629689781.db2.gz BUIRBDQUKADBEL-ZMSDIMECSA-N 0 3 293.407 2.935 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794816223 629690295 /nfs/dbraw/zinc/69/02/95/629690295.db2.gz YFGFZQWBFUPTJI-CQSZACIVSA-N 0 3 292.423 2.904 20 10 CFCDHN CC[C@H]([NH2+]C1COC(C)(C)OC1)c1ccc(C)cc1[O-] ZINC000794819949 629690963 /nfs/dbraw/zinc/69/09/63/629690963.db2.gz ZNSFJKILSFUXJS-AWEZNQCLSA-N 0 3 279.380 2.893 20 10 CFCDHN CC(C)N(Cc1cnc[nH]1)Cc1ccc(N(C)C)cc1 ZINC000796444493 629918693 /nfs/dbraw/zinc/91/86/93/629918693.db2.gz DTACJHMUFLZFAY-UHFFFAOYSA-N 0 3 272.396 2.886 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000796488634 629925500 /nfs/dbraw/zinc/92/55/00/629925500.db2.gz HWETWAHDLXNRIH-UHFFFAOYSA-N 0 3 275.270 2.833 20 10 CFCDHN C[C@@H](CN(C)C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000806169919 630779218 /nfs/dbraw/zinc/77/92/18/630779218.db2.gz MAOHUPDJLNPQNO-JBLDHEPKSA-N 0 3 266.360 2.619 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCCSC1 ZINC000808430292 630990946 /nfs/dbraw/zinc/99/09/46/630990946.db2.gz NQCRRWUGDDLFET-NSHDSACASA-N 0 3 267.394 2.634 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1COc2ccccc21 ZINC000808450830 630994073 /nfs/dbraw/zinc/99/40/73/630994073.db2.gz BZQJNUVJHQOMAE-GFCCVEGCSA-N 0 3 285.343 2.667 20 10 CFCDHN CCN(CCC[NH+](C)C)Cc1cc(Cl)cc(F)c1[O-] ZINC000809750196 631280063 /nfs/dbraw/zinc/28/00/63/631280063.db2.gz QQDAGNOZAQYBGY-UHFFFAOYSA-N 0 3 288.794 2.958 20 10 CFCDHN C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763870 631282799 /nfs/dbraw/zinc/28/27/99/631282799.db2.gz AMYYGWSDTOFCPK-SMDDNHRTSA-N 0 3 282.815 2.818 20 10 CFCDHN C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763870 631282803 /nfs/dbraw/zinc/28/28/03/631282803.db2.gz AMYYGWSDTOFCPK-SMDDNHRTSA-N 0 3 282.815 2.818 20 10 CFCDHN C[S@@](=O)c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000809793619 631292088 /nfs/dbraw/zinc/29/20/88/631292088.db2.gz IMYKYUNRGGTXFR-HXUWFJFHSA-N 0 3 293.363 2.559 20 10 CFCDHN CCC(N)(CC)C[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000841030298 631311210 /nfs/dbraw/zinc/31/12/10/631311210.db2.gz DRGSEFJSGOBPLO-UHFFFAOYSA-N 0 3 274.767 2.792 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](N)c2ccccc2)c([O-])c1 ZINC000841037379 631316841 /nfs/dbraw/zinc/31/68/41/631316841.db2.gz OVVWVEALVVTEOL-INIZCTEOSA-N 0 3 286.375 2.581 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088636 631336993 /nfs/dbraw/zinc/33/69/93/631336993.db2.gz BFEIKMKRKUSJFS-SNVBAGLBSA-N 0 3 298.789 2.949 20 10 CFCDHN COc1cccc(CN[C@@H]2COCc3ccccc32)c1O ZINC000841892218 631488891 /nfs/dbraw/zinc/48/88/91/631488891.db2.gz ZFFKMBPUWXELKY-OAHLLOKOSA-N 0 3 285.343 2.762 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@@]3(CCSC3)C2)cc1C ZINC000842622588 631684595 /nfs/dbraw/zinc/68/45/95/631684595.db2.gz IDZUVOKXQJTCLO-INIZCTEOSA-N 0 3 293.432 2.717 20 10 CFCDHN CC(=O)NCCN(C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000842633963 631687097 /nfs/dbraw/zinc/68/70/97/631687097.db2.gz UEZHDBZBLIRXIX-UHFFFAOYSA-N 0 3 292.423 2.566 20 10 CFCDHN CC(C)(C)OC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccccc2[O-])C1 ZINC000842785777 631740388 /nfs/dbraw/zinc/74/03/88/631740388.db2.gz UQTXFOOUBCLKOK-OCCSQVGLSA-N 0 3 291.391 2.992 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC(C)(C)[C@@]2(O)CCOC2)c1 ZINC000842917813 631781625 /nfs/dbraw/zinc/78/16/25/631781625.db2.gz BKFBEZWVUNYIRS-CXAGYDPISA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000842913665 631781746 /nfs/dbraw/zinc/78/17/46/631781746.db2.gz CXOVJNYRMNIOTJ-XQQFMLRXSA-N 0 3 251.370 2.840 20 10 CFCDHN C[NH2+]C[C@H]1CCCN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000843045279 631812319 /nfs/dbraw/zinc/81/23/19/631812319.db2.gz UECHKFNPFFUSIZ-GFCCVEGCSA-N 0 3 282.815 2.785 20 10 CFCDHN C[NH2+]C1CCN(Cc2c([O-])cc(C)cc2Cl)CC1 ZINC000843048978 631814939 /nfs/dbraw/zinc/81/49/39/631814939.db2.gz COHTXNSHMAVILH-UHFFFAOYSA-N 0 3 268.788 2.538 20 10 CFCDHN [NH3+][C@@H]1CCC[C@@H]2CN(Cc3c([O-])ccc(Cl)c3F)C[C@@H]21 ZINC000843059674 631821675 /nfs/dbraw/zinc/82/16/75/631821675.db2.gz PJYININPYKVAPD-GBIKHYSHSA-N 0 3 298.789 2.744 20 10 CFCDHN CC(C)[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H](O)C(F)(F)F ZINC000813328752 631903199 /nfs/dbraw/zinc/90/31/99/631903199.db2.gz UNIXQCJBKBWLGH-RYUDHWBXSA-N 0 3 295.276 2.569 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843417178 631949157 /nfs/dbraw/zinc/94/91/57/631949157.db2.gz QOZWHUWHETYGKE-CABCVRRESA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000843417178 631949159 /nfs/dbraw/zinc/94/91/59/631949159.db2.gz QOZWHUWHETYGKE-CABCVRRESA-N 0 3 261.365 2.783 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@]1(O)CCc2ccccc21 ZINC000843422084 631951396 /nfs/dbraw/zinc/95/13/96/631951396.db2.gz UQPYVPXFFKXXNZ-GOSISDBHSA-N 0 3 283.371 2.658 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@]1(O)CCc2ccccc21 ZINC000843422084 631951398 /nfs/dbraw/zinc/95/13/98/631951398.db2.gz UQPYVPXFFKXXNZ-GOSISDBHSA-N 0 3 283.371 2.658 20 10 CFCDHN Cc1ccc(O)c(CN2CCOC[C@@H]2C2CCC2)c1 ZINC000843429276 631956608 /nfs/dbraw/zinc/95/66/08/631956608.db2.gz UPFFBGKRWMSCLB-OAHLLOKOSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000816535871 632479630 /nfs/dbraw/zinc/47/96/30/632479630.db2.gz CTSFWSFGKLDODD-VXGBXAGGSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000816535871 632479634 /nfs/dbraw/zinc/47/96/34/632479634.db2.gz CTSFWSFGKLDODD-VXGBXAGGSA-N 0 3 298.789 2.901 20 10 CFCDHN COCc1ccc(CN[C@H](C)c2cc(OC)ccc2O)o1 ZINC000845971226 632607299 /nfs/dbraw/zinc/60/72/99/632607299.db2.gz IQLVSZIYPXUUDJ-LLVKDONJSA-N 0 3 291.347 2.991 20 10 CFCDHN C[C@@H](O)[C@H](NCc1ccccc1O)c1ccccc1F ZINC000846016919 632615474 /nfs/dbraw/zinc/61/54/74/632615474.db2.gz KLVBBSXJEZSZGE-BZNIZROVSA-N 0 3 275.323 2.743 20 10 CFCDHN COc1cccc(O)c1CNCc1cc(C)nc(C)c1 ZINC000817409511 632622499 /nfs/dbraw/zinc/62/24/99/632622499.db2.gz DAEWAWGHLOJHFC-UHFFFAOYSA-N 0 3 272.348 2.702 20 10 CFCDHN CCCN1C[C@H](C[NH2+][C@@H](CC)c2ccccc2[O-])CC1=O ZINC000817411725 632623462 /nfs/dbraw/zinc/62/34/62/632623462.db2.gz UOQXNGUMIYCFGR-ZFWWWQNUSA-N 0 3 290.407 2.691 20 10 CFCDHN CC[C@H]1C[C@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000817414714 632626475 /nfs/dbraw/zinc/62/64/75/632626475.db2.gz ITSXZLDWBOVVAZ-OLZOCXBDSA-N 0 3 253.317 2.579 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)COCC2CC2)c([O-])c1 ZINC000846074174 632630408 /nfs/dbraw/zinc/63/04/08/632630408.db2.gz YSVXKZVKMDXDQW-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CC(=O)N(CC)C1)c1ccc(C)cc1[O-] ZINC000846209705 632660456 /nfs/dbraw/zinc/66/04/56/632660456.db2.gz SLBXDASWNKGMDQ-DZGCQCFKSA-N 0 3 290.407 2.610 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](CO)CCF)c1[O-] ZINC000846209376 632660951 /nfs/dbraw/zinc/66/09/51/632660951.db2.gz QQPZEWZZGHISEY-KOLCDFICSA-N 0 3 275.751 2.725 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCc2c1ccc(=O)n2C)c1ccccc1[O-] ZINC000846215997 632663064 /nfs/dbraw/zinc/66/30/64/632663064.db2.gz OUHHBHIRVBHIRT-DOMZBBRYSA-N 0 3 298.386 2.819 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCC1(O)CCC1)CC2 ZINC000817585929 632671365 /nfs/dbraw/zinc/67/13/65/632671365.db2.gz JZCUWFAIFAJSPG-CYBMUJFWSA-N 0 3 261.365 2.664 20 10 CFCDHN CC[C@H]([NH2+]C1CCN(OC)CC1)c1ccc(C)cc1[O-] ZINC000817586896 632671415 /nfs/dbraw/zinc/67/14/15/632671415.db2.gz CMPMOKRWKZRZHK-HNNXBMFYSA-N 0 3 278.396 2.767 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](N)c1ccccc1)c1cc(F)ccc1[O-] ZINC000817955371 632755149 /nfs/dbraw/zinc/75/51/49/632755149.db2.gz WQSIFPZQAIVHBW-ABAIWWIYSA-N 0 3 274.339 2.882 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](N)C(C)C)c1ccc(F)cc1[O-] ZINC000817957396 632755599 /nfs/dbraw/zinc/75/55/99/632755599.db2.gz BQRWFJXNCFHIBO-CHWSQXEVSA-N 0 3 254.349 2.555 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1[O-] ZINC000817955817 632756011 /nfs/dbraw/zinc/75/60/11/632756011.db2.gz ILBDTLDCFCLFEO-GFCCVEGCSA-N 0 3 256.349 2.868 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1NCCc2ccccc21)c1ccccc1[O-] ZINC000817973663 632773340 /nfs/dbraw/zinc/77/33/40/632773340.db2.gz GBEGMQMRTVAOAH-GUYCJALGSA-N 0 3 282.387 2.930 20 10 CFCDHN C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000817977342 632775473 /nfs/dbraw/zinc/77/54/73/632775473.db2.gz HZYZETBETGBUEB-SRVKXCTJSA-N 0 3 258.365 2.932 20 10 CFCDHN C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817978141 632776197 /nfs/dbraw/zinc/77/61/97/632776197.db2.gz XAYPNTYITAEWOH-CIUDSAMLSA-N 0 3 276.302 2.797 20 10 CFCDHN CC[C@H](N)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817979883 632777264 /nfs/dbraw/zinc/77/72/64/632777264.db2.gz PXROJGOKGBFWOE-BDAKNGLRSA-N 0 3 276.302 2.799 20 10 CFCDHN C[C@H]([NH2+][C@@H](CN)C1CCCC1)c1ccc(F)cc1[O-] ZINC000817981450 632777697 /nfs/dbraw/zinc/77/76/97/632777697.db2.gz KBMUAKDIHLEARP-HZMBPMFUSA-N 0 3 266.360 2.699 20 10 CFCDHN CC[C@H](C)N1CCN(c2ccc(OC)cc2OC)CC1 ZINC000846745949 632781729 /nfs/dbraw/zinc/78/17/29/632781729.db2.gz PKYKRKXQMLCGGS-ZDUSSCGKSA-N 0 3 278.396 2.624 20 10 CFCDHN CO[C@H]1C[C@H]2C[C@H]([NH2+]Cc3ccccc3[O-])C[C@H]2C1 ZINC000818330900 632830637 /nfs/dbraw/zinc/83/06/37/632830637.db2.gz SMVRCQIGPJUGAP-ZJIFFRHRSA-N 0 3 261.365 2.685 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CC[C@H]2O)c1[O-] ZINC000818358325 632837389 /nfs/dbraw/zinc/83/73/89/632837389.db2.gz UZVWUTJNBHCEQB-GGZOMVNGSA-N 0 3 255.745 2.528 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCCN3CCCC[C@@H]13)CC2 ZINC000848568217 633291491 /nfs/dbraw/zinc/29/14/91/633291491.db2.gz BNWDORSGILIEGA-OAGGEKHMSA-N 0 3 286.419 2.986 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H]3CCC[C@@]3([NH3+])C2)c(Cl)c1 ZINC000857226176 635952948 /nfs/dbraw/zinc/95/29/48/635952948.db2.gz GUZKWGVIFLFPLN-XHDPSFHLSA-N 0 3 280.799 2.667 20 10 CFCDHN CCc1cccc(CN[C@@H](CO)c2ccsc2)c1O ZINC000848903170 633391137 /nfs/dbraw/zinc/39/11/37/633391137.db2.gz OGAPOVYJRHBBCS-AWEZNQCLSA-N 0 3 277.389 2.839 20 10 CFCDHN CCc1cccc(CN2CCO[C@@](C)(CC)C2)c1O ZINC000848905654 633391886 /nfs/dbraw/zinc/39/18/86/633391886.db2.gz LXQDICCNWIKFAA-INIZCTEOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H]([C@@H](CO)C2CC2)C2CC2)c1[O-] ZINC000848916128 633400495 /nfs/dbraw/zinc/40/04/95/633400495.db2.gz PELFUTXKPJLZSL-DLBZAZTESA-N 0 3 289.419 2.841 20 10 CFCDHN CCc1cccc(C[NH2+][C@H]([C@@H](CO)C2CC2)C2CC2)c1[O-] ZINC000848916131 633400519 /nfs/dbraw/zinc/40/05/19/633400519.db2.gz PELFUTXKPJLZSL-IRXDYDNUSA-N 0 3 289.419 2.841 20 10 CFCDHN CCc1cccc(CN2CCO[C@@H](C3CCC3)C2)c1O ZINC000848916544 633400598 /nfs/dbraw/zinc/40/05/98/633400598.db2.gz IJPWHERNKGJGBH-MRXNPFEDSA-N 0 3 275.392 2.956 20 10 CFCDHN Cc1cnc(OC2CC[NH+](Cc3ccccc3[O-])CC2)nc1 ZINC000848924922 633407947 /nfs/dbraw/zinc/40/79/47/633407947.db2.gz HKPFWGVVIANVFT-UHFFFAOYSA-N 0 3 299.374 2.534 20 10 CFCDHN COc1cncc(CNCc2ccc3c(c2)CCCN3C)c1 ZINC000850099388 633841068 /nfs/dbraw/zinc/84/10/68/633841068.db2.gz JDYHDVQFNVEJHE-UHFFFAOYSA-N 0 3 297.402 2.762 20 10 CFCDHN CCCn1nccc1CNCc1ccc(N(C)C)cc1C ZINC000850138180 633853126 /nfs/dbraw/zinc/85/31/26/633853126.db2.gz CFPOORPUNLTXBZ-UHFFFAOYSA-N 0 3 286.423 2.957 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](C)c1ccccn1 ZINC000850342780 633946784 /nfs/dbraw/zinc/94/67/84/633946784.db2.gz VSCCOISHOMLHPY-GFCCVEGCSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1cccc(CN[C@@H]2C[C@@H](O)c3ccccc32)c1O ZINC000850370399 633959522 /nfs/dbraw/zinc/95/95/22/633959522.db2.gz DNMSLXZHXIEEBL-HUUCEWRRSA-N 0 3 285.343 2.669 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)C1CCC1)c1ccc(C)cc1[O-] ZINC000850487164 634014476 /nfs/dbraw/zinc/01/44/76/634014476.db2.gz FSBBXQULRBJSLB-HUUCEWRRSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@@H]([S@](C)=O)C1)c1ccccc1[O-] ZINC000850500662 634019838 /nfs/dbraw/zinc/01/98/38/634019838.db2.gz GECGYAJJUPIXCM-HAKKBZAZSA-N 0 3 281.421 2.733 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C/C=C\CO)c1[O-] ZINC000850506554 634022125 /nfs/dbraw/zinc/02/21/25/634022125.db2.gz ANMAYYSPGRDWBM-XOULXFPDSA-N 0 3 255.745 2.553 20 10 CFCDHN C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)C1(CO)CC1 ZINC000850515806 634026324 /nfs/dbraw/zinc/02/63/24/634026324.db2.gz HZQAVECVQICEOF-SCVCMEIPSA-N 0 3 279.355 2.830 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1c([O-])cccc1OC)OCC ZINC000858209965 636156428 /nfs/dbraw/zinc/15/64/28/636156428.db2.gz DNRRAZXEWFCYRR-LBPRGKRZSA-N 0 3 267.369 2.696 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)CC1CC1)c1cc(F)ccc1[O-] ZINC000850545881 634047283 /nfs/dbraw/zinc/04/72/83/634047283.db2.gz UCRTVKJBSMUOJN-ZYHUDNBSSA-N 0 3 267.344 2.591 20 10 CFCDHN CO[C@@]1(C)C[C@H]1[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000850570790 634056102 /nfs/dbraw/zinc/05/61/02/634056102.db2.gz IYZUFMBPXADIMK-NRSCOXFESA-N 0 3 265.328 2.847 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CSCCS1 ZINC000857760988 636023247 /nfs/dbraw/zinc/02/32/47/636023247.db2.gz GZYADZUCCSUFEK-LLVKDONJSA-N 0 3 269.435 2.639 20 10 CFCDHN CN(C)c1cc(F)c(CNCC2(O)CCCCC2)cc1F ZINC000858119427 636132691 /nfs/dbraw/zinc/13/26/91/636132691.db2.gz PXRYJJKARZVOIC-UHFFFAOYSA-N 0 3 298.377 2.816 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2nccs2)cc1F ZINC000858117342 636133168 /nfs/dbraw/zinc/13/31/68/636133168.db2.gz KRFMXJVHASSYLA-UHFFFAOYSA-N 0 3 297.374 2.820 20 10 CFCDHN CO[C@@H]1CCC[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858172198 636147303 /nfs/dbraw/zinc/14/73/03/636147303.db2.gz MPRNIIXUPZHCOP-UKRRQHHQSA-N 0 3 284.350 2.688 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000858285635 636175693 /nfs/dbraw/zinc/17/56/93/636175693.db2.gz NKYQSXIPSOYVNA-AWEZNQCLSA-N 0 3 290.407 2.507 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNc1ccnc(CO)c1 ZINC000858413165 636226269 /nfs/dbraw/zinc/22/62/69/636226269.db2.gz AYXYPTUVEGCJKI-UHFFFAOYSA-N 0 3 271.364 2.560 20 10 CFCDHN CC(C)CC[C@@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000858485144 636267601 /nfs/dbraw/zinc/26/76/01/636267601.db2.gz KKFNEESJNCZJKJ-YPMHNXCESA-N 0 3 269.360 2.979 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000858485141 636268286 /nfs/dbraw/zinc/26/82/86/636268286.db2.gz KKFNEESJNCZJKJ-DGCLKSJQSA-N 0 3 269.360 2.979 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)CC(C)(C)O1 ZINC000194472501 636781243 /nfs/dbraw/zinc/78/12/43/636781243.db2.gz GAYJHYGCENFPFY-GFCCVEGCSA-N 0 3 275.392 2.880 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC[C@@H]2CCO)c1 ZINC000188009514 650311284 /nfs/dbraw/zinc/31/12/84/650311284.db2.gz LEZUUIMRMWXCLX-GUTXKFCHSA-N 0 3 263.381 2.902 20 10 CFCDHN CCN(Cc1cc(F)c(N(C)C)cc1F)C[C@@H]1CCOC1 ZINC000862222561 637290046 /nfs/dbraw/zinc/29/00/46/637290046.db2.gz DUPSCCWSNDRFKS-LBPRGKRZSA-N 0 3 298.377 2.889 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@@H](CO)C(C)(C)C)cc1F ZINC000862350403 637325240 /nfs/dbraw/zinc/32/52/40/637325240.db2.gz UBZXCFZORVMLKH-AWEZNQCLSA-N 0 3 286.366 2.527 20 10 CFCDHN CCn1nccc1CNCc1ccc(N(C)C)cc1C ZINC000119240931 637547753 /nfs/dbraw/zinc/54/77/53/637547753.db2.gz NSPOIGCXRWMDJD-UHFFFAOYSA-N 0 3 272.396 2.567 20 10 CFCDHN C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1ccccc1[O-] ZINC000865714349 638530793 /nfs/dbraw/zinc/53/07/93/638530793.db2.gz MYNGWFANKZVMNF-QGZVFWFLSA-N 0 3 289.350 2.615 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cccc3c2CCOC3)c([O-])c1 ZINC000865725960 638537608 /nfs/dbraw/zinc/53/76/08/638537608.db2.gz RHCGYEWHVOLVTL-UHFFFAOYSA-N 0 3 299.370 2.763 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CCC1)[C@@H]1CCCO1 ZINC000865735603 638543563 /nfs/dbraw/zinc/54/35/63/638543563.db2.gz RNUIDCONRNPLQH-HOTGVXAUSA-N 0 3 261.365 2.830 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1([C@H]2CCCCO2)CCC1 ZINC000865857995 638619411 /nfs/dbraw/zinc/61/94/11/638619411.db2.gz XXVCUIFJVOGCAE-OAHLLOKOSA-N 0 3 261.365 2.974 20 10 CFCDHN CC(C)[C@H]([NH2+][C@H](C)c1ccccc1[O-])[C@H](O)C(F)(F)F ZINC000866462888 638825595 /nfs/dbraw/zinc/82/55/95/638825595.db2.gz CHNQHAAVUMEQCH-ICCXJUOJSA-N 0 3 291.313 2.991 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H](C)c2ccnn2C)c1 ZINC000866614171 638854760 /nfs/dbraw/zinc/85/47/60/638854760.db2.gz LJUSCWSJBJPGBI-GHMZBOCLSA-N 0 3 275.352 2.546 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+]Cc1cc(F)ccc1[O-] ZINC000191671780 650516172 /nfs/dbraw/zinc/51/61/72/650516172.db2.gz MGXXSTVCGLIQDP-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@@H](NC(=O)[C@H](N)CC1CCCCC1)c1ccccc1O ZINC000870988611 641139997 /nfs/dbraw/zinc/13/99/97/641139997.db2.gz UZBKUGNRACGAAR-IUODEOHRSA-N 0 3 290.407 2.867 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCOC2=O)c([O-])c1 ZINC000872112592 641643494 /nfs/dbraw/zinc/64/34/94/641643494.db2.gz KLVWSUXEENQQDF-CHWSQXEVSA-N 0 3 277.364 2.695 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@@H]1CCOC1=O)c1ccccc1[O-] ZINC000872114897 641645953 /nfs/dbraw/zinc/64/59/53/641645953.db2.gz YPQYTBBJNXNOLV-TZMCWYRMSA-N 0 3 277.364 2.776 20 10 CFCDHN Oc1cc2c(cc1CN1CCO[C@@H](C(F)F)CC1)CCC2 ZINC000872678915 641894172 /nfs/dbraw/zinc/89/41/72/641894172.db2.gz OMPUZWYKKPUZTR-OAHLLOKOSA-N 0 3 297.345 2.737 20 10 CFCDHN C[C@H]([NH2+]CCCOC(F)F)c1cc(F)ccc1[O-] ZINC000194041617 650714105 /nfs/dbraw/zinc/71/41/05/650714105.db2.gz GUKSHWVLQHBUQN-QMMMGPOBSA-N 0 3 263.259 2.811 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CC(C)(C)CO2)c([O-])c1 ZINC000873155298 642037338 /nfs/dbraw/zinc/03/73/38/642037338.db2.gz HBFVKALNSCSZTK-AWEZNQCLSA-N 0 3 279.380 2.696 20 10 CFCDHN CC(C)[C@@H](C)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000081045620 650719919 /nfs/dbraw/zinc/71/99/19/650719919.db2.gz JYMDLKOHMJLPHH-JTQLQIEISA-N 0 3 251.326 2.503 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc(O)cc2)c([O-])c1 ZINC000083422088 650763317 /nfs/dbraw/zinc/76/33/17/650763317.db2.gz VTJDPZKZFCQWTC-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN Cc1ccc(CN2CCN(c3ccccc3O)CC2)c(O)c1 ZINC000876526818 642904825 /nfs/dbraw/zinc/90/48/25/642904825.db2.gz HAVUWPGOYRUMBQ-UHFFFAOYSA-N 0 3 298.386 2.728 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000876620541 642948900 /nfs/dbraw/zinc/94/89/00/642948900.db2.gz OVLXHFIPTJOLEN-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000876620541 642948905 /nfs/dbraw/zinc/94/89/05/642948905.db2.gz OVLXHFIPTJOLEN-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876680830 642970892 /nfs/dbraw/zinc/97/08/92/642970892.db2.gz JQZIDUIUYRXIKW-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876680830 642970894 /nfs/dbraw/zinc/97/08/94/642970894.db2.gz JQZIDUIUYRXIKW-HNNXBMFYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000876781133 643008164 /nfs/dbraw/zinc/00/81/64/643008164.db2.gz KAGSOCXMYRHDTQ-ZIAGYGMSSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000876781133 643008172 /nfs/dbraw/zinc/00/81/72/643008172.db2.gz KAGSOCXMYRHDTQ-ZIAGYGMSSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000876807446 643018766 /nfs/dbraw/zinc/01/87/66/643018766.db2.gz DRPZKIANAKJMKJ-GDBMZVCRSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000876807446 643018775 /nfs/dbraw/zinc/01/87/75/643018775.db2.gz DRPZKIANAKJMKJ-GDBMZVCRSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2COc3ccccc3O2)c([O-])c1 ZINC000876908133 643060100 /nfs/dbraw/zinc/06/01/00/643060100.db2.gz JUCDWOIOLXNBJR-AWEZNQCLSA-N 0 3 285.343 2.630 20 10 CFCDHN Cc1ccc(C[NH2+]C2CCN(c3ccccn3)CC2)c([O-])c1 ZINC000876930995 643069489 /nfs/dbraw/zinc/06/94/89/643069489.db2.gz ITVXSCVQLAWVSV-UHFFFAOYSA-N 0 3 297.402 2.854 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876959525 643082401 /nfs/dbraw/zinc/08/24/01/643082401.db2.gz LXVWKAXRNVKBAX-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)c2cccc(F)c2)c([O-])c1 ZINC000876989203 643095148 /nfs/dbraw/zinc/09/51/48/643095148.db2.gz VCRKLHRVZFTIRB-INIZCTEOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2cccc(F)c2)c([O-])c1 ZINC000876989204 643095285 /nfs/dbraw/zinc/09/52/85/643095285.db2.gz VCRKLHRVZFTIRB-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN COc1cccc2c1OC[C@@H]([NH2+]Cc1ccc(C)cc1[O-])C2 ZINC000877007134 643102772 /nfs/dbraw/zinc/10/27/72/643102772.db2.gz DSECLPQUHIKTAM-HNNXBMFYSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1ccc(C[NH2+]CCCNC(=O)OC(C)(C)C)c([O-])c1 ZINC000877016282 643105398 /nfs/dbraw/zinc/10/53/98/643105398.db2.gz FDGIQJBCXONMSB-UHFFFAOYSA-N 0 3 294.395 2.705 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)C2CCCCC2)c([O-])c1 ZINC000877068050 643132510 /nfs/dbraw/zinc/13/25/10/643132510.db2.gz PJLZQCTZAGFUSE-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(C)CCCC[C@H]2O)c([O-])c1 ZINC000877080669 643140459 /nfs/dbraw/zinc/14/04/59/643140459.db2.gz GJGDURHHSPHXBP-HZPDHXFCSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CSCCS2)c([O-])c1 ZINC000877083591 643142690 /nfs/dbraw/zinc/14/26/90/643142690.db2.gz AURMNMAAGHMMNH-LBPRGKRZSA-N 0 3 269.435 2.639 20 10 CFCDHN Cc1ccc(C[NH2+]CCOc2ncccc2Cl)c([O-])c1 ZINC000877084526 643143505 /nfs/dbraw/zinc/14/35/05/643143505.db2.gz HFZBFROXHWAPCR-UHFFFAOYSA-N 0 3 292.766 2.918 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)c([O-])c1 ZINC000877094575 643150483 /nfs/dbraw/zinc/15/04/83/643150483.db2.gz KIMNUKGZUAQTGY-HOCLYGCPSA-N 0 3 293.432 2.845 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(O)CCc2ccccc21 ZINC000877112973 643158020 /nfs/dbraw/zinc/15/80/20/643158020.db2.gz WLCOOJHABVMLKV-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)CCCO ZINC000877131821 643169308 /nfs/dbraw/zinc/16/93/08/643169308.db2.gz LTZKLURZLHFSFO-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1ccc(C[NH2+]CCCNc2ccccn2)c([O-])c1 ZINC000877157881 643180418 /nfs/dbraw/zinc/18/04/18/643180418.db2.gz XHBHCEOZNZUOHQ-UHFFFAOYSA-N 0 3 271.364 2.687 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c([O-])c1 ZINC000877395971 643258212 /nfs/dbraw/zinc/25/82/12/643258212.db2.gz PWLRLUUXYKOWPI-IAGOWNOFSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877465780 643286294 /nfs/dbraw/zinc/28/62/94/643286294.db2.gz WWLHPPDBDAQGBX-MRXNPFEDSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCSC[C@H](C)C2)c([O-])c1 ZINC000877474862 643292699 /nfs/dbraw/zinc/29/26/99/643292699.db2.gz HZAYVUAYRMOYQH-GFCCVEGCSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCSC[C@H](C)C2)c([O-])c1 ZINC000877474862 643292706 /nfs/dbraw/zinc/29/27/06/643292706.db2.gz HZAYVUAYRMOYQH-GFCCVEGCSA-N 0 3 251.395 2.886 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2Cc1ccc(C)cc1[O-] ZINC000877518429 643323173 /nfs/dbraw/zinc/32/31/73/643323173.db2.gz UMKWAQJBLGWQJT-IUKJFTNHSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1ccc(C)cc1[O-] ZINC000877518429 643323178 /nfs/dbraw/zinc/32/31/78/643323178.db2.gz UMKWAQJBLGWQJT-IUKJFTNHSA-N 0 3 273.376 2.556 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000877524018 643328758 /nfs/dbraw/zinc/32/87/58/643328758.db2.gz PQFUBQDRWSHEGV-CQSZACIVSA-N 0 3 284.359 2.968 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cnc(C)nc2C)c1O ZINC000877526229 643330193 /nfs/dbraw/zinc/33/01/93/643330193.db2.gz QTEOQLHEBBGMLT-JTQLQIEISA-N 0 3 287.363 2.658 20 10 CFCDHN CCC[C@]1(CO)CC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877536948 643340365 /nfs/dbraw/zinc/34/03/65/643340365.db2.gz DSUKRLXFISTISQ-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@]1(CO)CC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877536948 643340368 /nfs/dbraw/zinc/34/03/68/643340368.db2.gz DSUKRLXFISTISQ-INIZCTEOSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000877546003 643347347 /nfs/dbraw/zinc/34/73/47/643347347.db2.gz NPIZJWNNGUDRIA-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000877546003 643347350 /nfs/dbraw/zinc/34/73/50/643347350.db2.gz NPIZJWNNGUDRIA-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877609989 643397117 /nfs/dbraw/zinc/39/71/17/643397117.db2.gz GEAVWORPZVAXBJ-JSGCOSHPSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(CO)CCc3ccccc32)c([O-])c1 ZINC000877610008 643397390 /nfs/dbraw/zinc/39/73/90/643397390.db2.gz QASUUWYFNUEANM-LJQANCHMSA-N 0 3 297.398 2.667 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCN2C(C)(C)C)c([O-])c1 ZINC000877619743 643405918 /nfs/dbraw/zinc/40/59/18/643405918.db2.gz KRGPUPQKHAYDSP-AWEZNQCLSA-N 0 3 262.397 2.663 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1COc2cc(F)ccc2C1 ZINC000877630802 643415362 /nfs/dbraw/zinc/41/53/62/643415362.db2.gz NGWXVIWCFPYBRT-AWEZNQCLSA-N 0 3 287.334 2.933 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@@H]1[NH2+]Cc1c(C)cccc1[O-] ZINC000877639927 643424172 /nfs/dbraw/zinc/42/41/72/643424172.db2.gz SDTWRAAHLFXEHN-RDJZCZTQSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)[C@@H](C)c1ccccc1 ZINC000877640547 643425823 /nfs/dbraw/zinc/42/58/23/643425823.db2.gz OVEOBZVHZINAFN-KSSFIOAISA-N 0 3 285.387 2.955 20 10 CFCDHN COCCC1CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000877649857 643430828 /nfs/dbraw/zinc/43/08/28/643430828.db2.gz KUZMMBZYTYLSID-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](C1CCC1)[C@@H]1CCCO1 ZINC000877701524 643464574 /nfs/dbraw/zinc/46/45/74/643464574.db2.gz ZEIAJFMJCODSHF-HOTGVXAUSA-N 0 3 279.355 2.969 20 10 CFCDHN CN(Cc1cc(Cl)c(F)cc1[O-])[C@H]1C[NH+]2CCC1CC2 ZINC000877706246 643473612 /nfs/dbraw/zinc/47/36/12/643473612.db2.gz ITWHECXCHBJVBN-AWEZNQCLSA-N 0 3 298.789 2.711 20 10 CFCDHN CN1CC[C@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000877740170 643507809 /nfs/dbraw/zinc/50/78/09/643507809.db2.gz IVVOZZJZSZPXOE-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000877740170 643507812 /nfs/dbraw/zinc/50/78/12/643507812.db2.gz IVVOZZJZSZPXOE-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877741567 643509846 /nfs/dbraw/zinc/50/98/46/643509846.db2.gz WENRECLKUWVKEP-KGLIPLIRSA-N 0 3 293.432 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000877741567 643509854 /nfs/dbraw/zinc/50/98/54/643509854.db2.gz WENRECLKUWVKEP-KGLIPLIRSA-N 0 3 293.432 2.976 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1Cl ZINC000877741048 643511108 /nfs/dbraw/zinc/51/11/08/643511108.db2.gz MGSDNYAKWWIUHU-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)cc1Cl ZINC000877741048 643511118 /nfs/dbraw/zinc/51/11/18/643511118.db2.gz MGSDNYAKWWIUHU-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000877744370 643522423 /nfs/dbraw/zinc/52/24/23/643522423.db2.gz RZMMZRHVNVUNAT-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000877744370 643522427 /nfs/dbraw/zinc/52/24/27/643522427.db2.gz RZMMZRHVNVUNAT-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CCOC(=O)C1(C)CC([NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000877758187 643538282 /nfs/dbraw/zinc/53/82/82/643538282.db2.gz LWYVLNSMWZIUSF-FZWSLVFFSA-N 0 3 277.364 2.775 20 10 CFCDHN COC[C@H](CC1CCOCC1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877758279 643538310 /nfs/dbraw/zinc/53/83/10/643538310.db2.gz QSOOADXPNHPPLT-ZFWWWQNUSA-N 0 3 293.407 2.875 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](C(C)(C)O)C1 ZINC000877795631 643561758 /nfs/dbraw/zinc/56/17/58/643561758.db2.gz QLZGVHJPOPWEEF-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](C(C)(C)O)C1 ZINC000877795631 643561765 /nfs/dbraw/zinc/56/17/65/643561765.db2.gz QLZGVHJPOPWEEF-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H](C(C)(C)O)C2)c1[O-] ZINC000877796409 643562946 /nfs/dbraw/zinc/56/29/46/643562946.db2.gz FYEXSAASOJUSGC-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H](C(C)(C)O)C2)c1[O-] ZINC000877796409 643562948 /nfs/dbraw/zinc/56/29/48/643562948.db2.gz FYEXSAASOJUSGC-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CC(=O)Nc1ccc(C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000091956740 650912399 /nfs/dbraw/zinc/91/23/99/650912399.db2.gz WHGZDDITLIOEAE-UHFFFAOYSA-N 0 3 284.359 2.983 20 10 CFCDHN CC(=O)Nc1ccc(C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000091956740 650912401 /nfs/dbraw/zinc/91/24/01/650912401.db2.gz WHGZDDITLIOEAE-UHFFFAOYSA-N 0 3 284.359 2.983 20 10 CFCDHN CCCN(CCC)C(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879647278 644361425 /nfs/dbraw/zinc/36/14/25/644361425.db2.gz AAAZOSVENCFXEM-CYBMUJFWSA-N 0 3 278.396 2.691 20 10 CFCDHN C[C@@H]([NH2+]CCO[C@H]1CCCCO1)c1ccccc1[O-] ZINC000879648845 644362781 /nfs/dbraw/zinc/36/27/81/644362781.db2.gz BYCXMZKIAQZSLB-DOMZBBRYSA-N 0 3 265.353 2.586 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H]1COC(C)(C)O1)c1ccccc1[O-] ZINC000879649326 644362900 /nfs/dbraw/zinc/36/29/00/644362900.db2.gz NLBZVBFLRHQHIN-NEPJUHHUSA-N 0 3 265.353 2.584 20 10 CFCDHN CCC[C@@H](C)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651766 644364006 /nfs/dbraw/zinc/36/40/06/644364006.db2.gz JZDBDEVEEJZEAP-AGIUHOORSA-N 0 3 278.396 2.736 20 10 CFCDHN CCCCCNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651618 644364688 /nfs/dbraw/zinc/36/46/88/644364688.db2.gz DLKYIKMFTKKQAA-STQMWFEESA-N 0 3 278.396 2.738 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N[C@@H]1CCCC[C@H]1C)c1ccccc1[O-] ZINC000879652597 644365975 /nfs/dbraw/zinc/36/59/75/644365975.db2.gz GCTNYFIJNOJTJK-VNHYZAJKSA-N 0 3 290.407 2.738 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1[C@H](C)CCC[C@H]1C)c1ccccc1[O-] ZINC000879652223 644366087 /nfs/dbraw/zinc/36/60/87/644366087.db2.gz BIHOXIXJKFIEED-MCIONIFRSA-N 0 3 290.407 2.832 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N[C@H]1CCCC[C@@H]1C)c1ccccc1[O-] ZINC000879652600 644366158 /nfs/dbraw/zinc/36/61/58/644366158.db2.gz GCTNYFIJNOJTJK-YDHLFZDLSA-N 0 3 290.407 2.738 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](CC)CCO)c1ccccc1[O-] ZINC000094949536 650965743 /nfs/dbraw/zinc/96/57/43/650965743.db2.gz AMFMUGYUUZFWHO-GXTWGEPZSA-N 0 3 251.370 2.842 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@H]1c1cccnc1)OCO2 ZINC000024758598 645090916 /nfs/dbraw/zinc/09/09/16/645090916.db2.gz HVGGPNNJHVAQOK-AWEZNQCLSA-N 0 3 298.342 2.853 20 10 CFCDHN CC(C)N1CCC[C@H](C[NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000882983778 645542159 /nfs/dbraw/zinc/54/21/59/645542159.db2.gz OSMKIDPPFWGHQL-GFCCVEGCSA-N 0 3 298.377 2.880 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)Cc2ccoc2)c([O-])c1 ZINC000883276554 645718087 /nfs/dbraw/zinc/71/80/87/645718087.db2.gz MJLPTDBVGHAGOJ-HIFRSBDPSA-N 0 3 289.375 2.795 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](CO)Cc1ccoc1)c1ccccc1[O-] ZINC000883277476 645719900 /nfs/dbraw/zinc/71/99/00/645719900.db2.gz ZZVJYPBXINKGKY-ZBFHGGJFSA-N 0 3 289.375 2.877 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2(CO)CCCC2)c1 ZINC000135073564 646454275 /nfs/dbraw/zinc/45/42/75/646454275.db2.gz HCWHQTDMJSFKGI-CYBMUJFWSA-N 0 3 263.381 2.904 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CC(C)(C)CO1 ZINC000886306986 646961785 /nfs/dbraw/zinc/96/17/85/646961785.db2.gz HABKNKFCXACMLB-LBPRGKRZSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC2(CCC2)CO1 ZINC000886318625 646967767 /nfs/dbraw/zinc/96/77/67/646967767.db2.gz XXQWNBDYCRCIRK-CYBMUJFWSA-N 0 3 291.391 2.840 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520998 647026608 /nfs/dbraw/zinc/02/66/08/647026608.db2.gz ROEMCFAPCPVQNP-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[N@H+](CCN[C@@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520998 647026611 /nfs/dbraw/zinc/02/66/11/647026611.db2.gz ROEMCFAPCPVQNP-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[N@@H+](CCN[C@@H](C)c1c([O-])cccc1F)C(C)C ZINC000886520998 647026617 /nfs/dbraw/zinc/02/66/17/647026617.db2.gz ROEMCFAPCPVQNP-LBPRGKRZSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1c([O-])cccc1F ZINC000886524912 647029322 /nfs/dbraw/zinc/02/93/22/647029322.db2.gz TZZFHJSKXFFLPK-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000886670677 647101418 /nfs/dbraw/zinc/10/14/18/647101418.db2.gz UFVRFMMKHMCGGL-LZWOXQAQSA-N 0 3 293.407 2.671 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)Cc1ccccc1F)c1ccccc1[O-] ZINC000886673101 647103458 /nfs/dbraw/zinc/10/34/58/647103458.db2.gz ZZWZYCSNDIUJBC-TZMCWYRMSA-N 0 3 289.350 2.786 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@H]1CCCOC1)c1ccccc1[O-] ZINC000886788357 647137061 /nfs/dbraw/zinc/13/70/61/647137061.db2.gz ASCGNIQUKVRRTA-CWRNSKLLSA-N 0 3 293.407 2.875 20 10 CFCDHN CCC1([NH3+])CCN([C@H](C)c2cc([N+](=O)[O-])ccc2[O-])CC1 ZINC000925756943 648309918 /nfs/dbraw/zinc/30/99/18/648309918.db2.gz CGQPBKZLLOOSRA-LLVKDONJSA-N 0 3 293.367 2.565 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1C=C[C@H]2C[C@@H]1CO2)c1ccccc1[O-] ZINC000926940805 648665312 /nfs/dbraw/zinc/66/53/12/648665312.db2.gz WIVMQPITYKXGSF-RQJABVFESA-N 0 3 259.349 2.634 20 10 CFCDHN CC[C@@H]([NH2+]CC1CC2(C1)OCCO2)c1ccccc1[O-] ZINC000927000767 648678598 /nfs/dbraw/zinc/67/85/98/648678598.db2.gz JMNQSUWXTGZFBO-CQSZACIVSA-N 0 3 277.364 2.586 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@@H]2CCc3cccc([O-])c32)nc1 ZINC000927071671 648697662 /nfs/dbraw/zinc/69/76/62/648697662.db2.gz VCCRLYOMAWZRGZ-CQSZACIVSA-N 0 3 283.375 2.785 20 10 CFCDHN CC[C@@H]([NH2+]CCOC1CCOCC1)c1ccc(C)cc1[O-] ZINC000927078120 648700630 /nfs/dbraw/zinc/70/06/30/648700630.db2.gz FJXYEORLOOHPNM-MRXNPFEDSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@@H]([NH2+]CCO[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000927081672 648702850 /nfs/dbraw/zinc/70/28/50/648702850.db2.gz RAILVNBFCSNATR-UKRRQHHQSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@](O)(CN(C)Cc1ccccc1O)C(F)(F)F ZINC000929977516 649159476 /nfs/dbraw/zinc/15/94/76/649159476.db2.gz VQEPJDAGRMOPQJ-LBPRGKRZSA-N 0 3 277.286 2.527 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C(COC)COC ZINC000930351255 649236633 /nfs/dbraw/zinc/23/66/33/649236633.db2.gz NBQUEIZFIQWEQP-UHFFFAOYSA-N 0 3 281.396 2.656 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C(COC)COC ZINC000930351255 649236636 /nfs/dbraw/zinc/23/66/36/649236636.db2.gz NBQUEIZFIQWEQP-UHFFFAOYSA-N 0 3 281.396 2.656 20 10 CFCDHN Cc1cc(C[NH2+][C@@H](C)c2ccccc2[O-])c(C)nn1 ZINC000931558450 649454410 /nfs/dbraw/zinc/45/44/10/649454410.db2.gz UUSXFUOGFUCJFN-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)CC(C)C)c1[O-] ZINC000305784752 651078775 /nfs/dbraw/zinc/07/87/75/651078775.db2.gz RFVVQVGRKRHHGC-CYBMUJFWSA-N 0 3 271.788 2.851 20 10 CFCDHN CCCCN(C)CC[NH2+]Cc1c([O-])cccc1Cl ZINC000113342242 651191901 /nfs/dbraw/zinc/19/19/01/651191901.db2.gz BJNVUBQQKUHCNB-UHFFFAOYSA-N 0 3 270.804 2.867 20 10 CFCDHN Cc1ccc(C)c(CN2CCc3ncccc3C2)c1O ZINC001140182571 770263490 /nfs/dbraw/zinc/26/34/90/770263490.db2.gz VRORKXQJYKWFOK-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN CN1CCC[C@@H]2C[N@H+](Cc3c([O-])cccc3Cl)C[C@@H]21 ZINC001140341971 770530266 /nfs/dbraw/zinc/53/02/66/770530266.db2.gz NMFIMSCVEAGYLE-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CCC[C@@H]2C[N@@H+](Cc3c([O-])cccc3Cl)C[C@@H]21 ZINC001140341971 770530268 /nfs/dbraw/zinc/53/02/68/770530268.db2.gz NMFIMSCVEAGYLE-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCC1SCCS1 ZINC000693792073 775135166 /nfs/dbraw/zinc/13/51/66/775135166.db2.gz UBGXDSJDMUSUCU-UHFFFAOYSA-N 0 3 273.398 2.817 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccccc1[O-] ZINC000693890351 775230311 /nfs/dbraw/zinc/23/03/11/775230311.db2.gz PQHQJAYFRKJEDB-QWHCGFSZSA-N 0 3 262.397 2.916 20 10 CFCDHN C[C@@H](Cc1ccccn1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000694086830 775359917 /nfs/dbraw/zinc/35/99/17/775359917.db2.gz ZZFCQGGAHQGDCI-WFASDCNBSA-N 0 3 268.360 2.995 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@@H]1CCC[C@H]3C[C@H]31)OCO2 ZINC000694257528 775417970 /nfs/dbraw/zinc/41/79/70/775417970.db2.gz QWJYTHJGRZGPSI-GMXVVIOVSA-N 0 3 275.348 2.647 20 10 CFCDHN CN(C)c1ccc(CN2CCCC[C@@H](O)C2)c(Cl)c1 ZINC001140922318 775650366 /nfs/dbraw/zinc/65/03/66/775650366.db2.gz NXFYQDLYRLQGMR-CQSZACIVSA-N 0 3 282.815 2.753 20 10 CFCDHN C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2Cl)[C@@H]1CO ZINC001140921819 775651292 /nfs/dbraw/zinc/65/12/92/775651292.db2.gz RBXXWFCECJMYIF-MLGOLLRUSA-N 0 3 296.842 2.999 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)CC2)c1[O-] ZINC000293898471 775730830 /nfs/dbraw/zinc/73/08/30/775730830.db2.gz FGBJPLCSDGHVML-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)CC2)c1[O-] ZINC000293898471 775730832 /nfs/dbraw/zinc/73/08/32/775730832.db2.gz FGBJPLCSDGHVML-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CC[C@@H](C3CC3)O1)CC2 ZINC000722328701 776473382 /nfs/dbraw/zinc/47/33/82/776473382.db2.gz LDWQYTRBXNRWGA-LZWOXQAQSA-N 0 3 273.376 2.927 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@@H](F)C[C@H](CO)C1 ZINC001231587355 777268866 /nfs/dbraw/zinc/26/88/66/777268866.db2.gz ACTACVPMPOARDA-JSGCOSHPSA-N 0 3 289.350 2.698 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@@H](F)C[C@H](CO)C1 ZINC001231587355 777268874 /nfs/dbraw/zinc/26/88/74/777268874.db2.gz ACTACVPMPOARDA-JSGCOSHPSA-N 0 3 289.350 2.698 20 10 CFCDHN CCCNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1O ZINC001231592031 777271297 /nfs/dbraw/zinc/27/12/97/777271297.db2.gz FNBLPEIRJNMKDC-OAHLLOKOSA-N 0 3 290.407 2.581 20 10 CFCDHN COc1cc(CN2CCc3ccccc3C2)c(O)cc1O ZINC001231633115 777287764 /nfs/dbraw/zinc/28/77/64/777287764.db2.gz OXUUDFMWJMHKAS-UHFFFAOYSA-N 0 3 285.343 2.665 20 10 CFCDHN COC(=O)[C@@]1(C)CCCN1Cc1c(C)cc(C)cc1O ZINC001231843248 777344583 /nfs/dbraw/zinc/34/45/83/777344583.db2.gz UAZQKSXJMPGLHG-MRXNPFEDSA-N 0 3 277.364 2.537 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001231841870 777345751 /nfs/dbraw/zinc/34/57/51/777345751.db2.gz FIMOKORUQUXCST-PBHICJAKSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001231841870 777345753 /nfs/dbraw/zinc/34/57/53/777345753.db2.gz FIMOKORUQUXCST-PBHICJAKSA-N 0 3 277.408 2.992 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CC2CC(C2)C1 ZINC001231857589 777354579 /nfs/dbraw/zinc/35/45/79/777354579.db2.gz KZZKAFOLAXONSI-UHFFFAOYSA-N 0 3 260.381 2.603 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2[O-])CCN1C ZINC001231880542 777363412 /nfs/dbraw/zinc/36/34/12/777363412.db2.gz HNPZPUQQLAXWLD-CYBMUJFWSA-N 0 3 270.376 2.681 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccc3ccccc3c2[O-])CCN1C ZINC001231880542 777363416 /nfs/dbraw/zinc/36/34/16/777363416.db2.gz HNPZPUQQLAXWLD-CYBMUJFWSA-N 0 3 270.376 2.681 20 10 CFCDHN CN1CC[C@H]2C[N@H+](Cc3ccc4ccccc4c3[O-])C[C@H]21 ZINC001231880950 777364430 /nfs/dbraw/zinc/36/44/30/777364430.db2.gz OWXGSKBKWNPNSY-WMLDXEAASA-N 0 3 282.387 2.681 20 10 CFCDHN CN1CC[C@H]2C[N@@H+](Cc3ccc4ccccc4c3[O-])C[C@H]21 ZINC001231880950 777364432 /nfs/dbraw/zinc/36/44/32/777364432.db2.gz OWXGSKBKWNPNSY-WMLDXEAASA-N 0 3 282.387 2.681 20 10 CFCDHN COC(=O)c1c(CN2CCCC2)c2ccccc2n1C ZINC001232401082 777549059 /nfs/dbraw/zinc/54/90/59/777549059.db2.gz FEEDEMWIFSXFPT-UHFFFAOYSA-N 0 3 272.348 2.561 20 10 CFCDHN COC(=O)c1c(CN2CC3CC(C3)C2)c2ccccc2n1C ZINC001232404442 777549387 /nfs/dbraw/zinc/54/93/87/777549387.db2.gz UCSCGNQXRCOURC-UHFFFAOYSA-N 0 3 298.386 2.807 20 10 CFCDHN COc1cc(O)cc(CN(C)Cc2ccccc2O)c1 ZINC001232807451 777676749 /nfs/dbraw/zinc/67/67/49/777676749.db2.gz SVIFZXJWLMGAFB-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H]2c2cnccn2)c(O)c1 ZINC001232839555 777689104 /nfs/dbraw/zinc/68/91/04/777689104.db2.gz PFYHUPQRLYYPIT-MRXNPFEDSA-N 0 3 298.390 2.585 20 10 CFCDHN Oc1cc(CN2C3CCCC2CCC3)cc(O)c1O ZINC001233015353 777763633 /nfs/dbraw/zinc/76/36/33/777763633.db2.gz LHFLQIQVIBVVQO-UHFFFAOYSA-N 0 3 263.337 2.710 20 10 CFCDHN Oc1cc(CN2CC[C@H]3CCCC[C@@H]3C2)cc(O)c1O ZINC001233015365 777764708 /nfs/dbraw/zinc/76/47/08/777764708.db2.gz LPCUPXNBXPXKMW-CHWSQXEVSA-N 0 3 277.364 2.816 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@@]3(CCCO3)C2)c1O ZINC001233287775 777868465 /nfs/dbraw/zinc/86/84/65/777868465.db2.gz HBZMHGCXEKMVRF-HNNXBMFYSA-N 0 3 297.782 2.809 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)CC[C@@H]2C)c1[O-] ZINC001233288099 777869375 /nfs/dbraw/zinc/86/93/75/777869375.db2.gz WGAQWUYQPLBRJI-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H](CO)CC[C@@H]2C)c1[O-] ZINC001233288099 777869386 /nfs/dbraw/zinc/86/93/86/777869386.db2.gz WGAQWUYQPLBRJI-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN CC[N@H+](CCOC)Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727467 778055798 /nfs/dbraw/zinc/05/57/98/778055798.db2.gz NDDKHLYQBMSZFA-UHFFFAOYSA-N 0 3 293.285 2.759 20 10 CFCDHN CC[N@@H+](CCOC)Cc1cccc(OC(F)(F)F)c1[O-] ZINC001233727467 778055805 /nfs/dbraw/zinc/05/58/05/778055805.db2.gz NDDKHLYQBMSZFA-UHFFFAOYSA-N 0 3 293.285 2.759 20 10 CFCDHN C[N@H+](Cc1cccc(OC(F)(F)F)c1[O-])[C@H]1CCOC1 ZINC001233760609 778067597 /nfs/dbraw/zinc/06/75/97/778067597.db2.gz JAXQIRQWEROBGN-JTQLQIEISA-N 0 3 291.269 2.512 20 10 CFCDHN C[N@@H+](Cc1cccc(OC(F)(F)F)c1[O-])[C@H]1CCOC1 ZINC001233760609 778067604 /nfs/dbraw/zinc/06/76/04/778067604.db2.gz JAXQIRQWEROBGN-JTQLQIEISA-N 0 3 291.269 2.512 20 10 CFCDHN CCN1CCN(c2ccc(OC3CC=CC3)cc2)CC1 ZINC001234658074 778279617 /nfs/dbraw/zinc/27/96/17/778279617.db2.gz SLGLPJITQXZLHQ-UHFFFAOYSA-N 0 3 272.392 2.926 20 10 CFCDHN [O-]c1cccc(F)c1CN1C[C@H]2c3ccccc3C[NH2+][C@@H]2C1 ZINC001235220829 778420919 /nfs/dbraw/zinc/42/09/19/778420919.db2.gz HZSINEYGHJNMNT-WMLDXEAASA-N 0 3 298.361 2.603 20 10 CFCDHN CCc1cccc(CN2CCc3cccc(O)c3C2)n1 ZINC001235264613 778439053 /nfs/dbraw/zinc/43/90/53/778439053.db2.gz OBHZYMKRGRKOBZ-UHFFFAOYSA-N 0 3 268.360 2.908 20 10 CFCDHN Cc1cc([O-])c(CN(C)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001235347174 778464238 /nfs/dbraw/zinc/46/42/38/778464238.db2.gz NKPXXKVJAXRUEU-GFCCVEGCSA-N 0 3 268.788 2.538 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@@H]1O ZINC001235674633 778532937 /nfs/dbraw/zinc/53/29/37/778532937.db2.gz HIHGLRYBXHJLGP-DOMZBBRYSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@@H]1O ZINC001235674633 778532939 /nfs/dbraw/zinc/53/29/39/778532939.db2.gz HIHGLRYBXHJLGP-DOMZBBRYSA-N 0 3 277.408 2.892 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2CO)c([O-])c1 ZINC001235676967 778534542 /nfs/dbraw/zinc/53/45/42/778534542.db2.gz ZAIZXZPTDDOPEP-CQSZACIVSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H]2CO)c([O-])c1 ZINC001235676967 778534545 /nfs/dbraw/zinc/53/45/45/778534545.db2.gz ZAIZXZPTDDOPEP-CQSZACIVSA-N 0 3 263.381 2.646 20 10 CFCDHN CN(Cc1ccc2ccccc2c1[O-])C[C@@H]1CCC[NH2+]1 ZINC001236120222 778701233 /nfs/dbraw/zinc/70/12/33/778701233.db2.gz PJZIBZOHQTYZTL-HNNXBMFYSA-N 0 3 270.376 2.729 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[NH2+]C[C@H]32)cc1Cl ZINC001236285654 778761378 /nfs/dbraw/zinc/76/13/78/778761378.db2.gz BDMLGWKTHZQWMQ-BXUZGUMPSA-N 0 3 294.826 2.747 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(CO)cc1)c1ccccc1[O-] ZINC000226560286 778840341 /nfs/dbraw/zinc/84/03/41/778840341.db2.gz ZSZJBXYKEJMRNE-GFCCVEGCSA-N 0 3 257.333 2.735 20 10 CFCDHN CCc1ccc(C[N@@H+](CC)C2CCOCC2)c([O-])c1 ZINC001236785782 778935379 /nfs/dbraw/zinc/93/53/79/778935379.db2.gz AAZAKXYOTSGWBV-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@H+](CC)C2CCOCC2)c([O-])c1 ZINC001236785782 778935386 /nfs/dbraw/zinc/93/53/86/778935386.db2.gz AAZAKXYOTSGWBV-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784020 778936010 /nfs/dbraw/zinc/93/60/10/778936010.db2.gz RDHLVZXYIPCKBT-SUMWQHHRSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784020 778936014 /nfs/dbraw/zinc/93/60/14/778936014.db2.gz RDHLVZXYIPCKBT-SUMWQHHRSA-N 0 3 277.408 2.938 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236807235 778946333 /nfs/dbraw/zinc/94/63/33/778946333.db2.gz DZLVGMFIUPLLSZ-DYVFJYSZSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236807235 778946343 /nfs/dbraw/zinc/94/63/43/778946343.db2.gz DZLVGMFIUPLLSZ-DYVFJYSZSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236808148 778948137 /nfs/dbraw/zinc/94/81/37/778948137.db2.gz OHKJNZNGVYFVSU-CXAGYDPISA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001236808148 778948142 /nfs/dbraw/zinc/94/81/42/778948142.db2.gz OHKJNZNGVYFVSU-CXAGYDPISA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)CCc2cccnc2)c([O-])c1 ZINC001236811294 778948163 /nfs/dbraw/zinc/94/81/63/778948163.db2.gz OHBTZZWVIKOAPP-UHFFFAOYSA-N 0 3 286.375 2.779 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)CCc2cccnc2)c([O-])c1 ZINC001236811294 778948166 /nfs/dbraw/zinc/94/81/66/778948166.db2.gz OHBTZZWVIKOAPP-UHFFFAOYSA-N 0 3 286.375 2.779 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC001236821804 778953373 /nfs/dbraw/zinc/95/33/73/778953373.db2.gz UHQHYHAMYDOGSK-KRWDZBQOSA-N 0 3 291.391 2.712 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC001236821804 778953380 /nfs/dbraw/zinc/95/33/80/778953380.db2.gz UHQHYHAMYDOGSK-KRWDZBQOSA-N 0 3 291.391 2.712 20 10 CFCDHN C[C@]1(CO)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826763 778955366 /nfs/dbraw/zinc/95/53/66/778955366.db2.gz MLMRXNRMKTWIRU-KRWDZBQOSA-N 0 3 271.360 2.750 20 10 CFCDHN C[C@]1(CO)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236826763 778955367 /nfs/dbraw/zinc/95/53/67/778955367.db2.gz MLMRXNRMKTWIRU-KRWDZBQOSA-N 0 3 271.360 2.750 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236835089 778959221 /nfs/dbraw/zinc/95/92/21/778959221.db2.gz HWILNECDLSXMRY-SFHVURJKSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@@]1(C)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236835089 778959224 /nfs/dbraw/zinc/95/92/24/778959224.db2.gz HWILNECDLSXMRY-SFHVURJKSA-N 0 3 299.370 2.930 20 10 CFCDHN CN1CC[C@@H]([N@H+](C)Cc2cc3ccccc3cc2[O-])C1 ZINC001236835430 778959266 /nfs/dbraw/zinc/95/92/66/778959266.db2.gz KZWQNUPOMRCOTN-MRXNPFEDSA-N 0 3 270.376 2.681 20 10 CFCDHN CN1CC[C@@H]([N@@H+](C)Cc2cc3ccccc3cc2[O-])C1 ZINC001236835430 778959269 /nfs/dbraw/zinc/95/92/69/778959269.db2.gz KZWQNUPOMRCOTN-MRXNPFEDSA-N 0 3 270.376 2.681 20 10 CFCDHN CN(C)[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841418 778962127 /nfs/dbraw/zinc/96/21/27/778962127.db2.gz ZWMAWAALDPWOOX-INIZCTEOSA-N 0 3 270.376 2.681 20 10 CFCDHN CN(C)[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841418 778962129 /nfs/dbraw/zinc/96/21/29/778962129.db2.gz ZWMAWAALDPWOOX-INIZCTEOSA-N 0 3 270.376 2.681 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC[C@@H]1CO ZINC001236839583 778962297 /nfs/dbraw/zinc/96/22/97/778962297.db2.gz JEGQCBSNASYXTE-MRXNPFEDSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC[C@@H]1CO ZINC001236839583 778962299 /nfs/dbraw/zinc/96/22/99/778962299.db2.gz JEGQCBSNASYXTE-MRXNPFEDSA-N 0 3 271.360 2.892 20 10 CFCDHN COC(=O)CC1CN(Cc2ccc(C(C)C)cc2O)C1 ZINC001237049109 778998154 /nfs/dbraw/zinc/99/81/54/778998154.db2.gz LMGMPTPFAXLAHW-UHFFFAOYSA-N 0 3 277.364 2.511 20 10 CFCDHN OC[C@@H]1CCCCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237137150 779023498 /nfs/dbraw/zinc/02/34/98/779023498.db2.gz MUZGECFKAXALDK-LBPRGKRZSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@H]1CO ZINC001237137150 779023507 /nfs/dbraw/zinc/02/35/07/779023507.db2.gz MUZGECFKAXALDK-LBPRGKRZSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@H]1CO ZINC001237137150 779023515 /nfs/dbraw/zinc/02/35/15/779023515.db2.gz MUZGECFKAXALDK-LBPRGKRZSA-N 0 3 289.297 2.758 20 10 CFCDHN Cc1cccc(O)c1CN1CC[C@](C)(F)[C@H](F)C1 ZINC001237484293 779117620 /nfs/dbraw/zinc/11/76/20/779117620.db2.gz ASDMTCVOIRQRGG-KGLIPLIRSA-N 0 3 255.308 2.973 20 10 CFCDHN Cc1cccc(O)c1CN1CC2(C1)CC(F)(F)C2 ZINC001237481273 779117650 /nfs/dbraw/zinc/11/76/50/779117650.db2.gz FQCPEGJUHUJORT-UHFFFAOYSA-N 0 3 253.292 2.932 20 10 CFCDHN CCOCC1CC[NH+](Cc2c(C)cccc2[O-])CC1 ZINC001237488356 779119076 /nfs/dbraw/zinc/11/90/76/779119076.db2.gz UGMHWEUXILYPFO-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN COC(=O)C1(C)CCN(Cc2cc(F)cc(C)c2O)CC1 ZINC001238060636 779242117 /nfs/dbraw/zinc/24/21/17/779242117.db2.gz CWSNTSFATZSIDP-UHFFFAOYSA-N 0 3 295.354 2.615 20 10 CFCDHN Cc1noc([C@@H]2CC[N@H+](Cc3cc(F)cc(C)c3[O-])C2)n1 ZINC001238070837 779247283 /nfs/dbraw/zinc/24/72/83/779247283.db2.gz PYBZSFVDDDIVEX-LLVKDONJSA-N 0 3 291.326 2.521 20 10 CFCDHN Cc1noc([C@@H]2CC[N@@H+](Cc3cc(F)cc(C)c3[O-])C2)n1 ZINC001238070837 779247288 /nfs/dbraw/zinc/24/72/88/779247288.db2.gz PYBZSFVDDDIVEX-LLVKDONJSA-N 0 3 291.326 2.521 20 10 CFCDHN COc1cncc(C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000699876328 779404754 /nfs/dbraw/zinc/40/47/54/779404754.db2.gz GMUCNONAJOPWKQ-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CN(Cc1cc(Cl)ccc1[O-])[C@]1(C)CCC[NH2+]C1 ZINC001236199150 779496112 /nfs/dbraw/zinc/49/61/12/779496112.db2.gz FMMYWYRKBQEAIP-CQSZACIVSA-N 0 3 268.788 2.620 20 10 CFCDHN CCCN(Cc1cc(Cl)c(OC)cc1[O-])[C@H]1CC[NH2+]C1 ZINC001236322742 779540787 /nfs/dbraw/zinc/54/07/87/779540787.db2.gz ACXDEUQVNUDZSR-LBPRGKRZSA-N 0 3 298.814 2.628 20 10 CFCDHN COc1cc([O-])c(CN2CCC([NH+](C)C)CC2)c(Cl)c1 ZINC001236803604 779641037 /nfs/dbraw/zinc/64/10/37/779641037.db2.gz NDBCYZRCGKBVPY-UHFFFAOYSA-N 0 3 298.814 2.580 20 10 CFCDHN CCOC(=O)C[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC001203550266 780006689 /nfs/dbraw/zinc/00/66/89/780006689.db2.gz OTHIVOJGCQLZCC-ZDUSSCGKSA-N 0 3 277.364 2.557 20 10 CFCDHN CCOC(=O)C[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC001203550266 780006694 /nfs/dbraw/zinc/00/66/94/780006694.db2.gz OTHIVOJGCQLZCC-ZDUSSCGKSA-N 0 3 277.364 2.557 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(c2ncccn2)CC1 ZINC001203556606 780035757 /nfs/dbraw/zinc/03/57/57/780035757.db2.gz VGLSYYDPIAXYSM-UHFFFAOYSA-N 0 3 269.348 2.562 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2CCC(C)(O)CC2)c1[O-] ZINC000703584686 781034788 /nfs/dbraw/zinc/03/47/88/781034788.db2.gz AJHAOLMENPNBKL-UHFFFAOYSA-N 0 3 299.798 2.837 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCOC2(C)C)cc1F ZINC000293748445 282290612 /nfs/dbraw/zinc/29/06/12/282290612.db2.gz OAPNITMYPBPEEF-CQSZACIVSA-N 0 3 266.360 2.549 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)CC(C)(C)O)c1[O-] ZINC000295077227 199333738 /nfs/dbraw/zinc/33/37/38/199333738.db2.gz PWSGGMWQWHYINH-JTQLQIEISA-N 0 3 271.788 2.993 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CC(C)(C)O)c1ccccc1[O-] ZINC000295133707 199364659 /nfs/dbraw/zinc/36/46/59/199364659.db2.gz YMIJSHXCDJPFOA-YPMHNXCESA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC000092073454 347609181 /nfs/dbraw/zinc/60/91/81/347609181.db2.gz ZDXRSCDHXIOTAN-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC000092073454 347609182 /nfs/dbraw/zinc/60/91/82/347609182.db2.gz ZDXRSCDHXIOTAN-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)CC2(O)CCCC2)c1 ZINC000093503215 347677241 /nfs/dbraw/zinc/67/72/41/347677241.db2.gz DEQQHKPVCZSVLL-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)CC2(O)CCCC2)c1 ZINC000093503215 347677242 /nfs/dbraw/zinc/67/72/42/347677242.db2.gz DEQQHKPVCZSVLL-UHFFFAOYSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](OC)[C@H](C)CC)c1[O-] ZINC000294330517 199001346 /nfs/dbraw/zinc/00/13/46/199001346.db2.gz XQNCKLHYUXPXGP-IUODEOHRSA-N 0 3 281.396 2.942 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2ncccc2C)c1[O-] ZINC000294937579 199260558 /nfs/dbraw/zinc/26/05/58/199260558.db2.gz GSNMMZCWWKUVHQ-UHFFFAOYSA-N 0 3 286.375 2.827 20 10 CFCDHN CC(C)(C)C[C@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297532014 200220364 /nfs/dbraw/zinc/22/03/64/200220364.db2.gz DPVVWFVJSBMELU-STQMWFEESA-N 0 3 263.381 2.766 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297553544 200225928 /nfs/dbraw/zinc/22/59/28/200225928.db2.gz FUNXTQFTSOTDAY-DZGCQCFKSA-N 0 3 263.381 2.766 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)CC2 ZINC000297631822 200247342 /nfs/dbraw/zinc/24/73/42/200247342.db2.gz JIQFVWWKOOVWBM-BFHYXJOUSA-N 0 3 261.365 2.520 20 10 CFCDHN CCN(CC)CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000020089754 372228460 /nfs/dbraw/zinc/22/84/60/372228460.db2.gz VFZXNPSDSFKTDA-ZDUSSCGKSA-N 0 3 250.386 2.693 20 10 CFCDHN CC(C)C[C@@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000042879701 372964124 /nfs/dbraw/zinc/96/41/24/372964124.db2.gz DLUMNGUWGFKQKR-SNVBAGLBSA-N 0 3 251.326 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](OC)C2CC2)c1[O-] ZINC000378785001 781965286 /nfs/dbraw/zinc/96/52/86/781965286.db2.gz OYIAEUJZUQHNKP-CYBMUJFWSA-N 0 3 285.771 2.569 20 10 CFCDHN Cc1c(CN[C@H](C)c2ccc(N(C)C)cc2)cnn1C ZINC000090887973 375035172 /nfs/dbraw/zinc/03/51/72/375035172.db2.gz JCNIVVVIAWNVST-GFCCVEGCSA-N 0 3 272.396 2.645 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000092326151 375102383 /nfs/dbraw/zinc/10/23/83/375102383.db2.gz IZYCETLDIOZHQY-SNVBAGLBSA-N 0 3 259.353 2.593 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])CC1=CCCOC1 ZINC000092705041 375140066 /nfs/dbraw/zinc/14/00/66/375140066.db2.gz YWVONMJSOIWUOI-UHFFFAOYSA-N 0 3 261.365 2.951 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])CC1=CCCOC1 ZINC000092705041 375140071 /nfs/dbraw/zinc/14/00/71/375140071.db2.gz YWVONMJSOIWUOI-UHFFFAOYSA-N 0 3 261.365 2.951 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000093610061 375274593 /nfs/dbraw/zinc/27/45/93/375274593.db2.gz DGHXRAJXZAKDFM-IMJJTQAJSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000093610061 375274599 /nfs/dbraw/zinc/27/45/99/375274599.db2.gz DGHXRAJXZAKDFM-IMJJTQAJSA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc(O)c(CN(C)[C@H]2CCCc3c2cnn3C)c1 ZINC000093864252 375322931 /nfs/dbraw/zinc/32/29/31/375322931.db2.gz XADIXCBKVWWWDN-HNNXBMFYSA-N 0 3 285.391 2.944 20 10 CFCDHN CCC[C@@H](C)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658654 375577866 /nfs/dbraw/zinc/57/78/66/375577866.db2.gz YZZPIFDVUZQVDJ-SNVBAGLBSA-N 0 3 251.326 2.741 20 10 CFCDHN CCC[C@@H](C)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658654 375577870 /nfs/dbraw/zinc/57/78/70/375577870.db2.gz YZZPIFDVUZQVDJ-SNVBAGLBSA-N 0 3 251.326 2.741 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@@H+]1CC[C@H](N2CCCC2)C1 ZINC000124582987 377065032 /nfs/dbraw/zinc/06/50/32/377065032.db2.gz BWBOPVZJGZMJHJ-ZDUSSCGKSA-N 0 3 280.799 2.716 20 10 CFCDHN [O-]c1c(Cl)cccc1C[N@H+]1CC[C@H](N2CCCC2)C1 ZINC000124582987 377065038 /nfs/dbraw/zinc/06/50/38/377065038.db2.gz BWBOPVZJGZMJHJ-ZDUSSCGKSA-N 0 3 280.799 2.716 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCn2cccn2)c1 ZINC000126318629 377221260 /nfs/dbraw/zinc/22/12/60/377221260.db2.gz SBCILRQRVZGMCU-CYBMUJFWSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CC[S@](C)=O)c1ccccc1[O-] ZINC000128064597 377315671 /nfs/dbraw/zinc/31/56/71/377315671.db2.gz FPGRDYLIYQVIJY-SUFBMKPHSA-N 0 3 269.410 2.590 20 10 CFCDHN Cc1cc(O)c(CN2CCOC3(CCC3)C2)cc1C ZINC000129850739 377480593 /nfs/dbraw/zinc/48/05/93/377480593.db2.gz YTYFLJBYBKEQBO-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN CCCOc1ccc(C[NH+]2CCC(OC)CC2)c([O-])c1 ZINC000132150741 377808783 /nfs/dbraw/zinc/80/87/83/377808783.db2.gz XMLUQXHTEYMXGK-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN Oc1ccccc1CNCc1cccc2c1OCCCO2 ZINC000134235861 377995434 /nfs/dbraw/zinc/99/54/34/377995434.db2.gz XWTVBTXFPXPKFU-UHFFFAOYSA-N 0 3 285.343 2.843 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2CCSCC2)c1 ZINC000134609316 378036812 /nfs/dbraw/zinc/03/68/12/378036812.db2.gz FFCJKMXSNQHVRW-UHFFFAOYSA-N 0 3 251.395 2.933 20 10 CFCDHN CC[C@@H](N[C@@H]1C=C[C@H](CO)C1)c1ccc(N(C)C)cc1 ZINC000134627263 378040107 /nfs/dbraw/zinc/04/01/07/378040107.db2.gz SYOHWHHIUBXBLW-YSVLISHTSA-N 0 3 274.408 2.730 20 10 CFCDHN CC[C@@H]([NH2+]CCC(=O)N1CCCCC1)c1ccccc1[O-] ZINC000135733449 378160989 /nfs/dbraw/zinc/16/09/89/378160989.db2.gz XZPWCAGMIFYVSI-OAHLLOKOSA-N 0 3 290.407 2.836 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1cccc(F)c1)c1ccccc1[O-] ZINC000154113059 378539405 /nfs/dbraw/zinc/53/94/05/378539405.db2.gz YCSABGWJOJRIMA-ZBEGNZNMSA-N 0 3 275.323 2.916 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@@H](C)N1CCOCC1)c1ccccc1[O-] ZINC000155706134 378630730 /nfs/dbraw/zinc/63/07/30/378630730.db2.gz JHBRJQXTODFPOM-LZWOXQAQSA-N 0 3 292.423 2.542 20 10 CFCDHN C[C@@H](c1cccnc1)N1CCN(Cc2ccccc2O)CC1 ZINC000179575218 380559032 /nfs/dbraw/zinc/55/90/32/380559032.db2.gz JEDKIJGRNKTGIL-HNNXBMFYSA-N 0 3 297.402 2.666 20 10 CFCDHN COCCC[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179876829 380592413 /nfs/dbraw/zinc/59/24/13/380592413.db2.gz SHCVVBPFOAXWAY-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN COCCC[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179876829 380592416 /nfs/dbraw/zinc/59/24/16/380592416.db2.gz SHCVVBPFOAXWAY-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@H](C)C1)c1ccccc1[O-] ZINC000179899989 380593345 /nfs/dbraw/zinc/59/33/45/380593345.db2.gz PNSAAQZBXQWELS-KBPBESRZSA-N 0 3 262.397 2.775 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000180173175 380628722 /nfs/dbraw/zinc/62/87/22/380628722.db2.gz PHBQOTYFAVJCKY-ABAIWWIYSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000180173175 380628729 /nfs/dbraw/zinc/62/87/29/380628729.db2.gz PHBQOTYFAVJCKY-ABAIWWIYSA-N 0 3 265.328 2.532 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000180777054 380697893 /nfs/dbraw/zinc/69/78/93/380697893.db2.gz QPGUUZVXSGWDQN-UHFFFAOYSA-N 0 3 269.360 2.952 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCC[C@@H]1O ZINC000181094649 380738670 /nfs/dbraw/zinc/73/86/70/380738670.db2.gz HFWDAMZKBGJLPG-FZMZJTMJSA-N 0 3 267.344 2.514 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@@H]1CCCC[C@@H]1O ZINC000181094649 380738673 /nfs/dbraw/zinc/73/86/73/380738673.db2.gz HFWDAMZKBGJLPG-FZMZJTMJSA-N 0 3 267.344 2.514 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCOC[C@H]2C)c1 ZINC000287426354 380829661 /nfs/dbraw/zinc/82/96/61/380829661.db2.gz KJYNJJZRGILAFS-AGIUHOORSA-N 0 3 279.380 2.724 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)c1 ZINC000288614725 381017761 /nfs/dbraw/zinc/01/77/61/381017761.db2.gz QXZQIQPGCDRVCQ-CXAGYDPISA-N 0 3 271.360 2.912 20 10 CFCDHN C[N@@H+]1CC[C@@]2(CCN(Cc3cc(Cl)ccc3[O-])C2)C1 ZINC000368318573 380990563 /nfs/dbraw/zinc/99/05/63/380990563.db2.gz SGXNPNMAUIDJPF-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@@]2(CCN(Cc3cc(Cl)ccc3[O-])C2)C1 ZINC000368318573 380990567 /nfs/dbraw/zinc/99/05/67/380990567.db2.gz SGXNPNMAUIDJPF-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN CC[C@@H]([NH2+]CCCCCCO)c1ccccc1[O-] ZINC000183350022 381260891 /nfs/dbraw/zinc/26/08/91/381260891.db2.gz SNWSAGSPVLTKOW-CQSZACIVSA-N 0 3 251.370 2.986 20 10 CFCDHN C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1[O-] ZINC000296040730 381226325 /nfs/dbraw/zinc/22/63/25/381226325.db2.gz UHGJTPYKBZVVBZ-RLAWYHOSSA-N 0 3 260.381 2.668 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183420497 381268982 /nfs/dbraw/zinc/26/89/82/381268982.db2.gz PAPKADAAGQVLSK-ZDUSSCGKSA-N 0 3 278.396 2.691 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1cccnc1)CC2 ZINC000296072451 381243783 /nfs/dbraw/zinc/24/37/83/381243783.db2.gz SEJIIDZPWGLILE-CQSZACIVSA-N 0 3 254.333 2.607 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H](C)c2ccccc2[O-])[nH]n1 ZINC000183621638 381295065 /nfs/dbraw/zinc/29/50/65/381295065.db2.gz ANEPZKSBWRDJBH-CMPLNLGQSA-N 0 3 259.353 2.706 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H](C)c2ccccc2[O-])n[nH]1 ZINC000183621638 381295072 /nfs/dbraw/zinc/29/50/72/381295072.db2.gz ANEPZKSBWRDJBH-CMPLNLGQSA-N 0 3 259.353 2.706 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183628637 381296951 /nfs/dbraw/zinc/29/69/51/381296951.db2.gz IOESOCZALOGZHS-LBPRGKRZSA-N 0 3 251.370 2.842 20 10 CFCDHN COc1cccc(CN(C)[C@H](C)c2ccccn2)c1O ZINC000183679258 381304574 /nfs/dbraw/zinc/30/45/74/381304574.db2.gz UYMZUEHLGOIXCC-GFCCVEGCSA-N 0 3 272.348 2.989 20 10 CFCDHN C[C@@H]([NH2+]C1CCC2(CC1)OCCO2)c1ccccc1[O-] ZINC000183427489 381272383 /nfs/dbraw/zinc/27/23/83/381272383.db2.gz FGWQFIJKAVKCKE-GFCCVEGCSA-N 0 3 277.364 2.729 20 10 CFCDHN CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000183456573 381273317 /nfs/dbraw/zinc/27/33/17/381273317.db2.gz BYYKNGSWBIEESX-ZDUSSCGKSA-N 0 3 298.386 2.993 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183538098 381286075 /nfs/dbraw/zinc/28/60/75/381286075.db2.gz ZJMDPJLTRWQHNI-QWHCGFSZSA-N 0 3 251.370 2.842 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CO)C2)c([O-])c1C ZINC000296293382 381336475 /nfs/dbraw/zinc/33/64/75/381336475.db2.gz FPASRLRIVQZGJN-MCIONIFRSA-N 0 3 263.381 2.821 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@@H](C)c2cccnc2)c1 ZINC000183726353 381310683 /nfs/dbraw/zinc/31/06/83/381310683.db2.gz BGBMAHFMAPQYLK-LBPRGKRZSA-N 0 3 272.348 2.989 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])[C@H](O)C(F)F ZINC000296329421 381349330 /nfs/dbraw/zinc/34/93/30/381349330.db2.gz HEXYBGPQQKPGLR-JWYUURKGSA-N 0 3 277.286 2.587 20 10 CFCDHN C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1cc(F)ccc1[O-] ZINC000296310971 381342955 /nfs/dbraw/zinc/34/29/55/381342955.db2.gz GJXKDIDLDNYWGJ-HLVVYCRESA-N 0 3 278.371 2.807 20 10 CFCDHN COC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184692953 381461689 /nfs/dbraw/zinc/46/16/89/381461689.db2.gz JIFHLZVYZIQNAJ-NSHDSACASA-N 0 3 299.798 2.913 20 10 CFCDHN COC[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184692953 381461697 /nfs/dbraw/zinc/46/16/97/381461697.db2.gz JIFHLZVYZIQNAJ-NSHDSACASA-N 0 3 299.798 2.913 20 10 CFCDHN CNC(=O)c1cccc(CN[C@@H](C)c2cc(C)ccc2O)c1 ZINC000185150198 381546802 /nfs/dbraw/zinc/54/68/02/381546802.db2.gz XGFDHSXAHDXVMH-ZDUSSCGKSA-N 0 3 298.386 2.911 20 10 CFCDHN CN(CC[NH2+][C@@H]1CCc2cccc([O-])c21)C1CCCC1 ZINC000297931313 381575453 /nfs/dbraw/zinc/57/54/53/381575453.db2.gz XQINDJMOQKADKZ-OAHLLOKOSA-N 0 3 274.408 2.844 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](C)c2cn(C)nc2C)c1 ZINC000185349544 381607619 /nfs/dbraw/zinc/60/76/19/381607619.db2.gz SQURAQQAFLNQLX-WDEREUQCSA-N 0 3 289.379 2.855 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)C2CCCCC2)c1 ZINC000185327992 381599164 /nfs/dbraw/zinc/59/91/64/381599164.db2.gz BCYDEWAGAJVANW-SJCJKPOMSA-N 0 3 293.407 2.993 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000371316000 381588176 /nfs/dbraw/zinc/58/81/76/381588176.db2.gz ZADWHHWQINKTJL-KBPBESRZSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000371316000 381588181 /nfs/dbraw/zinc/58/81/81/381588181.db2.gz ZADWHHWQINKTJL-KBPBESRZSA-N 0 3 261.365 2.559 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2ccccc2O)c1 ZINC000185302977 381591459 /nfs/dbraw/zinc/59/14/59/381591459.db2.gz HADRIXPGXVLULA-LBPRGKRZSA-N 0 3 287.359 3.000 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1cc(C)ccc1[O-])C1CC1 ZINC000185307895 381593767 /nfs/dbraw/zinc/59/37/67/381593767.db2.gz WRFSYFDKNDZEOK-CYBMUJFWSA-N 0 3 262.397 2.836 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]Cc2cccc(CO)c2)c1 ZINC000185373090 381614650 /nfs/dbraw/zinc/61/46/50/381614650.db2.gz SPQOSACQJXJCQF-LBPRGKRZSA-N 0 3 287.359 2.744 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](O)Cc2ccccc2)c1 ZINC000185370114 381614694 /nfs/dbraw/zinc/61/46/94/381614694.db2.gz RBRMZEQMOGPYJU-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN COc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000371471782 381635967 /nfs/dbraw/zinc/63/59/67/381635967.db2.gz WVWCVOCPMLDJFO-IMJJTQAJSA-N 0 3 291.391 2.646 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 ZINC000371471782 381635971 /nfs/dbraw/zinc/63/59/71/381635971.db2.gz WVWCVOCPMLDJFO-IMJJTQAJSA-N 0 3 291.391 2.646 20 10 CFCDHN CC[C@@H](C)[C@@H](O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185439541 381632725 /nfs/dbraw/zinc/63/27/25/381632725.db2.gz ODQNKYGDVUFTLX-BFVZDQMLSA-N 0 3 255.333 2.589 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccsc1)c1cc(F)ccc1[O-] ZINC000185513998 381655403 /nfs/dbraw/zinc/65/54/03/381655403.db2.gz XUZLNUDEYYMRRJ-OTYXRUKQSA-N 0 3 281.352 2.977 20 10 CFCDHN CCN(Cc1ccncc1)Cc1cc2c(cc1O)OCO2 ZINC000298613792 381689044 /nfs/dbraw/zinc/68/90/44/381689044.db2.gz SNRKJUSNSDLJLN-UHFFFAOYSA-N 0 3 286.331 2.538 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c([O-])c1 ZINC000185672477 381699574 /nfs/dbraw/zinc/69/95/74/381699574.db2.gz CYJZYHSHYBENRF-MELADBBJSA-N 0 3 274.408 2.976 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CO[C@@H]2CCOC2)c([O-])c1 ZINC000185673781 381701706 /nfs/dbraw/zinc/70/17/06/381701706.db2.gz NGKKNCKVCXHJKE-MGPQQGTHSA-N 0 3 279.380 2.545 20 10 CFCDHN C/C=C/C[C@H](CO)[NH2+]Cc1ccc(OCCC)cc1[O-] ZINC000185814218 381742307 /nfs/dbraw/zinc/74/23/07/381742307.db2.gz IZVFQIORJBWKTO-LYKUJDHUSA-N 0 3 279.380 2.598 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cccc(C(N)=O)c2)c([O-])c1 ZINC000185983735 381795573 /nfs/dbraw/zinc/79/55/73/381795573.db2.gz URCVYDRQPCUWIX-ZDUSSCGKSA-N 0 3 298.386 2.693 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2[O-])C1 ZINC000186444679 381913797 /nfs/dbraw/zinc/91/37/97/381913797.db2.gz LZTNXYFMIBJKJD-QWHCGFSZSA-N 0 3 292.379 2.582 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000186353950 381889621 /nfs/dbraw/zinc/88/96/21/381889621.db2.gz FFZUDAOMQNUWPY-LBPRGKRZSA-N 0 3 278.396 2.514 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c([O-])c1C ZINC000373266199 381964760 /nfs/dbraw/zinc/96/47/60/381964760.db2.gz LXKUVQWZEWCLOO-JSGCOSHPSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1c([C@@H]2CCC[N@@H+]2Cc2ccccc2[O-])cnn1C ZINC000373153563 381937475 /nfs/dbraw/zinc/93/74/75/381937475.db2.gz MKJQJIVALMRUOG-HNNXBMFYSA-N 0 3 271.364 2.771 20 10 CFCDHN Cc1c([C@@H]2CCC[N@H+]2Cc2ccccc2[O-])cnn1C ZINC000373153563 381937478 /nfs/dbraw/zinc/93/74/78/381937478.db2.gz MKJQJIVALMRUOG-HNNXBMFYSA-N 0 3 271.364 2.771 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000375252478 382073132 /nfs/dbraw/zinc/07/31/32/382073132.db2.gz IPMIPJOUEMTUAU-BLLLJJGKSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000375252478 382073134 /nfs/dbraw/zinc/07/31/34/382073134.db2.gz IPMIPJOUEMTUAU-BLLLJJGKSA-N 0 3 277.364 2.574 20 10 CFCDHN COCC1(CC[NH2+]Cc2cccc(C)c2[O-])CCC1 ZINC000293585937 382185723 /nfs/dbraw/zinc/18/57/23/382185723.db2.gz ICTJHPVGUDXADY-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000293693175 382236863 /nfs/dbraw/zinc/23/68/63/382236863.db2.gz LHGNBYRASCWXPY-NWDGAFQWSA-N 0 3 296.386 2.734 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC=C(COC)CC2)c([O-])c1 ZINC000187621488 382228388 /nfs/dbraw/zinc/22/83/88/382228388.db2.gz ANYBHAZQNSRSNH-UHFFFAOYSA-N 0 3 291.391 2.960 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC=C(COC)CC2)c([O-])c1 ZINC000187621488 382228395 /nfs/dbraw/zinc/22/83/95/382228395.db2.gz ANYBHAZQNSRSNH-UHFFFAOYSA-N 0 3 291.391 2.960 20 10 CFCDHN CC1(C)CCC[C@@]1(O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000293589142 382187258 /nfs/dbraw/zinc/18/72/58/382187258.db2.gz IJHNQHCFRSBZAT-OAHLLOKOSA-N 0 3 267.344 2.562 20 10 CFCDHN CC1(C)CCC[C@]1(O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000293589137 382187769 /nfs/dbraw/zinc/18/77/69/382187769.db2.gz IJHNQHCFRSBZAT-HNNXBMFYSA-N 0 3 267.344 2.562 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000293774265 382273790 /nfs/dbraw/zinc/27/37/90/382273790.db2.gz SLKXJVCUQVTDPO-KGLIPLIRSA-N 0 3 292.423 2.904 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cccc(C)c1[O-])C(C)C ZINC000188003640 382320959 /nfs/dbraw/zinc/32/09/59/382320959.db2.gz IKXSPZISRAAZLX-CQSZACIVSA-N 0 3 251.370 2.851 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000188002928 382321620 /nfs/dbraw/zinc/32/16/20/382321620.db2.gz OKRLFRWLWUJPIK-CYBMUJFWSA-N 0 3 255.333 2.682 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@H](O)Cc1ccccc1 ZINC000293820058 382293634 /nfs/dbraw/zinc/29/36/34/382293634.db2.gz FTVCGLGYBJCAMD-MRXNPFEDSA-N 0 3 289.350 2.567 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@H](O)Cc1ccccc1 ZINC000293820058 382293637 /nfs/dbraw/zinc/29/36/37/382293637.db2.gz FTVCGLGYBJCAMD-MRXNPFEDSA-N 0 3 289.350 2.567 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000188276104 382380946 /nfs/dbraw/zinc/38/09/46/382380946.db2.gz WVAPATAQJSWTRL-MRXNPFEDSA-N 0 3 279.355 2.922 20 10 CFCDHN COc1cccc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1[O-] ZINC000188286934 382384175 /nfs/dbraw/zinc/38/41/75/382384175.db2.gz JIUAOLZQSZELLP-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@]2(O)CCC[C@H]2C)c1[O-] ZINC000294149901 382434759 /nfs/dbraw/zinc/43/47/59/382434759.db2.gz VIHBOROLTPSREH-BMIGLBTASA-N 0 3 299.798 2.695 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000378371896 382449746 /nfs/dbraw/zinc/44/97/46/382449746.db2.gz AIBBFVNHBRACCI-NWANDNLSSA-N 0 3 261.365 2.638 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000378371896 382449751 /nfs/dbraw/zinc/44/97/51/382449751.db2.gz AIBBFVNHBRACCI-NWANDNLSSA-N 0 3 261.365 2.638 20 10 CFCDHN CCOC[C@@H]([NH2+]Cc1cccc(OC)c1[O-])C(C)C ZINC000188861037 382494341 /nfs/dbraw/zinc/49/43/41/382494341.db2.gz AMTIOEBVHSCCKT-CYBMUJFWSA-N 0 3 267.369 2.552 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@H]21 ZINC000378538098 382479002 /nfs/dbraw/zinc/47/90/02/382479002.db2.gz ZZKJCYBEOINOKU-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CCN(Cc3cc(Cl)ccc3[O-])C[C@H]21 ZINC000378538098 382479007 /nfs/dbraw/zinc/47/90/07/382479007.db2.gz ZZKJCYBEOINOKU-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C2 ZINC000378617603 382491938 /nfs/dbraw/zinc/49/19/38/382491938.db2.gz BEPUDEKXRZJMGG-STQMWFEESA-N 0 3 271.364 2.563 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2nccnc2C)c([O-])c1 ZINC000294914748 382542760 /nfs/dbraw/zinc/54/27/60/382542760.db2.gz GMDRCCZGMXYNLM-LBPRGKRZSA-N 0 3 271.364 2.692 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCc2scnc2C)c1 ZINC000294915089 382542877 /nfs/dbraw/zinc/54/28/77/382542877.db2.gz FEUAYMQLKDQGNW-UHFFFAOYSA-N 0 3 292.404 2.888 20 10 CFCDHN COc1ccc(C[NH2+]C2CC(c3ccccn3)C2)c([O-])c1 ZINC000367299956 382563904 /nfs/dbraw/zinc/56/39/04/382563904.db2.gz KTWQXWYCEMHVPA-UHFFFAOYSA-N 0 3 284.359 2.832 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1ccccc1[O-])Cc1ccccc1 ZINC000294821325 382531150 /nfs/dbraw/zinc/53/11/50/382531150.db2.gz OWRISQKXZVIRDV-MRXNPFEDSA-N 0 3 271.360 2.740 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCC(C)(C)CO)c([O-])c1 ZINC000294826786 382533046 /nfs/dbraw/zinc/53/30/46/382533046.db2.gz PPHOXKWAZHWHEA-UHFFFAOYSA-N 0 3 281.396 2.679 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H](O)CC(C)(C)C2)cc1F ZINC000295240722 382597117 /nfs/dbraw/zinc/59/71/17/382597117.db2.gz OZVZOMJORAIVDA-CQSZACIVSA-N 0 3 294.414 2.875 20 10 CFCDHN CCOc1cccc(C[N@H+](CC(C)(C)O)C2CC2)c1[O-] ZINC000189943694 382646481 /nfs/dbraw/zinc/64/64/81/382646481.db2.gz HIZDNDPYWXPHNN-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC(C)(C)O)C2CC2)c1[O-] ZINC000189943694 382646482 /nfs/dbraw/zinc/64/64/82/382646482.db2.gz HIZDNDPYWXPHNN-UHFFFAOYSA-N 0 3 279.380 2.526 20 10 CFCDHN C[C@@](O)(CC[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000190276219 382660407 /nfs/dbraw/zinc/66/04/07/382660407.db2.gz INFNFQRNMOQQIK-QGZVFWFLSA-N 0 3 289.350 2.919 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c([O-])c1 ZINC000190347425 382663312 /nfs/dbraw/zinc/66/33/12/382663312.db2.gz GQUDZUUJLLSUFU-INMHGKMJSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000248526214 383253787 /nfs/dbraw/zinc/25/37/87/383253787.db2.gz UWJTVBDWXBNCNB-YZENIEGJSA-N 0 3 279.355 2.995 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1ccccc1[O-] ZINC000248393512 383234104 /nfs/dbraw/zinc/23/41/04/383234104.db2.gz WWIQGAKHDRGSPO-OBCWZRDOSA-N 0 3 261.365 2.856 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)cc1C ZINC000249955340 383368272 /nfs/dbraw/zinc/36/82/72/383368272.db2.gz VRYBMHSKPORFLD-SQWLQELKSA-N 0 3 261.365 2.666 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252667043 383426172 /nfs/dbraw/zinc/42/61/72/383426172.db2.gz FUTNSQFPRSRGDW-KBPBESRZSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252667043 383426174 /nfs/dbraw/zinc/42/61/74/383426174.db2.gz FUTNSQFPRSRGDW-KBPBESRZSA-N 0 3 280.799 2.762 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CCOC2)c([O-])c1 ZINC000266139862 384092392 /nfs/dbraw/zinc/09/23/92/384092392.db2.gz GQSXHMDKHSEYDU-GXTWGEPZSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])c1ccc([S@@](C)=O)cc1 ZINC000268824190 384670716 /nfs/dbraw/zinc/67/07/16/384670716.db2.gz KUEXXWTUFBFREW-FKIZINRSSA-N 0 3 289.400 2.980 20 10 CFCDHN CC[C@H](NC[C@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000268825495 384671259 /nfs/dbraw/zinc/67/12/59/384671259.db2.gz IZUPQKIEDYGREB-STQMWFEESA-N 0 3 290.329 2.717 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1cc(F)ccc1[O-] ZINC000282279416 385268829 /nfs/dbraw/zinc/26/88/29/385268829.db2.gz BBZUIWWJXBJTGH-QMTHXVAHSA-N 0 3 289.354 2.993 20 10 CFCDHN CCCC[N@H+](CCC1OCCO1)Cc1ccccc1[O-] ZINC000282559028 385342238 /nfs/dbraw/zinc/34/22/38/385342238.db2.gz YCIWGQXXWSQNIW-UHFFFAOYSA-N 0 3 279.380 2.757 20 10 CFCDHN CCCC[N@@H+](CCC1OCCO1)Cc1ccccc1[O-] ZINC000282559028 385342244 /nfs/dbraw/zinc/34/22/44/385342244.db2.gz YCIWGQXXWSQNIW-UHFFFAOYSA-N 0 3 279.380 2.757 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2cccc(C)c2[O-])CC1 ZINC000271713182 385389369 /nfs/dbraw/zinc/38/93/69/385389369.db2.gz HJNOKMJDUQSFJM-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCOC2)c1[O-] ZINC000271764823 385390715 /nfs/dbraw/zinc/39/07/15/385390715.db2.gz ZYXPVEXBCYAZJX-GFCCVEGCSA-N 0 3 255.745 2.575 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCOC2)c1[O-] ZINC000271764823 385390717 /nfs/dbraw/zinc/39/07/17/385390717.db2.gz ZYXPVEXBCYAZJX-GFCCVEGCSA-N 0 3 255.745 2.575 20 10 CFCDHN Cc1cccc(CN[C@H](CO)c2ccc(F)cc2)c1O ZINC000271775295 385390859 /nfs/dbraw/zinc/39/08/59/385390859.db2.gz CLTFRCVMKQZOHN-OAHLLOKOSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@H]2CCOC2)c1[O-] ZINC000271766331 385390970 /nfs/dbraw/zinc/39/09/70/385390970.db2.gz AIISFYMJLBDMAT-MNOVXSKESA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CCOC2)c1[O-] ZINC000271766338 385391543 /nfs/dbraw/zinc/39/15/43/385391543.db2.gz AIISFYMJLBDMAT-WDEREUQCSA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CC[C@@H](C)O)c1[O-] ZINC000271780213 385392156 /nfs/dbraw/zinc/39/21/56/385392156.db2.gz HNOPOMOWZOLUTB-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CC[C@@H](C)O)c1[O-] ZINC000271780213 385392159 /nfs/dbraw/zinc/39/21/59/385392159.db2.gz HNOPOMOWZOLUTB-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2CCCSC2)c1 ZINC000271869534 385394854 /nfs/dbraw/zinc/39/48/54/385394854.db2.gz XIYKEJMQJXKPLQ-LBPRGKRZSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1cc(Cl)cc(CN2C[C@@H]3CCC[NH2+][C@@H]3C2)c1[O-] ZINC000271881444 385394916 /nfs/dbraw/zinc/39/49/16/385394916.db2.gz VHELVYCRDJLYTD-SMDDNHRTSA-N 0 3 280.799 2.538 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@]1(C)[NH2+]Cc1cccc(C)c1[O-] ZINC000272415182 385531742 /nfs/dbraw/zinc/53/17/42/385531742.db2.gz MFKPNZHLZSROPF-YOEHRIQHSA-N 0 3 291.391 2.912 20 10 CFCDHN CCCOc1ccc(C[NH2+]C2(COC)CCC2)c([O-])c1 ZINC000284191190 385546379 /nfs/dbraw/zinc/54/63/79/385546379.db2.gz YFYBGQXANJDNRY-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)CN2CCCC2=O)c([O-])c1 ZINC000284275193 385547183 /nfs/dbraw/zinc/54/71/83/385547183.db2.gz XBSNJHLSJZNNCW-ZIAGYGMSSA-N 0 3 290.407 2.671 20 10 CFCDHN c1cncc([C@H]2OCC[C@@H]2NCc2ccc3c(c2)CCO3)c1 ZINC000285068194 385550997 /nfs/dbraw/zinc/55/09/97/385550997.db2.gz PBGRZMCJSZIHSK-FUHWJXTLSA-N 0 3 296.370 2.636 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H]2CCOC[C@H]2C)c1 ZINC000285413078 385555541 /nfs/dbraw/zinc/55/55/41/385555541.db2.gz GCJNWDMIVTVYDK-CHWSQXEVSA-N 0 3 279.380 2.553 20 10 CFCDHN CN(C)c1ccc(CN2CC=C(c3ccnn3C)CC2)cc1 ZINC000285752494 385557271 /nfs/dbraw/zinc/55/72/71/385557271.db2.gz WRSNJDNQDWDSFZ-UHFFFAOYSA-N 0 3 296.418 2.775 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000272813203 385623178 /nfs/dbraw/zinc/62/31/78/385623178.db2.gz DKOWJWSVVIRFLP-XHDPSFHLSA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000273364749 385679341 /nfs/dbraw/zinc/67/93/41/385679341.db2.gz DTOLDSOFJKKANM-ZDUSSCGKSA-N 0 3 273.380 2.946 20 10 CFCDHN COC[C@H](C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2)OC ZINC000273381572 385681048 /nfs/dbraw/zinc/68/10/48/385681048.db2.gz CEFHRTGHWADCRG-WFASDCNBSA-N 0 3 293.407 2.583 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cc(F)ccc1[O-] ZINC000273516883 385685581 /nfs/dbraw/zinc/68/55/81/385685581.db2.gz SSPRPEOJOUEVKK-YPMHNXCESA-N 0 3 295.354 2.868 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2([C@H](O)C(C)C)CC2)c1 ZINC000273510284 385686233 /nfs/dbraw/zinc/68/62/33/385686233.db2.gz ROJAZSDBADFFPM-BLLLJJGKSA-N 0 3 293.407 2.849 20 10 CFCDHN CS[C@H](CO)[C@@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273554507 385687388 /nfs/dbraw/zinc/68/73/88/385687388.db2.gz GQKBVYUUSKPIPM-YRGRVCCFSA-N 0 3 283.437 2.772 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273563055 385687877 /nfs/dbraw/zinc/68/78/77/385687877.db2.gz ISKCXXMIQRXANK-ZDUSSCGKSA-N 0 3 273.380 2.865 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)cc2[O-])o1 ZINC000273589313 385689032 /nfs/dbraw/zinc/68/90/32/385689032.db2.gz OSBDRTPIGQZTTG-WFASDCNBSA-N 0 3 275.348 2.986 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCN2CCOC2=O)c([O-])c1C ZINC000273574628 385689374 /nfs/dbraw/zinc/68/93/74/385689374.db2.gz LLJBTXCFNCJIPL-ZDUSSCGKSA-N 0 3 292.379 2.502 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CCO)c([O-])c1C ZINC000273588488 385690158 /nfs/dbraw/zinc/69/01/58/385690158.db2.gz ONVWQFXOLNRVAJ-ZWNOBZJWSA-N 0 3 251.370 2.678 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000273618331 385692712 /nfs/dbraw/zinc/69/27/12/385692712.db2.gz YFCBHVLEDNSPHX-KBPBESRZSA-N 0 3 290.407 2.671 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000273618333 385692751 /nfs/dbraw/zinc/69/27/51/385692751.db2.gz YFCBHVLEDNSPHX-UONOGXRCSA-N 0 3 290.407 2.671 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(C)c2[O-])[C@]12CCCO2 ZINC000273712765 385694195 /nfs/dbraw/zinc/69/41/95/385694195.db2.gz GNHIVTWOQCVJOA-BFYDXBDKSA-N 0 3 291.391 2.517 20 10 CFCDHN CCSCCNCc1ccc(N2CCOCC2)c(F)c1 ZINC000273716870 385694705 /nfs/dbraw/zinc/69/47/05/385694705.db2.gz LFKCCBJIPFFXSK-UHFFFAOYSA-N 0 3 298.427 2.505 20 10 CFCDHN C[C@H]([NH2+]CC1=CCCOC1)c1cc(F)ccc1[O-] ZINC000287210024 385804802 /nfs/dbraw/zinc/80/48/02/385804802.db2.gz WWODEAJAINBEHM-JTQLQIEISA-N 0 3 251.301 2.529 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccccn2)c1 ZINC000035628621 260030849 /nfs/dbraw/zinc/03/08/49/260030849.db2.gz WVUCUBIEXBOGIX-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC1(O)CCCCCC1 ZINC000180772856 285384755 /nfs/dbraw/zinc/38/47/55/285384755.db2.gz ULSVJLRDDVHJNT-UHFFFAOYSA-N 0 3 267.344 2.706 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCC3(CC1)OCCO3)CC2 ZINC000295957464 285396776 /nfs/dbraw/zinc/39/67/76/285396776.db2.gz LXISNRIRZIQJDK-AWEZNQCLSA-N 0 3 289.375 2.655 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CSCCS1)CC2 ZINC000297151006 285396856 /nfs/dbraw/zinc/39/68/56/285396856.db2.gz AVLCQZCKUWZGBY-NEPJUHHUSA-N 0 3 281.446 2.818 20 10 CFCDHN CC(C)C[C@@H](CN(C)C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297634828 393446194 /nfs/dbraw/zinc/44/61/94/393446194.db2.gz JNADMNMUNCYYAK-GJZGRUSLSA-N 0 3 276.424 2.945 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374092356 393482947 /nfs/dbraw/zinc/48/29/47/393482947.db2.gz DBYNJKNGERBFJF-HUUCEWRRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000374092356 393482955 /nfs/dbraw/zinc/48/29/55/393482955.db2.gz DBYNJKNGERBFJF-HUUCEWRRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374119630 393483937 /nfs/dbraw/zinc/48/39/37/393483937.db2.gz KKRVVMKWOGHIQM-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c1 ZINC000374119630 393483941 /nfs/dbraw/zinc/48/39/41/393483941.db2.gz KKRVVMKWOGHIQM-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@]2(O)CCc3ccccc32)cc1C ZINC000305232956 393500229 /nfs/dbraw/zinc/50/02/29/393500229.db2.gz UDNLODNVZPIOOQ-IBGZPJMESA-N 0 3 297.398 2.933 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CCC[C@@H](N2CCCCC2)C1 ZINC000374900013 393503069 /nfs/dbraw/zinc/50/30/69/393503069.db2.gz UAEQNGNUOQNXRZ-OAHLLOKOSA-N 0 3 292.398 2.982 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CCC[C@@H](N2CCCCC2)C1 ZINC000374900013 393503075 /nfs/dbraw/zinc/50/30/75/393503075.db2.gz UAEQNGNUOQNXRZ-OAHLLOKOSA-N 0 3 292.398 2.982 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@]2(CCN(C)C2)C1 ZINC000312704258 393522117 /nfs/dbraw/zinc/52/21/17/393522117.db2.gz OIFPIWUPZYYZIK-RDJZCZTQSA-N 0 3 274.408 2.871 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@]2(CCN(C)C2)C1 ZINC000312704258 393522122 /nfs/dbraw/zinc/52/21/22/393522122.db2.gz OIFPIWUPZYYZIK-RDJZCZTQSA-N 0 3 274.408 2.871 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@H]1n1ccnc1 ZINC000245918302 413070433 /nfs/dbraw/zinc/07/04/33/413070433.db2.gz GRBNEPKIYCUAFB-IUODEOHRSA-N 0 3 289.354 2.811 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@H]1n1ccnc1 ZINC000245918302 413070443 /nfs/dbraw/zinc/07/04/43/413070443.db2.gz GRBNEPKIYCUAFB-IUODEOHRSA-N 0 3 289.354 2.811 20 10 CFCDHN CC(C)CCOCC[N@H+](C)Cc1ccccc1[O-] ZINC000120766278 393940889 /nfs/dbraw/zinc/94/08/89/393940889.db2.gz MZQMMBDWUBDJJG-UHFFFAOYSA-N 0 3 251.370 2.887 20 10 CFCDHN CC(C)CCOCC[N@@H+](C)Cc1ccccc1[O-] ZINC000120766278 393940892 /nfs/dbraw/zinc/94/08/92/393940892.db2.gz MZQMMBDWUBDJJG-UHFFFAOYSA-N 0 3 251.370 2.887 20 10 CFCDHN COc1cc(O)c(CN2CC=C(C)CC2)cc1OC ZINC000271098627 394016524 /nfs/dbraw/zinc/01/65/24/394016524.db2.gz OBPSYTUUIOZZTA-UHFFFAOYSA-N 0 3 263.337 2.561 20 10 CFCDHN CC[C@@H](CO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263643206 393964197 /nfs/dbraw/zinc/96/41/97/393964197.db2.gz ANJFIOGIWUFFAU-INIZCTEOSA-N 0 3 271.360 2.920 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@]2(O)CCc3ccccc32)c1 ZINC000269809772 394007091 /nfs/dbraw/zinc/00/70/91/394007091.db2.gz LTZCSNUGRHVPTP-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H](O)[C@H]2CCCO2)c1[O-] ZINC000527954375 394431560 /nfs/dbraw/zinc/43/15/60/394431560.db2.gz JMNPRYAKOPVJQG-ZLKJLUDKSA-N 0 3 299.798 2.545 20 10 CFCDHN C[C@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccccc1[O-] ZINC000020146667 171033223 /nfs/dbraw/zinc/03/32/23/171033223.db2.gz IYPIURACBXOYPA-KBPBESRZSA-N 0 3 279.380 2.629 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H](C(C)C)N2CCCC2)c1 ZINC000020201028 171064594 /nfs/dbraw/zinc/06/45/94/171064594.db2.gz WTNNRKGAUAZHFO-MRXNPFEDSA-N 0 3 292.423 2.611 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCO2)c1cccnc1 ZINC000037362801 173151399 /nfs/dbraw/zinc/15/13/99/173151399.db2.gz VEEKAXLWYLBHPN-GFCCVEGCSA-N 0 3 254.333 2.867 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCOc2ccccc2)c1 ZINC000071408563 176156722 /nfs/dbraw/zinc/15/67/22/176156722.db2.gz FXKBMWDGNJKGKZ-UHFFFAOYSA-N 0 3 257.333 2.869 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCn2ccnc2)c1 ZINC000035629006 260030885 /nfs/dbraw/zinc/03/08/85/260030885.db2.gz DDRSZXLQBAIQSQ-ZDUSSCGKSA-N 0 3 259.353 2.638 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCO[C@H]2CCC[C@@H]21 ZINC000371527824 261295118 /nfs/dbraw/zinc/29/51/18/261295118.db2.gz JDBIWHSUVXRTCF-ZFWWWQNUSA-N 0 3 265.328 2.675 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCO[C@H]2CCC[C@@H]21 ZINC000371527824 261295119 /nfs/dbraw/zinc/29/51/19/261295119.db2.gz JDBIWHSUVXRTCF-ZFWWWQNUSA-N 0 3 265.328 2.675 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCN(c2ccncn2)C1)c1ccccc1[O-] ZINC000367829697 267120593 /nfs/dbraw/zinc/12/05/93/267120593.db2.gz BWUZADREADQHBA-ZIAGYGMSSA-N 0 3 298.390 2.502 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]1C(=O)NC1CC1 ZINC000368021585 267135942 /nfs/dbraw/zinc/13/59/42/267135942.db2.gz ZFAXRJIBHNAAJN-LSDHHAIUSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]1C(=O)NC1CC1 ZINC000368021585 267135946 /nfs/dbraw/zinc/13/59/46/267135946.db2.gz ZFAXRJIBHNAAJN-LSDHHAIUSA-N 0 3 288.391 2.586 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000368229521 267153725 /nfs/dbraw/zinc/15/37/25/267153725.db2.gz SZBTWRAKLYLKAT-CYBMUJFWSA-N 0 3 293.370 2.916 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000368229521 267153727 /nfs/dbraw/zinc/15/37/27/267153727.db2.gz SZBTWRAKLYLKAT-CYBMUJFWSA-N 0 3 293.370 2.916 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOC[C@@H]1CCOC ZINC000368270294 267158196 /nfs/dbraw/zinc/15/81/96/267158196.db2.gz VESOARYNCMRQRW-DZGCQCFKSA-N 0 3 279.380 2.581 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOC[C@@H]1CCOC ZINC000368270294 267158200 /nfs/dbraw/zinc/15/82/00/267158200.db2.gz VESOARYNCMRQRW-DZGCQCFKSA-N 0 3 279.380 2.581 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])C2 ZINC000368315600 267161445 /nfs/dbraw/zinc/16/14/45/267161445.db2.gz LAHQRJZXUXKYND-KGLIPLIRSA-N 0 3 285.391 2.871 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2cc(OC)ccc2[O-])C1 ZINC000368666400 267196598 /nfs/dbraw/zinc/19/65/98/267196598.db2.gz LOZLFKBQMGXCFB-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2cc(OC)ccc2[O-])C1 ZINC000368666400 267196600 /nfs/dbraw/zinc/19/66/00/267196600.db2.gz LOZLFKBQMGXCFB-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000368763031 267203241 /nfs/dbraw/zinc/20/32/41/267203241.db2.gz BGGQRHJEJNBTHF-IRXDYDNUSA-N 0 3 291.391 2.696 20 10 CFCDHN C[C@H]([NH2+]CC1(O)Cc2ccccc2C1)c1ccccc1[O-] ZINC000374713560 267808415 /nfs/dbraw/zinc/80/84/15/267808415.db2.gz WDJVRFMYTPDEKK-ZDUSSCGKSA-N 0 3 283.371 2.573 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](C)CSC)c1[O-] ZINC000076769390 276380505 /nfs/dbraw/zinc/38/05/05/276380505.db2.gz ILIGKMKZELSBOW-JTQLQIEISA-N 0 3 255.383 2.632 20 10 CFCDHN CC[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)N1CCCC1 ZINC000296214838 276569193 /nfs/dbraw/zinc/56/91/93/276569193.db2.gz ZPMAVSQTYYBDDQ-HUUCEWRRSA-N 0 3 274.408 2.844 20 10 CFCDHN CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000297836856 276834426 /nfs/dbraw/zinc/83/44/26/276834426.db2.gz SEJDHMXNPZNZOA-ZNMIVQPWSA-N 0 3 274.408 2.842 20 10 CFCDHN CO[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296394085 277284963 /nfs/dbraw/zinc/28/49/63/277284963.db2.gz KBEHGIWUDKXZTF-VNHYZAJKSA-N 0 3 261.365 2.927 20 10 CFCDHN COCCC1(C[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000295811291 277489394 /nfs/dbraw/zinc/48/93/94/277489394.db2.gz AATGIDRQABRMCR-ZDUSSCGKSA-N 0 3 261.365 2.786 20 10 CFCDHN C[C@@H](O)CC(C)(C)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296818499 278390974 /nfs/dbraw/zinc/39/09/74/278390974.db2.gz MAAXENINJISPJZ-YPMHNXCESA-N 0 3 263.381 2.766 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)CC)c1ccc(C)cc1[O-] ZINC000280263905 288041023 /nfs/dbraw/zinc/04/10/23/288041023.db2.gz XJTJCVUMBGMALI-AWEZNQCLSA-N 0 3 250.386 2.693 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CCN(C)C)c1ccc(F)cc1[O-] ZINC000286001700 288076823 /nfs/dbraw/zinc/07/68/23/288076823.db2.gz IRMOWPVCGFVAAT-RISCZKNCSA-N 0 3 268.376 2.912 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c([O-])c1 ZINC000249577692 280980338 /nfs/dbraw/zinc/98/03/38/280980338.db2.gz AKWQWURUGGNZMA-YYWXWVFPSA-N 0 3 261.365 2.919 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2([S@](C)=O)CCC2)c1 ZINC000281067632 301654195 /nfs/dbraw/zinc/65/41/95/301654195.db2.gz NWHPFXFGRXRAQK-BLVKFPJESA-N 0 3 281.421 2.652 20 10 CFCDHN C/C=C/C[C@@H](CO)[NH2+]Cc1ccc(OCCC)cc1[O-] ZINC000185814201 327846142 /nfs/dbraw/zinc/84/61/42/327846142.db2.gz IZVFQIORJBWKTO-KQIUPUNMSA-N 0 3 279.380 2.598 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC23CC(C2)CO3)c2c1c(F)ccc2[O-] ZINC000527983003 330298440 /nfs/dbraw/zinc/29/84/40/330298440.db2.gz RVKGYTDZGXSYQP-DHYSWEFNSA-N 0 3 277.339 2.848 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1 ZINC000527999164 330299731 /nfs/dbraw/zinc/29/97/31/330299731.db2.gz CODZEDMNLXMIOD-XMQPUEPBSA-N 0 3 279.380 2.863 20 10 CFCDHN CC(C)O[C@@]1(C)C[C@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000528004285 330300278 /nfs/dbraw/zinc/30/02/78/330300278.db2.gz DREIDUYDOHAJOW-BJJXKVORSA-N 0 3 261.365 2.925 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCCCCCO)c1[O-] ZINC000230935490 522539344 /nfs/dbraw/zinc/53/93/44/522539344.db2.gz OMAASJJVYNGHRO-UHFFFAOYSA-N 0 3 287.787 2.697 20 10 CFCDHN C/C=C/C[C@@H](CO)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000186505180 518530085 /nfs/dbraw/zinc/53/00/85/518530085.db2.gz MTMJQGBVHGZHMQ-YGEYTSGZSA-N 0 3 253.317 2.509 20 10 CFCDHN CC(C)(C)C[C@H](O)CNCc1ccc2c(c1)CCO2 ZINC000227372766 518694787 /nfs/dbraw/zinc/69/47/87/518694787.db2.gz NDPFNMRRPOPZLJ-AWEZNQCLSA-N 0 3 263.381 2.508 20 10 CFCDHN CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(C)(C)O ZINC000276753590 519821377 /nfs/dbraw/zinc/82/13/77/519821377.db2.gz IAHGHVUUINTCFD-FZMZJTMJSA-N 0 3 251.370 2.838 20 10 CFCDHN CCN(C)C(=O)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000274803264 520172814 /nfs/dbraw/zinc/17/28/14/520172814.db2.gz OYKWNEKSVFTMQW-UHFFFAOYSA-N 0 3 298.386 2.627 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC2(N(C)C)CCC2)c([O-])c1 ZINC000275422517 520366019 /nfs/dbraw/zinc/36/60/19/520366019.db2.gz AHDQYUVLHIYNLH-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCN2CC=CCC2)c([O-])c1 ZINC000279871664 520366658 /nfs/dbraw/zinc/36/66/58/520366658.db2.gz UAZPVOVAUBYCLD-UHFFFAOYSA-N 0 3 290.407 2.533 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1cc(OCC)ccc1[O-] ZINC000289434878 520504907 /nfs/dbraw/zinc/50/49/07/520504907.db2.gz LFEKGKVTQCMNKD-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1cc(OCC)ccc1[O-] ZINC000289434878 520504912 /nfs/dbraw/zinc/50/49/12/520504912.db2.gz LFEKGKVTQCMNKD-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000279725891 520860252 /nfs/dbraw/zinc/86/02/52/520860252.db2.gz VFGFDHBSFMWMIL-CQSZACIVSA-N 0 3 264.413 2.829 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@@H](CO)CC(C)C)c1 ZINC000290661670 521142280 /nfs/dbraw/zinc/14/22/80/521142280.db2.gz ZTNBEFZPMXUPJV-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@@H](CO)CC(C)C)c1 ZINC000290661670 521142286 /nfs/dbraw/zinc/14/22/86/521142286.db2.gz ZTNBEFZPMXUPJV-CQSZACIVSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H](CO)CC(C)C)c1 ZINC000290661669 521142550 /nfs/dbraw/zinc/14/25/50/521142550.db2.gz ZTNBEFZPMXUPJV-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H](CO)CC(C)C)c1 ZINC000290661669 521142554 /nfs/dbraw/zinc/14/25/54/521142554.db2.gz ZTNBEFZPMXUPJV-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CCCc2nccs2)c1 ZINC000265632951 521150277 /nfs/dbraw/zinc/15/02/77/521150277.db2.gz SIKNWKZPULNCDA-UHFFFAOYSA-N 0 3 292.404 2.970 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(O)CCCCC2)c1 ZINC000237035165 521150914 /nfs/dbraw/zinc/15/09/14/521150914.db2.gz BVMNPLGFEJNUPC-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN CCOc1ccc(O)c(CNCc2c(C)onc2CC)c1 ZINC000293038626 521152737 /nfs/dbraw/zinc/15/27/37/521152737.db2.gz SDRZPTKUDOGLKS-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273619989 521191882 /nfs/dbraw/zinc/19/18/82/521191882.db2.gz YSYUZZAPGNKUFQ-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN CCN(Cc1c[nH]nc1C)Cc1ccc(N(C)C)cc1 ZINC000156851171 521282993 /nfs/dbraw/zinc/28/29/93/521282993.db2.gz MRDYLOFAHFYDGR-UHFFFAOYSA-N 0 3 272.396 2.806 20 10 CFCDHN CCOc1cccc(C[NH2+]CCN(C)[C@@H](C)CC)c1[O-] ZINC000217390826 521362553 /nfs/dbraw/zinc/36/25/53/521362553.db2.gz ISBCBRFJYVXJLB-ZDUSSCGKSA-N 0 3 280.412 2.611 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@](C)(OC)C2CC2)c1[O-] ZINC000291006881 521364542 /nfs/dbraw/zinc/36/45/42/521364542.db2.gz DHAMIRPIMHWCNY-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(CNCc2ncccc2C)c1O ZINC000071339372 521368867 /nfs/dbraw/zinc/36/88/67/521368867.db2.gz ZWJBXUOFRISMGC-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN CCOC1(C[NH2+]Cc2cc(OC)ccc2[O-])CCCC1 ZINC000293700502 521637332 /nfs/dbraw/zinc/63/73/32/521637332.db2.gz RMWXRODJFDSKHY-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1cccc(OCC)c1[O-] ZINC000290477490 521653352 /nfs/dbraw/zinc/65/33/52/521653352.db2.gz NVTYYMUHVBPADB-UHFFFAOYSA-N 0 3 294.439 2.955 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1cccc(OCC)c1[O-] ZINC000290477490 521653356 /nfs/dbraw/zinc/65/33/56/521653356.db2.gz NVTYYMUHVBPADB-UHFFFAOYSA-N 0 3 294.439 2.955 20 10 CFCDHN CCc1ccccc1C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000084200277 521838479 /nfs/dbraw/zinc/83/84/79/521838479.db2.gz RHYNRGXKQVMNIV-UHFFFAOYSA-N 0 3 285.343 2.973 20 10 CFCDHN CN(C)c1ccc(CN(CCn2cccn2)C2CC2)cc1 ZINC000299436525 522174395 /nfs/dbraw/zinc/17/43/95/522174395.db2.gz RQLMZFGVFIXNJT-UHFFFAOYSA-N 0 3 284.407 2.614 20 10 CFCDHN CC[C@@H](C)[C@H](O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000155807555 522396614 /nfs/dbraw/zinc/39/66/14/522396614.db2.gz UEYUQJAPAOWACI-OSAQELSMSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1cc(Cl)cc(CN[C@@H](C)c2cn[nH]c2)c1O ZINC000230935434 522540638 /nfs/dbraw/zinc/54/06/38/522540638.db2.gz UDMSTFSOZQBHRN-QMMMGPOBSA-N 0 3 281.743 2.628 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC[C@@H](C)CO)c1[O-] ZINC000230935453 522542056 /nfs/dbraw/zinc/54/20/56/522542056.db2.gz KJVIPBZEVNHYEA-SNVBAGLBSA-N 0 3 287.787 2.552 20 10 CFCDHN CC[C@H]([NH2+]Cc1cnn(C)c1)c1ccc(C)cc1[O-] ZINC000279988729 522666070 /nfs/dbraw/zinc/66/60/70/522666070.db2.gz FEJOBGFQEXIARB-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN(C(C)C)C1=O)c1ccc(C)cc1[O-] ZINC000279942923 522753674 /nfs/dbraw/zinc/75/36/74/522753674.db2.gz BHYSFHJDTOLABD-GJZGRUSLSA-N 0 3 290.407 2.751 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC(=O)N(C(C)C)C1)c1ccc(C)cc1[O-] ZINC000280038480 522945548 /nfs/dbraw/zinc/94/55/48/522945548.db2.gz IRIOTJCIACMDFP-DZGCQCFKSA-N 0 3 290.407 2.751 20 10 CFCDHN CN1CCCc2cc(CNCc3cccnc3)ccc21 ZINC000050266790 523863684 /nfs/dbraw/zinc/86/36/84/523863684.db2.gz DJPWQCUSWHFHRK-UHFFFAOYSA-N 0 3 267.376 2.754 20 10 CFCDHN CO[C@](C)(C[NH2+]Cc1cc(C)c(C)cc1[O-])C1CC1 ZINC000291038614 524027512 /nfs/dbraw/zinc/02/75/12/524027512.db2.gz KINGJAKHJPEQRM-MRXNPFEDSA-N 0 3 263.381 2.914 20 10 CFCDHN CNC(=O)CCC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263695520 524064971 /nfs/dbraw/zinc/06/49/71/524064971.db2.gz QANMTZMRUMILQT-UHFFFAOYSA-N 0 3 298.386 2.675 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)ccc2[O-])c(OC)c1 ZINC000226585428 524072718 /nfs/dbraw/zinc/07/27/18/524072718.db2.gz XSTMGBUSVHOGJD-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1ccc(CN[C@H](C)c2cnn(C)c2C)cc1C ZINC000035274593 524090289 /nfs/dbraw/zinc/09/02/89/524090289.db2.gz XNMHZUAYUGYGBG-GFCCVEGCSA-N 0 3 273.380 2.896 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC000271881459 524389343 /nfs/dbraw/zinc/38/93/43/524389343.db2.gz VHSYQSJSXGJPJZ-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC3(C2)CCOCC3)c1[O-] ZINC000271881459 524389349 /nfs/dbraw/zinc/38/93/49/524389349.db2.gz VHSYQSJSXGJPJZ-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN COc1ccccc1CC[NH2+]Cc1cccc(OC)c1[O-] ZINC000227434450 524422726 /nfs/dbraw/zinc/42/27/26/524422726.db2.gz DMWQNVSQOSLRDN-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN Cc1cccc(C[NH2+]CC(C)(C)CCCO)c1[O-] ZINC000224941698 524429883 /nfs/dbraw/zinc/42/98/83/524429883.db2.gz FLDHZCJKVONMAW-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN COc1ccc(O)c(CN2CCC(F)(F)[C@H](C)C2)c1 ZINC000291688044 524736198 /nfs/dbraw/zinc/73/61/98/524736198.db2.gz XWVAPXVEEOBBKL-SNVBAGLBSA-N 0 3 271.307 2.878 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)[C@@H]2[C@H]2CCCO2)c1 ZINC000291635047 524739099 /nfs/dbraw/zinc/73/90/99/524739099.db2.gz SQRCEOJOFCUALK-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ccc(C)nc2)c1 ZINC000062051031 524764732 /nfs/dbraw/zinc/76/47/32/524764732.db2.gz GKUSATSHNUHVBX-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2ncccc2C)c1 ZINC000071339347 524766176 /nfs/dbraw/zinc/76/61/76/524766176.db2.gz BPTLIBNJFPUCIU-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCCOC(C)(C)C2)c1 ZINC000364988321 524770467 /nfs/dbraw/zinc/77/04/67/524770467.db2.gz XLHPNJUXTXBFOJ-LBPRGKRZSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCCOC(C)(C)C2)c1 ZINC000364988321 524770476 /nfs/dbraw/zinc/77/04/76/524770476.db2.gz XLHPNJUXTXBFOJ-LBPRGKRZSA-N 0 3 279.380 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCOC2(C)C)c1 ZINC000294709394 524773814 /nfs/dbraw/zinc/77/38/14/524773814.db2.gz DQDMVFDIXWRMDF-HZMBPMFUSA-N 0 3 265.353 2.619 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c1 ZINC000300419268 524774058 /nfs/dbraw/zinc/77/40/58/524774058.db2.gz UVYZMPABNHVEHJ-JJMVLAAESA-N 0 3 277.364 2.619 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC(C)(C)O)c1[O-] ZINC000274944670 524868538 /nfs/dbraw/zinc/86/85/38/524868538.db2.gz RCKXCIDJDXSJAX-UHFFFAOYSA-N 0 3 257.761 2.605 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCSC2)c1[O-] ZINC000271866015 524870567 /nfs/dbraw/zinc/87/05/67/524870567.db2.gz WBEHCFHWLYGZSG-LLVKDONJSA-N 0 3 257.786 2.949 20 10 CFCDHN COc1ncccc1CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000289595328 525044522 /nfs/dbraw/zinc/04/45/22/525044522.db2.gz BFKGBYIUDVVYSA-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@@](C)(O)CC2)cc1C ZINC000279736083 525316008 /nfs/dbraw/zinc/31/60/08/525316008.db2.gz WOVSKKITQNWUOH-MRXNPFEDSA-N 0 3 263.381 2.746 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@@](C)(O)CC2)cc1C ZINC000279736083 525316016 /nfs/dbraw/zinc/31/60/16/525316016.db2.gz WOVSKKITQNWUOH-MRXNPFEDSA-N 0 3 263.381 2.746 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@]3(C2)CCCN(C)C3)cc1C ZINC000293527810 525320749 /nfs/dbraw/zinc/32/07/49/525320749.db2.gz BPCYHJIPMKBEGF-SFHVURJKSA-N 0 3 288.435 2.927 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@]3(C2)CCCN(C)C3)cc1C ZINC000293527810 525320756 /nfs/dbraw/zinc/32/07/56/525320756.db2.gz BPCYHJIPMKBEGF-SFHVURJKSA-N 0 3 288.435 2.927 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC(C)(C)CCCO)c1 ZINC000221379977 525346131 /nfs/dbraw/zinc/34/61/31/525346131.db2.gz KTQOKLXTIJUHQI-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN C[C@H]([NH2+]CCN1CCCCC1)c1cc(F)ccc1[O-] ZINC000094617927 525348783 /nfs/dbraw/zinc/34/87/83/525348783.db2.gz SBVXXTWZCFORSZ-LBPRGKRZSA-N 0 3 266.360 2.668 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCNc2ccccn2)c1 ZINC000273588461 525359771 /nfs/dbraw/zinc/35/97/71/525359771.db2.gz ONEZVWKKLRTDQV-CYBMUJFWSA-N 0 3 271.364 2.858 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCC(=O)NC23CCC3)c1 ZINC000283346699 525361931 /nfs/dbraw/zinc/36/19/31/525361931.db2.gz MCHKZEFLAYQPIF-IUODEOHRSA-N 0 3 288.391 2.553 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCC[C@@H](C)CO)c1 ZINC000230669686 525363132 /nfs/dbraw/zinc/36/31/32/525363132.db2.gz UXZAJFGWFSURGK-OLZOCXBDSA-N 0 3 251.370 2.760 20 10 CFCDHN C[C@H]([NH2+]CCc1nccs1)c1cc(F)ccc1[O-] ZINC000094618173 525373466 /nfs/dbraw/zinc/37/34/66/525373466.db2.gz WLTZOFWOXSMAAU-VIFPVBQESA-N 0 3 266.341 2.881 20 10 CFCDHN C[C@@H]([NH2+]C1CCN(C2CC2)CC1)c1cc(F)ccc1[O-] ZINC000094617530 525401730 /nfs/dbraw/zinc/40/17/30/525401730.db2.gz SKBOGKPXPCWHEZ-LLVKDONJSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCN2C)c1cccnc1 ZINC000050286102 525451237 /nfs/dbraw/zinc/45/12/37/525451237.db2.gz MHBLLUAURVJXGZ-ZDUSSCGKSA-N 0 3 267.376 2.925 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649180 525482036 /nfs/dbraw/zinc/48/20/36/525482036.db2.gz HLZGDGBDCXBCRA-OLZOCXBDSA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCOC1)c1cc(F)ccc1[O-] ZINC000094617772 525500395 /nfs/dbraw/zinc/50/03/95/525500395.db2.gz HXMJDDXJKLUAGI-GHMZBOCLSA-N 0 3 253.317 2.609 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000300419136 525577318 /nfs/dbraw/zinc/57/73/18/525577318.db2.gz PSDWOQVIJFQCLH-RJIBLYRGSA-N 0 3 265.328 2.749 20 10 CFCDHN CSC[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000291809394 525706513 /nfs/dbraw/zinc/70/65/13/525706513.db2.gz CSMXIOAQWVIVLQ-NSHDSACASA-N 0 3 295.404 2.696 20 10 CFCDHN CSC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)C1 ZINC000291809394 525706525 /nfs/dbraw/zinc/70/65/25/525706525.db2.gz CSMXIOAQWVIVLQ-NSHDSACASA-N 0 3 295.404 2.696 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cn2ccnc2)c([O-])c1 ZINC000037156849 525739573 /nfs/dbraw/zinc/73/95/73/525739573.db2.gz CRQWZQZPCXHGRH-QWHCGFSZSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccncc1CNCc1ccc2c(c1)CCN2C ZINC000162655918 525747369 /nfs/dbraw/zinc/74/73/69/525747369.db2.gz ZHPCZNRYUCHXTJ-UHFFFAOYSA-N 0 3 267.376 2.672 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CC=CCC2)c([O-])c1 ZINC000281005847 525919437 /nfs/dbraw/zinc/91/94/37/525919437.db2.gz NVKNTABGTBQPRA-AWEZNQCLSA-N 0 3 260.381 2.613 20 10 CFCDHN COc1cccc(C[NH2+]C[C@H](O)c2ccc(C)cc2)c1[O-] ZINC000237213378 526021380 /nfs/dbraw/zinc/02/13/80/526021380.db2.gz ABQMSNNIUKJDAM-HNNXBMFYSA-N 0 3 287.359 2.532 20 10 CFCDHN COc1cccc(CNCc2ccc3c(c2)CCO3)c1 ZINC000037680666 526027853 /nfs/dbraw/zinc/02/78/53/526027853.db2.gz JTKINTBMJCOCBQ-UHFFFAOYSA-N 0 3 269.344 2.920 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2COc3c(C)cccc3C2)c1[O-] ZINC000289710174 526040129 /nfs/dbraw/zinc/04/01/29/526040129.db2.gz UHUDXXPWKNORFX-OAHLLOKOSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cnn([C@H]2CC[N@H+](Cc3cc(C)ccc3[O-])C2)c1 ZINC000290908512 526268327 /nfs/dbraw/zinc/26/83/27/526268327.db2.gz MVBCVGMEXZLESI-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@H]2CC[N@@H+](Cc3cc(C)ccc3[O-])C2)c1 ZINC000290908512 526268330 /nfs/dbraw/zinc/26/83/30/526268330.db2.gz MVBCVGMEXZLESI-HNNXBMFYSA-N 0 3 271.364 2.653 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC3(CCC3)[C@@H]1C1CC1)OCO2 ZINC000291616577 526334285 /nfs/dbraw/zinc/33/42/85/526334285.db2.gz RJUPMWJIMLGQCC-INIZCTEOSA-N 0 3 287.359 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC3(CCC3)[C@@H]1C1CC1)OCO2 ZINC000291616577 526334293 /nfs/dbraw/zinc/33/42/93/526334293.db2.gz RJUPMWJIMLGQCC-INIZCTEOSA-N 0 3 287.359 2.885 20 10 CFCDHN Oc1cc2c(cc1CN1CC3(CCC3)[C@@H]1C1CC1)OCO2 ZINC000291616577 526334296 /nfs/dbraw/zinc/33/42/96/526334296.db2.gz RJUPMWJIMLGQCC-INIZCTEOSA-N 0 3 287.359 2.885 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1OCCc2ccccc21 ZINC000134606176 526374308 /nfs/dbraw/zinc/37/43/08/526374308.db2.gz DKUOOYATJHAPLX-QGZVFWFLSA-N 0 3 269.344 2.796 20 10 CFCDHN Cc1n[nH]c(CC[NH2+][C@H](C)c2ccc3ccccc3c2[O-])n1 ZINC000273422613 526828661 /nfs/dbraw/zinc/82/86/61/526828661.db2.gz JSHDJTNNMXIISL-LLVKDONJSA-N 0 3 296.374 2.865 20 10 CFCDHN Cc1nc(CC[NH2+][C@H](C)c2ccc3ccccc3c2[O-])n[nH]1 ZINC000273422613 526828663 /nfs/dbraw/zinc/82/86/63/526828663.db2.gz JSHDJTNNMXIISL-LLVKDONJSA-N 0 3 296.374 2.865 20 10 CFCDHN Cc1nnc(CC[NH2+][C@H](C)c2ccc3ccccc3c2[O-])[nH]1 ZINC000273422613 526828666 /nfs/dbraw/zinc/82/86/66/526828666.db2.gz JSHDJTNNMXIISL-LLVKDONJSA-N 0 3 296.374 2.865 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@]1(CO)C[C@H]1c1ccccc1 ZINC000289870256 527600793 /nfs/dbraw/zinc/60/07/93/527600793.db2.gz OYIFCNDFHUMBQE-WMZOPIPTSA-N 0 3 283.371 2.648 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1C[C@](C)(OC)C1(C)C ZINC000744448321 574075043 /nfs/dbraw/zinc/07/50/43/574075043.db2.gz IDTHPPKXQSJPBO-HOCLYGCPSA-N 0 3 279.380 2.694 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)ccc1[O-])C1CCOCC1 ZINC000746054658 574132204 /nfs/dbraw/zinc/13/22/04/574132204.db2.gz XHBIDRCGFGISLN-OAHLLOKOSA-N 0 3 263.381 2.995 20 10 CFCDHN C[C@H]1CCC[C@@](CNC(=O)c2cc([O-])cs2)([NH+](C)C)C1 ZINC000732276438 574149143 /nfs/dbraw/zinc/14/91/43/574149143.db2.gz KBWVQWUTNBBCBD-XHDPSFHLSA-N 0 3 296.436 2.694 20 10 CFCDHN CCCCN(C)c1ccc(OCCN(C)C)cc1 ZINC000732411241 574156677 /nfs/dbraw/zinc/15/66/77/574156677.db2.gz YDMZEOWCAQULJF-UHFFFAOYSA-N 0 3 250.386 2.863 20 10 CFCDHN CCOCc1cc(CN[C@@H](CC)COC)ccc1OC ZINC000738440562 574169248 /nfs/dbraw/zinc/16/92/48/574169248.db2.gz VOMRZXQTNILVMB-HNNXBMFYSA-N 0 3 281.396 2.746 20 10 CFCDHN COC(=O)C1CCC([NH2+]Cc2cc(C)ccc2[O-])CC1 ZINC000733327812 574221810 /nfs/dbraw/zinc/22/18/10/574221810.db2.gz BMYAIMQRYAWYIQ-UHFFFAOYSA-N 0 3 277.364 2.522 20 10 CFCDHN COCCC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756342821 574227303 /nfs/dbraw/zinc/22/73/03/574227303.db2.gz LFYGXSRACOJJSQ-MWLCHTKSSA-N 0 3 253.317 2.706 20 10 CFCDHN CN1CC[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000729682160 574227868 /nfs/dbraw/zinc/22/78/68/574227868.db2.gz OCKIHQMQBNMJFZ-QGZVFWFLSA-N 0 3 282.387 2.853 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)c2ccco2)c1 ZINC000756382922 574231825 /nfs/dbraw/zinc/23/18/25/574231825.db2.gz HGCPZRAHHQIDHO-BXUZGUMPSA-N 0 3 261.321 2.678 20 10 CFCDHN COC[C@H](C)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756467780 574239423 /nfs/dbraw/zinc/23/94/23/574239423.db2.gz YLOFHXKQYZQIGZ-SCVCMEIPSA-N 0 3 267.344 2.952 20 10 CFCDHN COC[C@H](C)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756467779 574239433 /nfs/dbraw/zinc/23/94/33/574239433.db2.gz YLOFHXKQYZQIGZ-JFGNBEQYSA-N 0 3 267.344 2.952 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756508302 574242803 /nfs/dbraw/zinc/24/28/03/574242803.db2.gz HNJJJAVSPHUYAU-GXFFZTMASA-N 0 3 289.354 2.874 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCN2CCCCC2=O)c1 ZINC000756555699 574246957 /nfs/dbraw/zinc/24/69/57/574246957.db2.gz LSWBPZFFSDUYLT-AWEZNQCLSA-N 0 3 290.407 2.754 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000756565191 574248308 /nfs/dbraw/zinc/24/83/08/574248308.db2.gz WJXWMSZMJWMWSJ-KOLCDFICSA-N 0 3 265.328 2.584 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756573651 574249380 /nfs/dbraw/zinc/24/93/80/574249380.db2.gz BQLUZIZQABSFRU-JBLDHEPKSA-N 0 3 267.344 2.830 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756643981 574254527 /nfs/dbraw/zinc/25/45/27/574254527.db2.gz WVTCMZLCISKZBQ-MVWJERBFSA-N 0 3 267.344 2.686 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cc(F)cc(F)c1[O-] ZINC000756645506 574255276 /nfs/dbraw/zinc/25/52/76/574255276.db2.gz GJFGYQNJFTWGQX-LDYMZIIASA-N 0 3 293.317 2.602 20 10 CFCDHN C[C@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)[S@@](C)=O ZINC000756761275 574261149 /nfs/dbraw/zinc/26/11/49/574261149.db2.gz MKCKFGLQQKYSSF-QBQZWJRISA-N 0 3 299.411 2.826 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC1)c1cc2c(cc1[O-])CCCC2 ZINC000756768814 574261367 /nfs/dbraw/zinc/26/13/67/574261367.db2.gz NISWLCACYIXULD-CYBMUJFWSA-N 0 3 274.408 2.627 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H](O)c2ccc(C)o2)c([O-])c1 ZINC000741261909 574285180 /nfs/dbraw/zinc/28/51/80/574285180.db2.gz RSKUDLOPHBZAOR-OAHLLOKOSA-N 0 3 291.347 2.516 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CCC(C)(O)CC2)c([O-])c1 ZINC000749296431 574288618 /nfs/dbraw/zinc/28/86/18/574288618.db2.gz OIOZHNLOCMENSI-UHFFFAOYSA-N 0 3 279.380 2.574 20 10 CFCDHN C[NH+](C)CC[C@@H](NC(=O)c1cc([O-])cs1)C(C)(C)C ZINC000734879928 574305974 /nfs/dbraw/zinc/30/59/74/574305974.db2.gz CMXSPJKLNHOYEN-GFCCVEGCSA-N 0 3 284.425 2.550 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@@H]([C@H]3CCOC3)C1)CCC2 ZINC000749797777 574309628 /nfs/dbraw/zinc/30/96/28/574309628.db2.gz CXRGUVSACIIUEC-CVEARBPZSA-N 0 3 287.403 2.739 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@@H]([C@H]3CCOC3)C1)CCC2 ZINC000749797777 574309630 /nfs/dbraw/zinc/30/96/30/574309630.db2.gz CXRGUVSACIIUEC-CVEARBPZSA-N 0 3 287.403 2.739 20 10 CFCDHN COC(=O)CCN(Cc1ccco1)Cc1ccccc1O ZINC000749841355 574312126 /nfs/dbraw/zinc/31/21/26/574312126.db2.gz XBZPQMYFMVSLOW-UHFFFAOYSA-N 0 3 289.331 2.551 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2C[C@@H](OC)C2(C)C)c([O-])c1 ZINC000753372454 574401717 /nfs/dbraw/zinc/40/17/17/574401717.db2.gz FJLXNDMLMFMKRD-LSDHHAIUSA-N 0 3 279.380 2.694 20 10 CFCDHN CC(=O)NC1CCC([N@H+](C)Cc2cccc(C)c2[O-])CC1 ZINC000753590354 574405556 /nfs/dbraw/zinc/40/55/56/574405556.db2.gz MHJPDUGZWCBWJY-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN CC(=O)NC1CCC([N@@H+](C)Cc2cccc(C)c2[O-])CC1 ZINC000753590354 574405557 /nfs/dbraw/zinc/40/55/57/574405557.db2.gz MHJPDUGZWCBWJY-UHFFFAOYSA-N 0 3 290.407 2.580 20 10 CFCDHN Cc1cc(F)ncc1CN(C)Cc1ccccc1O ZINC000891714290 617724227 /nfs/dbraw/zinc/72/42/27/617724227.db2.gz VCHFIVQMNBSGAG-UHFFFAOYSA-N 0 3 260.312 2.867 20 10 CFCDHN CC[N@H+](Cc1ccc(OC)c(OC)c1[O-])C1CCC1 ZINC000892086932 617943403 /nfs/dbraw/zinc/94/34/03/617943403.db2.gz XDWPJEWGZHZTHU-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN CC[N@@H+](Cc1ccc(OC)c(OC)c1[O-])C1CCC1 ZINC000892086932 617943404 /nfs/dbraw/zinc/94/34/04/617943404.db2.gz XDWPJEWGZHZTHU-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN CN(C)c1ccc(CN2CCOC[C@]2(C)C2CC2)cc1 ZINC000934480749 618051529 /nfs/dbraw/zinc/05/15/29/618051529.db2.gz YTCYKFBWQUTXCE-QGZVFWFLSA-N 0 3 274.408 2.754 20 10 CFCDHN CN(C)c1ccc(CN2CCOC[C@@]2(C)C2CC2)cc1 ZINC000934480748 618051711 /nfs/dbraw/zinc/05/17/11/618051711.db2.gz YTCYKFBWQUTXCE-KRWDZBQOSA-N 0 3 274.408 2.754 20 10 CFCDHN Cc1cccc(F)c1CNCc1cc2c(cc1O)OCO2 ZINC000742381086 618128644 /nfs/dbraw/zinc/12/86/44/618128644.db2.gz WHRZWKYDXOKSIY-UHFFFAOYSA-N 0 3 289.306 2.858 20 10 CFCDHN CN1CCCc2cc(CNCc3ccc(F)nc3)ccc21 ZINC000189018054 618321630 /nfs/dbraw/zinc/32/16/30/618321630.db2.gz TXQGYSPOPOFNDX-UHFFFAOYSA-N 0 3 285.366 2.893 20 10 CFCDHN C[C@H](CNC(=O)OC(C)(C)C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000235463585 618330081 /nfs/dbraw/zinc/33/00/81/618330081.db2.gz CZRNQCIRIVMUNE-SNVBAGLBSA-N 0 3 298.358 2.534 20 10 CFCDHN COc1ccc(C[NH2+]C2CC3(C2)COC(C)(C)C3)c([O-])c1 ZINC000894185867 618431588 /nfs/dbraw/zinc/43/15/88/618431588.db2.gz STHAQJWFGIRLRF-UHFFFAOYSA-N 0 3 291.391 2.838 20 10 CFCDHN CC[C@@H](C)C[C@H](CO)[NH2+]Cc1c(C)cccc1[O-] ZINC000877605862 618442696 /nfs/dbraw/zinc/44/26/96/618442696.db2.gz KLPVHYILDKYWNS-DGCLKSJQSA-N 0 3 251.370 2.587 20 10 CFCDHN C/C=C\CNCc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000895405579 618570333 /nfs/dbraw/zinc/57/03/33/618570333.db2.gz LUMYJUBXSWWUTD-PLNGDYQASA-N 0 3 290.338 2.770 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCC[C@H](CO)C1)c1ccccc1[O-] ZINC000311420852 618711220 /nfs/dbraw/zinc/71/12/20/618711220.db2.gz NWPOPCGZSNXQSA-YDHLFZDLSA-N 0 3 263.381 2.984 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCOC(C)C)c1[O-] ZINC000169096909 618720867 /nfs/dbraw/zinc/72/08/67/618720867.db2.gz IMMRWTGSWOKDOS-UHFFFAOYSA-N 0 3 273.760 2.569 20 10 CFCDHN C[C@@H]([NH2+]CCCOC[C@@H]1CCOC1)c1cc(F)ccc1[O-] ZINC000185524167 618927262 /nfs/dbraw/zinc/92/72/62/618927262.db2.gz MVHAPKAVDIKINU-OLZOCXBDSA-N 0 3 297.370 2.625 20 10 CFCDHN CC1CCC(O)(C[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000312822051 618954202 /nfs/dbraw/zinc/95/42/02/618954202.db2.gz MXOBWUPIYPLHLW-KDJCLPLCSA-N 0 3 275.392 2.910 20 10 CFCDHN CC1CCC(O)(C[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000312822054 618954234 /nfs/dbraw/zinc/95/42/34/618954234.db2.gz MXOBWUPIYPLHLW-TVIZTDCDSA-N 0 3 275.392 2.910 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2COCC2(C)C)c1[O-] ZINC000313069958 618973971 /nfs/dbraw/zinc/97/39/71/618973971.db2.gz UBLDLDYODGMQNW-LBPRGKRZSA-N 0 3 285.771 2.569 20 10 CFCDHN CCn1cc(CN[C@H](C)c2cc(OC)ccc2O)c(C)n1 ZINC000894501652 619405113 /nfs/dbraw/zinc/40/51/13/619405113.db2.gz FGTJNOKHMKNLFD-GFCCVEGCSA-N 0 3 289.379 2.776 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC1(C2(O)CCC2)CCC1 ZINC000895870200 619624308 /nfs/dbraw/zinc/62/43/08/619624308.db2.gz LGPKYFXLFBAUEB-UHFFFAOYSA-N 0 3 291.391 2.576 20 10 CFCDHN CC1(C)CC[C@@H](CO)[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000895924257 619635533 /nfs/dbraw/zinc/63/55/33/619635533.db2.gz UJZNYKCZFOHFSN-ZDUSSCGKSA-N 0 3 267.344 2.514 20 10 CFCDHN CC1(C)CC[C@@H](CO)[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000895924257 619635535 /nfs/dbraw/zinc/63/55/35/619635535.db2.gz UJZNYKCZFOHFSN-ZDUSSCGKSA-N 0 3 267.344 2.514 20 10 CFCDHN COC(=O)c1cc(CNCc2c(O)cccc2F)oc1C ZINC000896641465 619782246 /nfs/dbraw/zinc/78/22/46/619782246.db2.gz RTKLHMQZIKWVBL-UHFFFAOYSA-N 0 3 293.294 2.509 20 10 CFCDHN COC(=O)c1cc(C[NH2+]Cc2c([O-])cccc2F)oc1C ZINC000896641465 619782248 /nfs/dbraw/zinc/78/22/48/619782248.db2.gz RTKLHMQZIKWVBL-UHFFFAOYSA-N 0 3 293.294 2.509 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2C[C@@](CO)(c3ccccc3)C2)c([O-])c1 ZINC000897357491 620035021 /nfs/dbraw/zinc/03/50/21/620035021.db2.gz PAMVVAWPPVGTCA-IZAXUBKRSA-N 0 3 297.398 2.883 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(C3(O)CCC3)CC2)c([O-])c1 ZINC000897530231 620217782 /nfs/dbraw/zinc/21/77/82/620217782.db2.gz CNGIDQALTZKTTE-UHFFFAOYSA-N 0 3 291.391 2.576 20 10 CFCDHN COC(=O)C[C@@H]([NH2+]Cc1ccc(C)cc1[O-])C(C)(C)C ZINC000897887337 620298594 /nfs/dbraw/zinc/29/85/94/620298594.db2.gz QOVHRVFNGOIURR-CQSZACIVSA-N 0 3 279.380 2.768 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])c1cncs1 ZINC000897933510 620302700 /nfs/dbraw/zinc/30/27/00/620302700.db2.gz YVJMOUXXZDNIIC-MRVPVSSYSA-N 0 3 252.314 2.839 20 10 CFCDHN OCCc1ccc(CNCc2ccc3c(c2)CCCO3)cc1 ZINC000898168550 620342551 /nfs/dbraw/zinc/34/25/51/620342551.db2.gz IWNVIEOADBCBGX-UHFFFAOYSA-N 0 3 297.398 2.836 20 10 CFCDHN CC[C@H]([NH2+][C@H]1COC[C@H]1C1CC1)c1ccccc1[O-] ZINC000898380754 620379078 /nfs/dbraw/zinc/37/90/78/620379078.db2.gz UUQFMIRHGWAUDK-KKUMJFAQSA-N 0 3 261.365 2.858 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@H]2CNC(=O)C2)c1[O-] ZINC000926980091 620435707 /nfs/dbraw/zinc/43/57/07/620435707.db2.gz OVNXJLFIYLONEP-GHMZBOCLSA-N 0 3 296.798 2.531 20 10 CFCDHN CCn1cnc(CNCCCSc2nccs2)c1 ZINC000902254919 621006639 /nfs/dbraw/zinc/00/66/39/621006639.db2.gz IXGCDAIQGWILPJ-UHFFFAOYSA-N 0 3 282.438 2.632 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CC1)c1cc(Cl)c(Cl)cc1[O-] ZINC000902403704 621068939 /nfs/dbraw/zinc/06/89/39/621068939.db2.gz APZFYQZNIJHRTB-SSDOTTSWSA-N 0 3 275.179 2.841 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CC(=O)N(C)C2)c([O-])c1 ZINC000903213677 621290093 /nfs/dbraw/zinc/29/00/93/621290093.db2.gz PJGGEWMPPSMXOE-KGLIPLIRSA-N 0 3 290.407 2.528 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(C)cc1[O-] ZINC000903286472 621318382 /nfs/dbraw/zinc/31/83/82/621318382.db2.gz KHOFTNQPBOKSJR-WQXBFISLSA-N 0 3 273.376 2.917 20 10 CFCDHN COC(=O)C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000903451688 621386835 /nfs/dbraw/zinc/38/68/35/621386835.db2.gz WPFOCYFXIFYXBU-KWCYVHTRSA-N 0 3 289.375 2.701 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2CCC(O)CC2)c([O-])c1 ZINC000227657297 623116314 /nfs/dbraw/zinc/11/63/14/623116314.db2.gz JXIKMYFFWGMGDC-IYXRBSQSSA-N 0 3 263.381 2.902 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])C[C@@](C)(O)c1ccccc1 ZINC000822517156 623119951 /nfs/dbraw/zinc/11/99/51/623119951.db2.gz UMHCMJXPPPXFDV-QGZVFWFLSA-N 0 3 289.350 2.871 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])C[C@@](C)(O)c1ccccc1 ZINC000822517156 623119965 /nfs/dbraw/zinc/11/99/65/623119965.db2.gz UMHCMJXPPPXFDV-QGZVFWFLSA-N 0 3 289.350 2.871 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H](C)c2cn[nH]c2)c1 ZINC000230669562 623289702 /nfs/dbraw/zinc/28/97/02/623289702.db2.gz OWDYXHLZPYESFQ-UWVGGRQHSA-N 0 3 261.325 2.536 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H](O)C2)c([O-])c1 ZINC000230663701 623291532 /nfs/dbraw/zinc/29/15/32/623291532.db2.gz VUTAMCDKJDXSRX-MELADBBJSA-N 0 3 263.381 2.902 20 10 CFCDHN CCSCCN1CCN(c2ccc(OC)cc2)CC1 ZINC000172730126 623300278 /nfs/dbraw/zinc/30/02/78/623300278.db2.gz VJOQQVPCTWDXOW-UHFFFAOYSA-N 0 3 280.437 2.570 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)C2CCOCC2)c1[O-] ZINC000230935224 623309849 /nfs/dbraw/zinc/30/98/49/623309849.db2.gz OLUVBPDZIWMHNS-SNVBAGLBSA-N 0 3 299.798 2.959 20 10 CFCDHN C[N@H+](CCCCCCCO)Cc1ccccc1[O-] ZINC000173359273 623344846 /nfs/dbraw/zinc/34/48/46/623344846.db2.gz YZXHRVKRVSBAKF-UHFFFAOYSA-N 0 3 251.370 2.767 20 10 CFCDHN C[N@@H+](CCCCCCCO)Cc1ccccc1[O-] ZINC000173359273 623344852 /nfs/dbraw/zinc/34/48/52/623344852.db2.gz YZXHRVKRVSBAKF-UHFFFAOYSA-N 0 3 251.370 2.767 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cc(C2CC2)nn1C ZINC000823850385 623404613 /nfs/dbraw/zinc/40/46/13/623404613.db2.gz BDIIEXSUHRUHQM-UHFFFAOYSA-N 0 3 298.434 2.962 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@](C)(COC)C2)c([O-])c1 ZINC000824576924 623527673 /nfs/dbraw/zinc/52/76/73/623527673.db2.gz VEKLBJRTGCILEO-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@](C)(COC)C2)c([O-])c1 ZINC000824576924 623527677 /nfs/dbraw/zinc/52/76/77/623527677.db2.gz VEKLBJRTGCILEO-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1c([O-])cccc1OC)OC ZINC000824597702 623530254 /nfs/dbraw/zinc/53/02/54/623530254.db2.gz WVMZFLARQDFPMU-IAQYHMDHSA-N 0 3 267.369 2.552 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]([NH+](C)C)C2)cc1Cl ZINC000824688423 623545425 /nfs/dbraw/zinc/54/54/25/623545425.db2.gz GQJCMXSBFCTMHC-ZDUSSCGKSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[N@@H+]3CCC[C@H]3C2)cc1Cl ZINC000824761025 623560008 /nfs/dbraw/zinc/56/00/08/623560008.db2.gz CEGYWISFGKSCOR-ZDUSSCGKSA-N 0 3 280.799 2.634 20 10 CFCDHN Cc1cc([O-])c(CN2CC[N@H+]3CCC[C@H]3C2)cc1Cl ZINC000824761025 623560010 /nfs/dbraw/zinc/56/00/10/623560010.db2.gz CEGYWISFGKSCOR-ZDUSSCGKSA-N 0 3 280.799 2.634 20 10 CFCDHN CCC[N@H+](CCc1nnc(C)o1)Cc1ccccc1[O-] ZINC000929753983 623570923 /nfs/dbraw/zinc/57/09/23/623570923.db2.gz ZDLOJDAKMJLTIR-UHFFFAOYSA-N 0 3 275.352 2.538 20 10 CFCDHN CCC[N@@H+](CCc1nnc(C)o1)Cc1ccccc1[O-] ZINC000929753983 623570931 /nfs/dbraw/zinc/57/09/31/623570931.db2.gz ZDLOJDAKMJLTIR-UHFFFAOYSA-N 0 3 275.352 2.538 20 10 CFCDHN NC(=O)[C@H]1CCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1[O-] ZINC000824959571 623595764 /nfs/dbraw/zinc/59/57/64/623595764.db2.gz JHQXDVDHPYLQQA-MRXNPFEDSA-N 0 3 296.370 2.509 20 10 CFCDHN NC(=O)[C@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ccc1[O-] ZINC000824959571 623595767 /nfs/dbraw/zinc/59/57/67/623595767.db2.gz JHQXDVDHPYLQQA-MRXNPFEDSA-N 0 3 296.370 2.509 20 10 CFCDHN NC(=O)[C@H]1CCCN1Cc1cc(-c2ccccc2)ccc1O ZINC000824959571 623595771 /nfs/dbraw/zinc/59/57/71/623595771.db2.gz JHQXDVDHPYLQQA-MRXNPFEDSA-N 0 3 296.370 2.509 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)Cc1cnn(C)c1)c1ccccc1[O-] ZINC000825046216 623615932 /nfs/dbraw/zinc/61/59/32/623615932.db2.gz QVJGUNCAVIMNBS-SWLSCSKDSA-N 0 3 273.380 2.798 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)[C@H](OC)C2CC2)c([O-])c1 ZINC000825099068 623629632 /nfs/dbraw/zinc/62/96/32/623629632.db2.gz TZWNCKVOSUGMDO-BZNIZROVSA-N 0 3 279.380 2.694 20 10 CFCDHN CCc1cccc(CN2CCO[C@](C)(C3CC3)C2)c1O ZINC000826877897 623901540 /nfs/dbraw/zinc/90/15/40/623901540.db2.gz NHLWCCXRKHTYPR-KRWDZBQOSA-N 0 3 275.392 2.956 20 10 CFCDHN Cc1cc(CN2CCN(C)CC2)ccc1N1CCCCC1 ZINC000827372974 623995003 /nfs/dbraw/zinc/99/50/03/623995003.db2.gz FWPJDJWHXRKBCB-UHFFFAOYSA-N 0 3 287.451 2.733 20 10 CFCDHN C[C@H](C(=O)N[C@@H](C)c1ccccc1O)N1CCCCCC1 ZINC000827978289 624145065 /nfs/dbraw/zinc/14/50/65/624145065.db2.gz OBHHKLXPJDPQCN-UONOGXRCSA-N 0 3 290.407 2.834 20 10 CFCDHN CN(C)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000153876355 624226808 /nfs/dbraw/zinc/22/68/08/624226808.db2.gz MOONOFXPNKETDH-UHFFFAOYSA-N 0 3 262.397 2.698 20 10 CFCDHN CN(C)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000153876355 624226812 /nfs/dbraw/zinc/22/68/12/624226812.db2.gz MOONOFXPNKETDH-UHFFFAOYSA-N 0 3 262.397 2.698 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834602777 625734703 /nfs/dbraw/zinc/73/47/03/625734703.db2.gz UVXFNWCAKMQCSC-ZBEGNZNMSA-N 0 3 299.418 2.951 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834612843 625734743 /nfs/dbraw/zinc/73/47/43/625734743.db2.gz VKVODWPIXSNJOP-YUTCNCBUSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC[C@@H]2CCOC2)c([O-])c1 ZINC000185523808 625735862 /nfs/dbraw/zinc/73/58/62/625735862.db2.gz CLQZDRKNSNQFJC-CABCVRRESA-N 0 3 293.407 2.794 20 10 CFCDHN C[C@H](Cc1ccncc1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834615868 625735987 /nfs/dbraw/zinc/73/59/87/625735987.db2.gz JKONIAYWVOBSRN-DOMZBBRYSA-N 0 3 268.360 2.995 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834722690 625801459 /nfs/dbraw/zinc/80/14/59/625801459.db2.gz XYECWFFVBQNTMP-KOLCDFICSA-N 0 3 275.270 2.546 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000083445909 625849646 /nfs/dbraw/zinc/84/96/46/625849646.db2.gz XKAKJMQJHRHLJP-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN CCO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000834904855 625916920 /nfs/dbraw/zinc/91/69/20/625916920.db2.gz RZVNYXPSSLFUFL-IAOVAPTHSA-N 0 3 292.423 2.597 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@H](O)C2CCC2)c2c1c(F)ccc2[O-] ZINC000834905467 625918071 /nfs/dbraw/zinc/91/80/71/625918071.db2.gz ITBRUIDCQCURPH-IUPBHXKESA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H](O)C2CCC2)c2c1c(F)ccc2[O-] ZINC000834905570 625918177 /nfs/dbraw/zinc/91/81/77/625918177.db2.gz ITBRUIDCQCURPH-LQJRIPTKSA-N 0 3 279.355 2.830 20 10 CFCDHN Cc1cnc(CC[NH2+][C@H](C)c2cc(F)ccc2[O-])cn1 ZINC000834908436 625920242 /nfs/dbraw/zinc/92/02/42/625920242.db2.gz JWLIWQVQWLIHFC-LLVKDONJSA-N 0 3 275.327 2.523 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2cn(C)cn2)c2c1c(F)ccc2[O-] ZINC000840767521 625926028 /nfs/dbraw/zinc/92/60/28/625926028.db2.gz USTRSTSVDKHRQT-GWCFXTLKSA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@H](N[C@@H](CCO)c1ccco1)c1ccccc1O ZINC000186561546 626333776 /nfs/dbraw/zinc/33/37/76/626333776.db2.gz PMHOAAIBPUHQEP-AAEUAGOBSA-N 0 3 261.321 2.760 20 10 CFCDHN CCOc1ccc(C[NH2+][C@]23C[C@H]2COC32CCC2)c([O-])c1 ZINC000923033327 626444874 /nfs/dbraw/zinc/44/48/74/626444874.db2.gz UDQUKOQTCGSPHM-SUMWQHHRSA-N 0 3 289.375 2.592 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@H](C)O ZINC000824921330 626480549 /nfs/dbraw/zinc/48/05/49/626480549.db2.gz JENFSBIXYZZYKO-CABZTGNLSA-N 0 3 257.761 2.603 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)c1[O-] ZINC000839187462 626530206 /nfs/dbraw/zinc/53/02/06/626530206.db2.gz JJPBMZSJABUFSN-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)c1[O-] ZINC000839187462 626530207 /nfs/dbraw/zinc/53/02/07/626530207.db2.gz JJPBMZSJABUFSN-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCC[C@@H]3COC[C@@H]32)c1O ZINC000839187462 626530208 /nfs/dbraw/zinc/53/02/08/626530208.db2.gz JJPBMZSJABUFSN-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000760885932 626780880 /nfs/dbraw/zinc/78/08/80/626780880.db2.gz MUIWHHUFAAMZPG-JGGQBBKZSA-N 0 3 279.380 2.545 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C)C[C@@H](O)c1ccco1 ZINC000763524826 626994745 /nfs/dbraw/zinc/99/47/45/626994745.db2.gz MRAGLDBZIPHMMB-BXUZGUMPSA-N 0 3 291.347 2.596 20 10 CFCDHN Cc1ncc([C@H](C)[NH2+]Cc2ccccc2[O-])c(C)n1 ZINC000765625368 627150987 /nfs/dbraw/zinc/15/09/87/627150987.db2.gz HWQQKJLXQNRHSZ-JTQLQIEISA-N 0 3 257.337 2.650 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)NCc1ccc(N(C)C)cc1C ZINC000766030055 627172793 /nfs/dbraw/zinc/17/27/93/627172793.db2.gz UBDJJOMVXQVLKF-ZDUSSCGKSA-N 0 3 286.423 2.954 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1 ZINC000767195173 627238815 /nfs/dbraw/zinc/23/88/15/627238815.db2.gz IXYXEGZBZVKMBT-IAGOWNOFSA-N 0 3 291.391 2.696 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000767730405 627280857 /nfs/dbraw/zinc/28/08/57/627280857.db2.gz YVTNSAMKSWLAML-CQSZACIVSA-N 0 3 299.370 2.754 20 10 CFCDHN Oc1cc2c(cc1CN1CC[C@H]1c1ccccc1)[C@H](O)CO2 ZINC000768439929 627343160 /nfs/dbraw/zinc/34/31/60/627343160.db2.gz QGEGIQKAVLKWPO-DOTOQJQBSA-N 0 3 297.354 2.765 20 10 CFCDHN CC(C)C[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768465292 627345110 /nfs/dbraw/zinc/34/51/10/627345110.db2.gz FRDDXVLUXHDMTF-WBMJQRKESA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)C[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768465292 627345111 /nfs/dbraw/zinc/34/51/11/627345111.db2.gz FRDDXVLUXHDMTF-WBMJQRKESA-N 0 3 291.391 2.686 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000769513828 627449886 /nfs/dbraw/zinc/44/98/86/627449886.db2.gz FOEGLJWHBVPBIR-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000769513828 627449889 /nfs/dbraw/zinc/44/98/89/627449889.db2.gz FOEGLJWHBVPBIR-ZFWWWQNUSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@H](CO)C(C)(C)C)c([O-])c1 ZINC000769534936 627452823 /nfs/dbraw/zinc/45/28/23/627452823.db2.gz YNYVRVQMGOHMRL-OAHLLOKOSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)c([O-])c1 ZINC000769534936 627452825 /nfs/dbraw/zinc/45/28/25/627452825.db2.gz YNYVRVQMGOHMRL-OAHLLOKOSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC000769541937 627454242 /nfs/dbraw/zinc/45/42/42/627454242.db2.gz XDGFNEODJWKRMX-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC000769541937 627454245 /nfs/dbraw/zinc/45/42/45/627454245.db2.gz XDGFNEODJWKRMX-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000770374983 627516554 /nfs/dbraw/zinc/51/65/54/627516554.db2.gz PMKLUSVJWIWBBR-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1[O-] ZINC000770374983 627516556 /nfs/dbraw/zinc/51/65/56/627516556.db2.gz PMKLUSVJWIWBBR-DZGCQCFKSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc(CN(C)Cc2cccc(O)c2)c1O ZINC000771935330 627650230 /nfs/dbraw/zinc/65/02/30/627650230.db2.gz MZYDUMIITIXAMX-UHFFFAOYSA-N 0 3 273.332 2.738 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](O)c1ccco1)c1ccccc1[O-] ZINC000775416275 628023257 /nfs/dbraw/zinc/02/32/57/628023257.db2.gz UEVKBIZNHUBOEC-OCCSQVGLSA-N 0 3 261.321 2.760 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCC[C@H]1C)c1ccccc1[O-] ZINC000775509002 628032176 /nfs/dbraw/zinc/03/21/76/628032176.db2.gz MIIIEKIDJROZRX-UKRRQHHQSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCC[C@@H]1C)c1ccccc1[O-] ZINC000775508999 628032378 /nfs/dbraw/zinc/03/23/78/628032378.db2.gz MIIIEKIDJROZRX-DZGCQCFKSA-N 0 3 262.397 2.917 20 10 CFCDHN CC(C)[C@H](C)NC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 ZINC000775833570 628073730 /nfs/dbraw/zinc/07/37/30/628073730.db2.gz DWJMSWYTZRVAOM-KBPBESRZSA-N 0 3 291.439 2.564 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](C)CN2CCCCC2)c([O-])c1 ZINC000775974864 628089253 /nfs/dbraw/zinc/08/92/53/628089253.db2.gz YVLFEENHIWIAJR-CQSZACIVSA-N 0 3 292.423 2.755 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCC(F)(F)C1 ZINC000776700216 628169078 /nfs/dbraw/zinc/16/90/78/628169078.db2.gz KFSGEAJRLKNJJQ-VIFPVBQESA-N 0 3 257.280 2.678 20 10 CFCDHN COC(=O)CCC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000779015233 628345513 /nfs/dbraw/zinc/34/55/13/628345513.db2.gz NCBBSJQLMBKOLM-UHFFFAOYSA-N 0 3 295.354 2.697 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@H]2CCCC[C@H]2O)c([O-])c1 ZINC000779154585 628356925 /nfs/dbraw/zinc/35/69/25/628356925.db2.gz WBTBZPOVTLBXTQ-CZUORRHYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c([O-])c1 ZINC000779154585 628356929 /nfs/dbraw/zinc/35/69/29/628356929.db2.gz WBTBZPOVTLBXTQ-CZUORRHYSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000779154587 628357023 /nfs/dbraw/zinc/35/70/23/628357023.db2.gz WBTBZPOVTLBXTQ-XJKSGUPXSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000779154587 628357025 /nfs/dbraw/zinc/35/70/25/628357025.db2.gz WBTBZPOVTLBXTQ-XJKSGUPXSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1ccccc1[C@@H](CO)N[C@@H](C)c1ccccc1O ZINC000783524285 628717001 /nfs/dbraw/zinc/71/70/01/628717001.db2.gz YSPYTTBFQOWBGS-SWLSCSKDSA-N 0 3 287.359 2.785 20 10 CFCDHN C[C@H]1C[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC(C)(C)C1 ZINC000784008272 628761807 /nfs/dbraw/zinc/76/18/07/628761807.db2.gz NLGPYLPWKOCUGF-ABAIWWIYSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC(C)(C)C1 ZINC000784008272 628761812 /nfs/dbraw/zinc/76/18/12/628761812.db2.gz NLGPYLPWKOCUGF-ABAIWWIYSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000784036306 628767633 /nfs/dbraw/zinc/76/76/33/628767633.db2.gz SSVORPOUPAYVTB-SWLSCSKDSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000784036306 628767636 /nfs/dbraw/zinc/76/76/36/628767636.db2.gz SSVORPOUPAYVTB-SWLSCSKDSA-N 0 3 291.391 2.686 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@@H](O)C[C@@H]2C)cc1F ZINC000788270834 629054679 /nfs/dbraw/zinc/05/46/79/629054679.db2.gz SOGOTXMNYHCXBP-JSGCOSHPSA-N 0 3 280.387 2.627 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CC[C@H](O)C2)c([O-])c1 ZINC000788775640 629099102 /nfs/dbraw/zinc/09/91/02/629099102.db2.gz IWZJVOOPSJBLCJ-IHRRRGAJSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1c(CN(C)Cc2cc3c(cc2O)CCC3)cnn1C ZINC000790418387 629237638 /nfs/dbraw/zinc/23/76/38/629237638.db2.gz VNFRRUOIAHLNLP-UHFFFAOYSA-N 0 3 285.391 2.555 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1C[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000790949843 629273764 /nfs/dbraw/zinc/27/37/64/629273764.db2.gz PMSWXSSICMODCV-STQMWFEESA-N 0 3 298.789 2.901 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2c([O-])ccc(Cl)c2F)CC[N@@H+]1C ZINC000790972726 629275941 /nfs/dbraw/zinc/27/59/41/629275941.db2.gz GDUBEYZGEZJWFW-ZJUUUORDSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2c([O-])ccc(Cl)c2F)CC[N@H+]1C ZINC000790972726 629275944 /nfs/dbraw/zinc/27/59/44/629275944.db2.gz GDUBEYZGEZJWFW-ZJUUUORDSA-N 0 3 286.778 2.757 20 10 CFCDHN C[C@H]1COCCCN1C/C=C/c1ccc(N(C)C)cc1 ZINC000835024712 629320168 /nfs/dbraw/zinc/32/01/68/629320168.db2.gz AARYYMFMMUHBHD-DRDHIDPGSA-N 0 3 274.408 2.877 20 10 CFCDHN C[C@@H]1COCCN(C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835024802 629320833 /nfs/dbraw/zinc/32/08/33/629320833.db2.gz BTPQSTMCJHBLIS-XVWMLYKFSA-N 0 3 274.408 2.734 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CCC(C)(O)CC2)cc1 ZINC000835029767 629326678 /nfs/dbraw/zinc/32/66/78/629326678.db2.gz RXHINVUJGJGWGL-SNAWJCMRSA-N 0 3 274.408 2.613 20 10 CFCDHN CN(C)c1ccc(/C=C\CNC[C@H](O)c2ccco2)cc1 ZINC000835036955 629332410 /nfs/dbraw/zinc/33/24/10/629332410.db2.gz SBBVNDHNIGYQFH-IMMZDGJCSA-N 0 3 286.375 2.682 20 10 CFCDHN CCc1cc(CNCC=Cc2ccc(N(C)C)cc2)[nH]n1 ZINC000835039656 629333004 /nfs/dbraw/zinc/33/30/04/629333004.db2.gz JSWRANOCUPCBDT-AATRIKPKSA-N 0 3 284.407 2.841 20 10 CFCDHN CCc1cc(CNCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835039656 629333006 /nfs/dbraw/zinc/33/30/06/629333006.db2.gz JSWRANOCUPCBDT-AATRIKPKSA-N 0 3 284.407 2.841 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CC[C@@H](O)C(C)(C)C2)cc1 ZINC000835046118 629343106 /nfs/dbraw/zinc/34/31/06/629343106.db2.gz STVWTBHUSALPSK-KEGWNNHHSA-N 0 3 288.435 2.859 20 10 CFCDHN Cc1cc(CNC/C=C/c2ccc(N(C)C)cc2)n(C)n1 ZINC000835050128 629350172 /nfs/dbraw/zinc/35/01/72/629350172.db2.gz PBBXAEXVAAMFDX-AATRIKPKSA-N 0 3 284.407 2.598 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccccc2[O-])cc1C ZINC000835073494 629371330 /nfs/dbraw/zinc/37/13/30/629371330.db2.gz MXUQBHMTZLVNRL-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN COCCN(C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792776391 629450637 /nfs/dbraw/zinc/45/06/37/629450637.db2.gz HEYFCGNJMLFVTJ-UHFFFAOYSA-N 0 3 290.329 2.850 20 10 CFCDHN C[C@H]1C[C@H](C)N1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000793219769 629507751 /nfs/dbraw/zinc/50/77/51/629507751.db2.gz DDSALTOLDCZWME-STQMWFEESA-N 0 3 278.371 2.645 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609087 629578204 /nfs/dbraw/zinc/57/82/04/629578204.db2.gz NOEBRMILASMWGQ-HNNXBMFYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609087 629578210 /nfs/dbraw/zinc/57/82/10/629578210.db2.gz NOEBRMILASMWGQ-HNNXBMFYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c([O-])c1 ZINC000793607957 629578515 /nfs/dbraw/zinc/57/85/15/629578515.db2.gz GNUNPJFBQXEYFO-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c([O-])c1 ZINC000793607957 629578516 /nfs/dbraw/zinc/57/85/16/629578516.db2.gz GNUNPJFBQXEYFO-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN C[N@H+](CCN1CCc2ccccc21)Cc1ccccc1[O-] ZINC000794410523 629644048 /nfs/dbraw/zinc/64/40/48/629644048.db2.gz ADMQQDKTQJGUQE-UHFFFAOYSA-N 0 3 282.387 2.887 20 10 CFCDHN C[N@@H+](CCN1CCc2ccccc21)Cc1ccccc1[O-] ZINC000794410523 629644049 /nfs/dbraw/zinc/64/40/49/629644049.db2.gz ADMQQDKTQJGUQE-UHFFFAOYSA-N 0 3 282.387 2.887 20 10 CFCDHN CC[C@H]([NH2+]CC(=O)N(CC)CC)c1ccc(C)cc1[O-] ZINC000794805910 629687659 /nfs/dbraw/zinc/68/76/59/629687659.db2.gz ZDOLBWHZDJFRAI-AWEZNQCLSA-N 0 3 278.396 2.610 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)COCC(C)C)c1ccc(C)cc1[O-] ZINC000794801926 629687691 /nfs/dbraw/zinc/68/76/91/629687691.db2.gz LIKUFNDSBOYSIF-HOCLYGCPSA-N 0 3 295.423 2.775 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000794807097 629687817 /nfs/dbraw/zinc/68/78/17/629687817.db2.gz KDYBNJXCJLQNJM-GDBMZVCRSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@H]([NH2+]C[C@](C)(O)C1CC1)c1ccc(C)cc1[O-] ZINC000794805463 629688178 /nfs/dbraw/zinc/68/81/78/629688178.db2.gz GSVFMJFWIZOKIK-HOCLYGCPSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@H]([NH2+]CC[S@](=O)CC)c1ccc(C)cc1[O-] ZINC000794809174 629688546 /nfs/dbraw/zinc/68/85/46/629688546.db2.gz RBPVBSBYOWZYHA-SCLBCKFNSA-N 0 3 269.410 2.510 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794816221 629690509 /nfs/dbraw/zinc/69/05/09/629690509.db2.gz YFGFZQWBFUPTJI-AWEZNQCLSA-N 0 3 292.423 2.904 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCN2CC=CCC2)c2c1c(F)ccc2[O-] ZINC000794834413 629692271 /nfs/dbraw/zinc/69/22/71/629692271.db2.gz NJOMGQKOAYCRIB-GXTWGEPZSA-N 0 3 290.382 2.931 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCOC[C@H]2C)c([O-])c1 ZINC000796497681 629927135 /nfs/dbraw/zinc/92/71/35/629927135.db2.gz NXAFGZWEJFMRTJ-CHWSQXEVSA-N 0 3 279.380 2.553 20 10 CFCDHN C[C@@H](NCCCSc1nccs1)c1ncc[nH]1 ZINC000796771356 629963474 /nfs/dbraw/zinc/96/34/74/629963474.db2.gz JAKBYYBCZGQLMI-SECBINFHSA-N 0 3 268.411 2.699 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798965283 630265833 /nfs/dbraw/zinc/26/58/33/630265833.db2.gz QUFWZVFMGTZBNT-GFCCVEGCSA-N 0 3 272.323 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798965283 630265835 /nfs/dbraw/zinc/26/58/35/630265835.db2.gz QUFWZVFMGTZBNT-GFCCVEGCSA-N 0 3 272.323 2.916 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCC1(F)CCC1 ZINC000808426670 630990176 /nfs/dbraw/zinc/99/01/76/630990176.db2.gz HGUZNVSSPPIIAW-UHFFFAOYSA-N 0 3 253.317 2.773 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCn2ccnc2)c1[O-] ZINC000808673095 631025986 /nfs/dbraw/zinc/02/59/86/631025986.db2.gz XKIAQSQAPOYGDF-LLVKDONJSA-N 0 3 279.771 2.901 20 10 CFCDHN CC(=O)NCCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808674195 631026293 /nfs/dbraw/zinc/02/62/93/631026293.db2.gz OKYQTIXYIAAOIE-SNVBAGLBSA-N 0 3 284.787 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)c1[O-] ZINC000808703091 631030937 /nfs/dbraw/zinc/03/09/37/631030937.db2.gz HZXVSSCBMBQNQP-GMXVVIOVSA-N 0 3 281.783 2.942 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCCn2cncn2)c1[O-] ZINC000808710797 631032156 /nfs/dbraw/zinc/03/21/56/631032156.db2.gz ONDTZCXTXPJSIO-NSHDSACASA-N 0 3 294.786 2.686 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC(C)(C)C(N)=O)c1[O-] ZINC000808709965 631032669 /nfs/dbraw/zinc/03/26/69/631032669.db2.gz JTIJUDBNJUBYMO-SECBINFHSA-N 0 3 284.787 2.516 20 10 CFCDHN CCN(C)C(=O)[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808716760 631035162 /nfs/dbraw/zinc/03/51/62/631035162.db2.gz VGXKXJWNLJLXNY-GHMZBOCLSA-N 0 3 298.814 2.871 20 10 CFCDHN CC[C@H](N[C@@H](c1nncn1C)C(C)C)c1ccccc1O ZINC000809691712 631263850 /nfs/dbraw/zinc/26/38/50/631263850.db2.gz LUGGHOIMNNYBDA-DZGCQCFKSA-N 0 3 288.395 2.959 20 10 CFCDHN CN(C)CC[N@H+](CCc1ccccc1)Cc1ccccc1[O-] ZINC000809730849 631272581 /nfs/dbraw/zinc/27/25/81/631272581.db2.gz HJRSTGZOZBWVNC-UHFFFAOYSA-N 0 3 298.430 2.999 20 10 CFCDHN CN(C)CC[N@@H+](CCc1ccccc1)Cc1ccccc1[O-] ZINC000809730849 631272583 /nfs/dbraw/zinc/27/25/83/631272583.db2.gz HJRSTGZOZBWVNC-UHFFFAOYSA-N 0 3 298.430 2.999 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@@H](O)C2CC2)c1[O-] ZINC000809752313 631281438 /nfs/dbraw/zinc/28/14/38/631281438.db2.gz QKLHOTYGMYCHNM-CYBMUJFWSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H](O)C2CC2)c1[O-] ZINC000809752313 631281445 /nfs/dbraw/zinc/28/14/45/631281445.db2.gz QKLHOTYGMYCHNM-CYBMUJFWSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1ccc(O)c(CN2CCO[C@@H](C3CCC3)C2)c1 ZINC000840954966 631281992 /nfs/dbraw/zinc/28/19/92/631281992.db2.gz OCJFSFCPPVXMOW-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@]2(C)CCCO)c([O-])c1 ZINC000809758004 631282772 /nfs/dbraw/zinc/28/27/72/631282772.db2.gz ZIHGLCLFLZBZCE-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@]2(C)CCCO)c([O-])c1 ZINC000809758004 631282776 /nfs/dbraw/zinc/28/27/76/631282776.db2.gz ZIHGLCLFLZBZCE-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@]1(C)CCCO ZINC000809757151 631283042 /nfs/dbraw/zinc/28/30/42/631283042.db2.gz KBWPOCVDXYQFBX-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@]1(C)CCCO ZINC000809757151 631283046 /nfs/dbraw/zinc/28/30/46/631283046.db2.gz KBWPOCVDXYQFBX-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@@H](C)O[C@@H]2C)c([O-])c1 ZINC000840962639 631285539 /nfs/dbraw/zinc/28/55/39/631285539.db2.gz DXKVGNSZOZLMMG-BZPMIXESSA-N 0 3 279.380 2.694 20 10 CFCDHN [NH3+]C1(CNCc2c([O-])ccc(Cl)c2F)CCCCC1 ZINC000841040139 631318301 /nfs/dbraw/zinc/31/83/01/631318301.db2.gz JUPKBZUGRUZAHC-UHFFFAOYSA-N 0 3 286.778 2.936 20 10 CFCDHN C[C@@H]([NH3+])[C@@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000841081535 631332963 /nfs/dbraw/zinc/33/29/63/631332963.db2.gz SNINWCPHIWLBHC-RNFRBKRXSA-N 0 3 263.168 2.524 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000841089967 631337437 /nfs/dbraw/zinc/33/74/37/631337437.db2.gz SKFNTFIWTWABBY-LBPRGKRZSA-N 0 3 298.789 2.949 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(CC(N)=O)cc1)c1ccccc1[O-] ZINC000810242460 631348807 /nfs/dbraw/zinc/34/88/07/631348807.db2.gz CVQSHFUIMXYNAB-MRXNPFEDSA-N 0 3 298.386 2.661 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cncn2C)c1[O-] ZINC000810243166 631349000 /nfs/dbraw/zinc/34/90/00/631349000.db2.gz MFDMUWCNYGOECV-JTQLQIEISA-N 0 3 279.771 2.938 20 10 CFCDHN COCC[C@H](COC)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000810257750 631350423 /nfs/dbraw/zinc/35/04/23/631350423.db2.gz VLBQLPYTXBPJIZ-NQBHXWOUSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@](C)(O)C2)c2c1c(F)ccc2[O-] ZINC000841758182 631467816 /nfs/dbraw/zinc/46/78/16/631467816.db2.gz FJLUAMLJDOMWNE-VKQTUNLWSA-N 0 3 265.328 2.583 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CC2(N(C)C)CC2)c2c1c(F)ccc2[O-] ZINC000841764317 631468958 /nfs/dbraw/zinc/46/89/58/631468958.db2.gz WDHXZZRVVICIJU-CMPLNLGQSA-N 0 3 278.371 2.763 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(CC(F)F)C2)c([O-])c1 ZINC000841764161 631469098 /nfs/dbraw/zinc/46/90/98/631469098.db2.gz DHNQIAUMKPXZIH-RYUDHWBXSA-N 0 3 284.350 2.691 20 10 CFCDHN COc1cccc(O)c1CN1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000811510651 631574810 /nfs/dbraw/zinc/57/48/10/631574810.db2.gz MIUYIJKXSUVWSW-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000811510651 631574812 /nfs/dbraw/zinc/57/48/12/631574812.db2.gz MIUYIJKXSUVWSW-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000811510651 631574813 /nfs/dbraw/zinc/57/48/13/631574813.db2.gz MIUYIJKXSUVWSW-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCS[C@@H]2C)c([O-])c1 ZINC000842777715 631737982 /nfs/dbraw/zinc/73/79/82/631737982.db2.gz CNKZAWINULFSJH-MFKMUULPSA-N 0 3 267.394 2.775 20 10 CFCDHN Cn1ncc2ccc(C[NH2+]Cc3ccccc3[O-])cc21 ZINC000812771530 631770635 /nfs/dbraw/zinc/77/06/35/631770635.db2.gz YAWIWLVWONPCPY-UHFFFAOYSA-N 0 3 267.332 2.569 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]([NH3+])[C@H](C)C2)c(Cl)c1 ZINC000843051010 631814554 /nfs/dbraw/zinc/81/45/54/631814554.db2.gz DDSQFOYQIOZXOQ-MFKMUULPSA-N 0 3 268.788 2.523 20 10 CFCDHN CC[C@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@@H]1[NH3+] ZINC000843053132 631817611 /nfs/dbraw/zinc/81/76/11/631817611.db2.gz XQPIYTGNMKBFTE-GWCFXTLKSA-N 0 3 268.788 2.605 20 10 CFCDHN CC[C@@H]([NH2+]CCOc1cccnc1)c1ccccc1[O-] ZINC000155841383 650034041 /nfs/dbraw/zinc/03/40/41/650034041.db2.gz CYNHVJXXWSNSTO-OAHLLOKOSA-N 0 3 272.348 2.907 20 10 CFCDHN CCN(C)c1ccc(CN2CCC(F)(F)[C@@H](CO)C2)cc1 ZINC000815118743 632205712 /nfs/dbraw/zinc/20/57/12/632205712.db2.gz KSNQLFGLKWAZGP-CQSZACIVSA-N 0 3 298.377 2.592 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000815150733 632218382 /nfs/dbraw/zinc/21/83/82/632218382.db2.gz MJRQTQBRMHPRRY-AWEZNQCLSA-N 0 3 293.407 2.679 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)CO)c([O-])c1 ZINC000815597263 632295564 /nfs/dbraw/zinc/29/55/64/632295564.db2.gz RCMLIVVJBMUSQI-GFCCVEGCSA-N 0 3 251.370 2.678 20 10 CFCDHN CN1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2[O-])C1 ZINC000816549392 632482114 /nfs/dbraw/zinc/48/21/14/632482114.db2.gz MPOZVGNJTKUYCJ-AWEZNQCLSA-N 0 3 284.403 2.977 20 10 CFCDHN CN1CCN(Cc2cc(F)ccc2O)c2ccccc2C1 ZINC000816618368 632495484 /nfs/dbraw/zinc/49/54/84/632495484.db2.gz WAEVGNLREJZBTQ-UHFFFAOYSA-N 0 3 286.350 2.983 20 10 CFCDHN COc1ccc(O)c(CN2CCN(C)Cc3ccccc32)c1 ZINC000816617784 632496103 /nfs/dbraw/zinc/49/61/03/632496103.db2.gz IWHPLUWBUWKKPB-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@]2(O)CCC[C@@H]2C)c1[O-] ZINC000816661409 632507607 /nfs/dbraw/zinc/50/76/07/632507607.db2.gz MTAFAXYDJNGXIV-NHYWBVRUSA-N 0 3 283.799 2.995 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC([C@@H](C)CO)CC2)c([O-])c1 ZINC000846059138 632626298 /nfs/dbraw/zinc/62/62/98/632626298.db2.gz YTOVEROPJHEWMM-ZDUSSCGKSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H](CCO)CC2)c1[O-] ZINC000817418763 632627793 /nfs/dbraw/zinc/62/77/93/632627793.db2.gz FOAGSBOGWQPGQS-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H](CCO)CC2)c1[O-] ZINC000817418763 632627795 /nfs/dbraw/zinc/62/77/95/632627795.db2.gz FOAGSBOGWQPGQS-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN COc1cccc([C@@H](C)NCc2cccc(C)n2)c1O ZINC000846143451 632645711 /nfs/dbraw/zinc/64/57/11/632645711.db2.gz ISOIAXGCNYLRBR-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCC1(CO)CCC1)CC2 ZINC000846209640 632660397 /nfs/dbraw/zinc/66/03/97/632660397.db2.gz GOYGJYODBGSUAZ-ZDUSSCGKSA-N 0 3 261.365 2.522 20 10 CFCDHN CCN1C[C@@H](C[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])CC1=O ZINC000846209690 632660879 /nfs/dbraw/zinc/66/08/79/632660879.db2.gz SDDRPDIRKNEILJ-ZIAGYGMSSA-N 0 3 290.407 2.528 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCc2c1ccc(=O)n2C)c1ccccc1[O-] ZINC000846216001 632662780 /nfs/dbraw/zinc/66/27/80/632662780.db2.gz OUHHBHIRVBHIRT-SWLSCSKDSA-N 0 3 298.386 2.819 20 10 CFCDHN C[C@H]([NH2+]CCCC1(O)CCC1)c1cc(F)ccc1[O-] ZINC000817585205 632671352 /nfs/dbraw/zinc/67/13/52/632671352.db2.gz CMCQLFGHNQPFGU-NSHDSACASA-N 0 3 267.344 2.877 20 10 CFCDHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1cc(Cl)ccc1O ZINC000846475743 632716664 /nfs/dbraw/zinc/71/66/64/632716664.db2.gz HXAQDZZNQMRXDH-GHMZBOCLSA-N 0 3 296.798 2.535 20 10 CFCDHN C[C@H]([NH2+]C1CCNCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817935612 632741761 /nfs/dbraw/zinc/74/17/61/632741761.db2.gz KCGUOKYLKZULNL-VIFPVBQESA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@@H](N[C@H]1CCC[NH2+]C1)c1cccc(Cl)c1[O-] ZINC000817940739 632744323 /nfs/dbraw/zinc/74/43/23/632744323.db2.gz KHOCFLAEJFIEOT-GXFFZTMASA-N 0 3 268.788 2.838 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](N)c1ccc(N(C)C)cc1)c1ccccc1[O-] ZINC000817943571 632746527 /nfs/dbraw/zinc/74/65/27/632746527.db2.gz VPPWIOVZISHHEO-CXAGYDPISA-N 0 3 299.418 2.809 20 10 CFCDHN C[C@H](NC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817951146 632751800 /nfs/dbraw/zinc/75/18/00/632751800.db2.gz AGKMAWVVYBCUKC-GXSJLCMTSA-N 0 3 299.212 2.557 20 10 CFCDHN C[C@@H](NC[C@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817951148 632752094 /nfs/dbraw/zinc/75/20/94/632752094.db2.gz AGKMAWVVYBCUKC-MWLCHTKSSA-N 0 3 299.212 2.557 20 10 CFCDHN Nc1ccc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000817956953 632755548 /nfs/dbraw/zinc/75/55/48/632755548.db2.gz GLLBWGJXTMRBQZ-OAHLLOKOSA-N 0 3 268.360 2.794 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CN)CC(C)C)c1ccc(F)cc1[O-] ZINC000817957918 632756245 /nfs/dbraw/zinc/75/62/45/632756245.db2.gz GEAZUAJOXCJLMI-OCCSQVGLSA-N 0 3 268.376 2.945 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000817971686 632771475 /nfs/dbraw/zinc/77/14/75/632771475.db2.gz PATJQNBUIPAHGR-JKOKRWQUSA-N 0 3 266.360 2.713 20 10 CFCDHN C[C@H]([NH3+])CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817972077 632772083 /nfs/dbraw/zinc/77/20/83/632772083.db2.gz JOIHRAJBKMLCIW-BQBZGAKWSA-N 0 3 263.168 2.697 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1cc(Cl)ccc1[O-] ZINC000817977224 632774993 /nfs/dbraw/zinc/77/49/93/632774993.db2.gz FBZHHQNFLNPZEQ-PTRXPTGYSA-N 0 3 256.777 2.822 20 10 CFCDHN C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1[O-] ZINC000817978001 632775295 /nfs/dbraw/zinc/77/52/95/632775295.db2.gz SUHSKYNDGKQXIA-VGMNWLOBSA-N 0 3 287.201 2.541 20 10 CFCDHN CC[C@@H]([NH2+]CCCNC1CC1)c1ccc(F)cc1[O-] ZINC000817984095 632780913 /nfs/dbraw/zinc/78/09/13/632780913.db2.gz MWHUQJFYFWEKRW-CQSZACIVSA-N 0 3 266.360 2.714 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000848928141 633410708 /nfs/dbraw/zinc/41/07/08/633410708.db2.gz WPZSLTVKYAOGCA-LSDHHAIUSA-N 0 3 278.371 2.638 20 10 CFCDHN NC1(C[NH2+]Cc2cccc(Br)c2[O-])CCCC1 ZINC000849350126 633626276 /nfs/dbraw/zinc/62/62/76/633626276.db2.gz QXCKRBBVACHSHS-UHFFFAOYSA-N 0 3 299.212 2.516 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccc(C)o3)C2)cc1 ZINC000850345433 633947542 /nfs/dbraw/zinc/94/75/42/633947542.db2.gz AAZJTHHUCMZGFQ-AWEZNQCLSA-N 0 3 286.375 2.965 20 10 CFCDHN CC[C@@H](COCC1CC1)[NH2+]Cc1c([O-])cccc1OC ZINC000850350888 633951090 /nfs/dbraw/zinc/95/10/90/633951090.db2.gz VZOFSXKLZNEUKU-ZDUSSCGKSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cc(Br)cc(C[NH2+][C@H]2C=CCC2)c1[O-] ZINC000850358271 633953887 /nfs/dbraw/zinc/95/38/87/633953887.db2.gz MQYMNOKEEUIUNV-NSHDSACASA-N 0 3 298.180 2.972 20 10 CFCDHN O[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)c2ccccc21 ZINC000850369551 633959508 /nfs/dbraw/zinc/95/95/08/633959508.db2.gz BAPIOJIDOUCCKF-SJORKVTESA-N 0 3 281.355 2.890 20 10 CFCDHN COc1cccc(O)c1CN[C@H]1C[C@H](O)c2ccccc21 ZINC000850370985 633961177 /nfs/dbraw/zinc/96/11/77/633961177.db2.gz HGRYBUWVLBOIPQ-HOCLYGCPSA-N 0 3 285.343 2.669 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000850393686 633974713 /nfs/dbraw/zinc/97/47/13/633974713.db2.gz DLVKFIFIGCEXNE-GFCCVEGCSA-N 0 3 271.307 2.782 20 10 CFCDHN COc1ccc(CN[C@@H]2CCCn3nccc32)cc1C ZINC000850430358 633989554 /nfs/dbraw/zinc/98/95/54/633989554.db2.gz OQDYBEZVJBQKQB-CQSZACIVSA-N 0 3 271.364 2.825 20 10 CFCDHN COC1CC(CC[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000850482680 634012399 /nfs/dbraw/zinc/01/23/99/634012399.db2.gz QYPFSUZPGBWFDM-UBHUBRDASA-N 0 3 261.365 2.784 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H](CO)C2CCC2)c2c1c(F)ccc2[O-] ZINC000850487374 634014576 /nfs/dbraw/zinc/01/45/76/634014576.db2.gz IDIRYXUGAUHMHS-ICCXJUOJSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2N(C)C1=O)c1ccccc1[O-] ZINC000850500743 634019638 /nfs/dbraw/zinc/01/96/38/634019638.db2.gz IYWHATVVVPMUFQ-SWLSCSKDSA-N 0 3 296.370 2.631 20 10 CFCDHN CO[C@@H]1CCC[C@H]([C@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000850503825 634021190 /nfs/dbraw/zinc/02/11/90/634021190.db2.gz ZHJZNHSXCKTTEV-AYDFFVQHSA-N 0 3 293.407 2.609 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C1(CO)CC1)c1ccc(C)cc1[O-] ZINC000850513819 634026063 /nfs/dbraw/zinc/02/60/63/634026063.db2.gz HAIMCQPVYDEOST-OCCSQVGLSA-N 0 3 263.381 2.902 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)C1(CO)CC1)c1ccc(C)cc1[O-] ZINC000850513820 634026432 /nfs/dbraw/zinc/02/64/32/634026432.db2.gz HAIMCQPVYDEOST-TZMCWYRMSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)C1(CO)CC1 ZINC000850515805 634026597 /nfs/dbraw/zinc/02/65/97/634026597.db2.gz HZQAVECVQICEOF-JFGNBEQYSA-N 0 3 279.355 2.830 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](CO)CC1CC1)c1ccccc1[O-] ZINC000850544169 634046541 /nfs/dbraw/zinc/04/65/41/634046541.db2.gz DCZLUSDCFQBSOZ-DZGCQCFKSA-N 0 3 263.381 2.842 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)[C@]1(O)CCCOC1)c1ccccc1[O-] ZINC000850561132 634054084 /nfs/dbraw/zinc/05/40/84/634054084.db2.gz HZZCNLMFOATDIS-GUYCJALGSA-N 0 3 293.407 2.611 20 10 CFCDHN CO[C@@H](CNCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858168400 636146018 /nfs/dbraw/zinc/14/60/18/636146018.db2.gz URWHJUQKVQWBHH-HNNXBMFYSA-N 0 3 284.350 2.545 20 10 CFCDHN CCC[C@@H](CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858171608 636147515 /nfs/dbraw/zinc/14/75/15/636147515.db2.gz ZLYKMEKXPBQVBA-LBPRGKRZSA-N 0 3 286.366 2.936 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858284137 636175977 /nfs/dbraw/zinc/17/59/77/636175977.db2.gz XORNENMAHWTLLW-DJQAVVSRSA-N 0 3 298.377 2.932 20 10 CFCDHN CC(C)CC[C@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000858484966 636267536 /nfs/dbraw/zinc/26/75/36/636267536.db2.gz HHGPNZGNGDGDRW-CHWSQXEVSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@H](Nc1ccnc(CO)c1)c1ccc(N(C)C)cc1 ZINC000858488154 636270693 /nfs/dbraw/zinc/27/06/93/636270693.db2.gz ONAFAHWEQYAISW-LBPRGKRZSA-N 0 3 271.364 2.813 20 10 CFCDHN CCOC(C)(C)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000159294074 650254386 /nfs/dbraw/zinc/25/43/86/650254386.db2.gz PDRAQHICIXPZOZ-SNVBAGLBSA-N 0 3 255.333 2.997 20 10 CFCDHN CN(C)c1cc(F)c(CN2CCC[C@H]2C(C)(C)O)cc1F ZINC000862324893 637321391 /nfs/dbraw/zinc/32/13/91/637321391.db2.gz XQHCMJQAMAVLTO-HNNXBMFYSA-N 0 3 298.377 2.766 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC[C@H](C)NC1)c1ccc(F)cc1[O-] ZINC000863546731 637693677 /nfs/dbraw/zinc/69/36/77/637693677.db2.gz NMKFIMSOHAPQJC-JKOKRWQUSA-N 0 3 266.360 2.713 20 10 CFCDHN FC(F)(F)[C@@H]1C[C@H]1NCc1ccc2c(c1)CCO2 ZINC000865753677 638553434 /nfs/dbraw/zinc/55/34/34/638553434.db2.gz OOYQJGDRAQQSKV-GHMZBOCLSA-N 0 3 257.255 2.662 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000865778532 638568362 /nfs/dbraw/zinc/56/83/62/638568362.db2.gz KZPVQJVBCYIOKR-CQSZACIVSA-N 0 3 261.365 2.689 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCn2nccc21)c1cc(F)ccc1[O-] ZINC000866634314 638858572 /nfs/dbraw/zinc/85/85/72/638858572.db2.gz QDQYBZYUAORVFD-ZWNOBZJWSA-N 0 3 275.327 2.914 20 10 CFCDHN C[C@H](NC(=O)C[C@@H]1NCc2ccccc21)c1ccccc1O ZINC000870988781 641139895 /nfs/dbraw/zinc/13/98/95/641139895.db2.gz ZJOPKCDIQXQUAC-LRDDRELGSA-N 0 3 296.370 2.804 20 10 CFCDHN Cc1ccc(N(C)C(=O)c2cccc3c2CCNC3)cc1 ZINC000124248607 641938834 /nfs/dbraw/zinc/93/88/34/641938834.db2.gz ZQZLYJKXPYPSLT-UHFFFAOYSA-N 0 3 280.371 2.917 20 10 CFCDHN COc1cc(CN2CCC(C(C)=O)CC2)c(O)cc1C ZINC000872800024 641941147 /nfs/dbraw/zinc/94/11/47/641941147.db2.gz OYYJDSRYNSUDAY-UHFFFAOYSA-N 0 3 277.364 2.510 20 10 CFCDHN Cc1ccc(O)c(CN[C@H](C)c2nccnc2C)c1 ZINC000873189335 642057752 /nfs/dbraw/zinc/05/77/52/642057752.db2.gz PCMYIMMQZWJLQM-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccccn2)c1 ZINC000019957603 642241748 /nfs/dbraw/zinc/24/17/48/642241748.db2.gz WZQVRAWYYQCGMB-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN C[C@@H]([NH2+]CC1(O)CCC(C)CC1)c1ccccc1[O-] ZINC000087043955 650799017 /nfs/dbraw/zinc/79/90/17/650799017.db2.gz SEXRWQYCTSDZOB-MFOWVQHXSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](OCC(C)C)C2)c([O-])c1 ZINC000876809901 643017588 /nfs/dbraw/zinc/01/75/88/643017588.db2.gz ZPQCQVCWNPOYEJ-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c([O-])c1 ZINC000876809901 643017593 /nfs/dbraw/zinc/01/75/93/643017593.db2.gz ZPQCQVCWNPOYEJ-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCOCC(C)C ZINC000876901152 643057797 /nfs/dbraw/zinc/05/77/97/643057797.db2.gz AHXJXOYEBHGVBC-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2COc3ccccc3O2)c([O-])c1 ZINC000876908134 643060053 /nfs/dbraw/zinc/06/00/53/643060053.db2.gz JUCDWOIOLXNBJR-CQSZACIVSA-N 0 3 285.343 2.630 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000876959524 643081956 /nfs/dbraw/zinc/08/19/56/643081956.db2.gz LXVWKAXRNVKBAX-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN CC[C@@H]([NH2+]CCCn1cccn1)c1ccccc1[O-] ZINC000126262367 643084407 /nfs/dbraw/zinc/08/44/07/643084407.db2.gz QTJQSMSEGALRSJ-CQSZACIVSA-N 0 3 259.353 2.720 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CCO)c1ccccc1 ZINC000877054695 643123311 /nfs/dbraw/zinc/12/33/11/643123311.db2.gz KFLJFVCVGKITGP-MRXNPFEDSA-N 0 3 285.387 2.956 20 10 CFCDHN Cc1ccc(C[NH2+]CCCC(C)(C)CO)c([O-])c1 ZINC000877059249 643125940 /nfs/dbraw/zinc/12/59/40/643125940.db2.gz SVAHDJVBVNRLAK-UHFFFAOYSA-N 0 3 251.370 2.589 20 10 CFCDHN Cc1ccc(C[NH2+]CCCOCC2CCOCC2)c([O-])c1 ZINC000877058902 643126180 /nfs/dbraw/zinc/12/61/80/643126180.db2.gz NZFRPKYZOHDZQO-UHFFFAOYSA-N 0 3 293.407 2.624 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(C)CCCC[C@@H]2O)c([O-])c1 ZINC000877080671 643140975 /nfs/dbraw/zinc/14/09/75/643140975.db2.gz GJGDURHHSPHXBP-JKSUJKDBSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ncc(CC[NH2+]Cc2c(C)cccc2[O-])s1 ZINC000877114777 643157489 /nfs/dbraw/zinc/15/74/89/643157489.db2.gz AYTDSKBBMWTEHZ-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCc1ccccn1 ZINC000877116088 643159147 /nfs/dbraw/zinc/15/91/47/643159147.db2.gz JFYOOOAKFAAUAJ-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877117207 643159919 /nfs/dbraw/zinc/15/99/19/643159919.db2.gz OEZYEXVUPHEBFH-ZDUSSCGKSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@](C)(O)c1ccc(F)cc1 ZINC000877127688 643166120 /nfs/dbraw/zinc/16/61/20/643166120.db2.gz MYMMJUAARURPQW-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c([O-])c1 ZINC000877135546 643170689 /nfs/dbraw/zinc/17/06/89/643170689.db2.gz GICMVZJFGADPAZ-HOCLYGCPSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000877139419 643173863 /nfs/dbraw/zinc/17/38/63/643173863.db2.gz NVAAQWNKAZWLQO-HOCLYGCPSA-N 0 3 277.408 2.930 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000877139419 643173869 /nfs/dbraw/zinc/17/38/69/643173869.db2.gz NVAAQWNKAZWLQO-HOCLYGCPSA-N 0 3 277.408 2.930 20 10 CFCDHN CCOC(=O)C1(C[NH2+]Cc2ccc(C)cc2[O-])CCC1 ZINC000877312022 643233416 /nfs/dbraw/zinc/23/34/16/643233416.db2.gz CDFXQWYWAZWTIL-UHFFFAOYSA-N 0 3 277.364 2.524 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+]Cc2ccc(C)cc2[O-])c1 ZINC000877465338 643285320 /nfs/dbraw/zinc/28/53/20/643285320.db2.gz RXDUTGRTRVZBSL-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000877486609 643301298 /nfs/dbraw/zinc/30/12/98/643301298.db2.gz OLCBYYJJADTKNA-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c([O-])c1 ZINC000877486609 643301303 /nfs/dbraw/zinc/30/13/03/643301303.db2.gz OLCBYYJJADTKNA-HIFRSBDPSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc(CN2C[C@H](C)O[C@@H](C3CC3)C2)c(O)c1 ZINC000877486093 643302370 /nfs/dbraw/zinc/30/23/70/643302370.db2.gz DRICSJPTDKZNBS-BLLLJJGKSA-N 0 3 261.365 2.700 20 10 CFCDHN COc1ccc(C[NH2+]C[C@H]2CC2(Cl)Cl)c([O-])c1 ZINC000877494403 643307778 /nfs/dbraw/zinc/30/77/78/643307778.db2.gz WMTCKMOUQPFRTJ-SECBINFHSA-N 0 3 276.163 2.684 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccc(F)c2N)c1 ZINC000877532267 643334828 /nfs/dbraw/zinc/33/48/28/643334828.db2.gz DKOPMMIQVYJWOQ-JTQLQIEISA-N 0 3 290.338 2.973 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)c([O-])c1 ZINC000877534532 643337033 /nfs/dbraw/zinc/33/70/33/643337033.db2.gz CFWWZLYDPUWYDD-CXAGYDPISA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2COc3ccccc32)c([O-])c1 ZINC000877537997 643341277 /nfs/dbraw/zinc/34/12/77/643341277.db2.gz RZYWDHMTICSEEV-CQSZACIVSA-N 0 3 269.344 2.966 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)c([O-])c1 ZINC000877540285 643342510 /nfs/dbraw/zinc/34/25/10/643342510.db2.gz VLAKWTDZTSNZIS-IEBWSBKVSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@H+](Cc3ccc(C)cc3[O-])C2)c1 ZINC000877540981 643343718 /nfs/dbraw/zinc/34/37/18/643343718.db2.gz CNXLVDHWHSXXTI-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(C)cc3[O-])C2)c1 ZINC000877540981 643343723 /nfs/dbraw/zinc/34/37/23/643343723.db2.gz CNXLVDHWHSXXTI-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1c(C)cccc1[O-])OC ZINC000877548304 643348943 /nfs/dbraw/zinc/34/89/43/643348943.db2.gz VKURNDDMYGFOHF-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(O)CCCC1(C)C ZINC000877551599 643352837 /nfs/dbraw/zinc/35/28/37/643352837.db2.gz HHBCJRLWUMMAAJ-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN C[N@@H+]1CCC[C@@]2(CCN(Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551700 643352890 /nfs/dbraw/zinc/35/28/90/643352890.db2.gz KBKGEEMRWPHLJL-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN C[N@H+]1CCC[C@@]2(CCN(Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551700 643352896 /nfs/dbraw/zinc/35/28/96/643352896.db2.gz KBKGEEMRWPHLJL-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@@]2(CC[N@H+](Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551700 643352903 /nfs/dbraw/zinc/35/29/03/643352903.db2.gz KBKGEEMRWPHLJL-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN CN1CCC[C@@]2(CC[N@@H+](Cc3ccc(F)c(F)c3[O-])C2)C1 ZINC000877551700 643352910 /nfs/dbraw/zinc/35/29/10/643352910.db2.gz KBKGEEMRWPHLJL-MRXNPFEDSA-N 0 3 296.361 2.588 20 10 CFCDHN Cc1ccc(CN2C[C@]3(CCCO3)[C@H]2C2CC2)c(O)c1 ZINC000877555633 643357448 /nfs/dbraw/zinc/35/74/48/643357448.db2.gz YCEPVKOYRNVYCZ-IAGOWNOFSA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1cccnc1CC[NH2+]Cc1c(C)cccc1[O-] ZINC000877566300 643365014 /nfs/dbraw/zinc/36/50/14/643365014.db2.gz XOILBWMMTNKXRU-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1ccc(C[NH2+]C(C)(C)COC(C)C)c([O-])c1 ZINC000877590375 643384010 /nfs/dbraw/zinc/38/40/10/643384010.db2.gz WYWCPJCPDXJBKV-UHFFFAOYSA-N 0 3 251.370 2.994 20 10 CFCDHN Cc1ccc(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877603905 643392544 /nfs/dbraw/zinc/39/25/44/643392544.db2.gz FMSUELPPGFGZGP-LJQANCHMSA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1ccc(C[N@H+](C)C[C@]2(O)CCc3ccccc32)c([O-])c1 ZINC000877603905 643392547 /nfs/dbraw/zinc/39/25/47/643392547.db2.gz FMSUELPPGFGZGP-LJQANCHMSA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1ccc(C[NH+]2CCC([C@H](C)CO)CC2)c([O-])c1 ZINC000877613093 643399797 /nfs/dbraw/zinc/39/97/97/643399797.db2.gz WNRRIFJIRVNUCR-CYBMUJFWSA-N 0 3 263.381 2.541 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877639408 643424369 /nfs/dbraw/zinc/42/43/69/643424369.db2.gz IVPFHEGEJOJEBD-WBVHZDCISA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)CCC(C)C)c([O-])c1 ZINC000877653525 643433111 /nfs/dbraw/zinc/43/31/11/643433111.db2.gz MBMXLLJZRXPTDV-AWEZNQCLSA-N 0 3 251.370 2.587 20 10 CFCDHN CO[C@@H](C[N@@H+]1Cc2cccc([O-])c2C1)C1CCCC1 ZINC000877703198 643469239 /nfs/dbraw/zinc/46/92/39/643469239.db2.gz VVPKHKBFNRGQHH-INIZCTEOSA-N 0 3 261.365 2.913 20 10 CFCDHN CO[C@@H](C[N@H+]1Cc2cccc([O-])c2C1)C1CCCC1 ZINC000877703198 643469245 /nfs/dbraw/zinc/46/92/45/643469245.db2.gz VVPKHKBFNRGQHH-INIZCTEOSA-N 0 3 261.365 2.913 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc(Cl)c1F)[C@@H]1CN2CCC1CC2 ZINC000877707198 643474605 /nfs/dbraw/zinc/47/46/05/643474605.db2.gz ZPTDPKCGJDQQOI-CYBMUJFWSA-N 0 3 298.789 2.711 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc(Cl)c1F)[C@@H]1CN2CCC1CC2 ZINC000877707198 643474610 /nfs/dbraw/zinc/47/46/10/643474610.db2.gz ZPTDPKCGJDQQOI-CYBMUJFWSA-N 0 3 298.789 2.711 20 10 CFCDHN C[N@@H+]1CC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000877743371 643517774 /nfs/dbraw/zinc/51/77/74/643517774.db2.gz KERHMRBQMCYBLA-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CN(Cc3c([O-])cccc3Cl)CC[C@@H]21 ZINC000877743371 643517780 /nfs/dbraw/zinc/51/77/80/643517780.db2.gz KERHMRBQMCYBLA-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[C@@H]([NH2+]Cc1cnc2c(cnn2C)c1)c1ccccc1[O-] ZINC000877755873 643535007 /nfs/dbraw/zinc/53/50/07/643535007.db2.gz PUAAFYNHICDAGZ-LLVKDONJSA-N 0 3 282.347 2.525 20 10 CFCDHN C[C@@H](NCc1c(C(F)(F)F)cnn1C)c1ccccc1O ZINC000877755566 643535059 /nfs/dbraw/zinc/53/50/59/643535059.db2.gz FQIGWUNBLAVWME-SECBINFHSA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1ccccc1[O-] ZINC000877755566 643535064 /nfs/dbraw/zinc/53/50/64/643535064.db2.gz FQIGWUNBLAVWME-SECBINFHSA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@@H](O)c1ncc(CN[C@H](C)c2ccccc2O)s1 ZINC000877755638 643535614 /nfs/dbraw/zinc/53/56/14/643535614.db2.gz JBXOEFZTYKZCES-NXEZZACHSA-N 0 3 278.377 2.753 20 10 CFCDHN C[C@@H](O)c1ncc(C[NH2+][C@H](C)c2ccccc2[O-])s1 ZINC000877755638 643535616 /nfs/dbraw/zinc/53/56/16/643535616.db2.gz JBXOEFZTYKZCES-NXEZZACHSA-N 0 3 278.377 2.753 20 10 CFCDHN Cc1nn(C)c2ncc(C[NH2+][C@@H](C)c3ccccc3[O-])cc12 ZINC000877757035 643536732 /nfs/dbraw/zinc/53/67/32/643536732.db2.gz BHWRYMRJMAWMOH-NSHDSACASA-N 0 3 296.374 2.833 20 10 CFCDHN C[C@H](NCc1c(C(F)(F)F)cnn1C)c1ccccc1O ZINC000877758033 643538813 /nfs/dbraw/zinc/53/88/13/643538813.db2.gz FQIGWUNBLAVWME-VIFPVBQESA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1ccccc1[O-] ZINC000877758033 643538822 /nfs/dbraw/zinc/53/88/22/643538822.db2.gz FQIGWUNBLAVWME-VIFPVBQESA-N 0 3 299.296 2.995 20 10 CFCDHN CCOC(=O)[C@H](C)C1CN(Cc2cccc(CC)c2O)C1 ZINC000877830584 643596239 /nfs/dbraw/zinc/59/62/39/643596239.db2.gz OAPDBOQNHNIHHH-GFCCVEGCSA-N 0 3 291.391 2.586 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCC2(CCC2)O1 ZINC000878241521 643805218 /nfs/dbraw/zinc/80/52/18/643805218.db2.gz HDCNCKQVAKGQKZ-CQSZACIVSA-N 0 3 261.365 2.926 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1CCC2(CCC2)O1 ZINC000878241521 643805220 /nfs/dbraw/zinc/80/52/20/643805220.db2.gz HDCNCKQVAKGQKZ-CQSZACIVSA-N 0 3 261.365 2.926 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1[C@H](C)CCC[C@@H]1C)c1ccccc1[O-] ZINC000879647354 644361471 /nfs/dbraw/zinc/36/14/71/644361471.db2.gz BIHOXIXJKFIEED-HZSPNIEDSA-N 0 3 290.407 2.832 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1[C@H](C)CCC[C@H]1C)c1ccccc1[O-] ZINC000879647358 644361986 /nfs/dbraw/zinc/36/19/86/644361986.db2.gz BIHOXIXJKFIEED-MGPQQGTHSA-N 0 3 290.407 2.832 20 10 CFCDHN CC(C)CC[C@@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648931 644362728 /nfs/dbraw/zinc/36/27/28/644362728.db2.gz GOVCINZVSKVSAZ-CHWSQXEVSA-N 0 3 251.370 2.840 20 10 CFCDHN CC(C)CCNC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649072 644363558 /nfs/dbraw/zinc/36/35/58/644363558.db2.gz LGJAUSWBYPRWJW-CHWSQXEVSA-N 0 3 278.396 2.594 20 10 CFCDHN C[C@@H](NCc1cc(CO)ccc1F)c1ccccc1O ZINC000879650160 644363891 /nfs/dbraw/zinc/36/38/91/644363891.db2.gz MMFSCINULJUZAP-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(CO)ccc1F)c1ccccc1[O-] ZINC000879650160 644363894 /nfs/dbraw/zinc/36/38/94/644363894.db2.gz MMFSCINULJUZAP-LLVKDONJSA-N 0 3 275.323 2.874 20 10 CFCDHN Cc1cccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000879651219 644364271 /nfs/dbraw/zinc/36/42/71/644364271.db2.gz NJTKKHHDLHGBSP-AWEZNQCLSA-N 0 3 298.386 2.668 20 10 CFCDHN CC(C)CC[C@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879650538 644364755 /nfs/dbraw/zinc/36/47/55/644364755.db2.gz GOVCINZVSKVSAZ-STQMWFEESA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)NC1CCCCC1 ZINC000879651694 644365224 /nfs/dbraw/zinc/36/52/24/644365224.db2.gz HQHMKMDMMNYSHZ-QWHCGFSZSA-N 0 3 290.407 2.880 20 10 CFCDHN CCCN(CCC)C(=O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879652035 644366461 /nfs/dbraw/zinc/36/64/61/644366461.db2.gz AAAZOSVENCFXEM-ZDUSSCGKSA-N 0 3 278.396 2.691 20 10 CFCDHN Cc1cc(Cn2cc([C@@H](C)N)nn2)ccc1N1CCCCC1 ZINC000881379300 644964311 /nfs/dbraw/zinc/96/43/11/644964311.db2.gz NXUBHLKOZWRFEW-CQSZACIVSA-N 0 3 299.422 2.645 20 10 CFCDHN COc1ccccc1OCC[NH2+]Cc1ccccc1[O-] ZINC000134225422 646308227 /nfs/dbraw/zinc/30/82/27/646308227.db2.gz JFDUKJCLDFLMKQ-UHFFFAOYSA-N 0 3 273.332 2.569 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1CCC2(CCC2)CO1 ZINC000886318626 646967832 /nfs/dbraw/zinc/96/78/32/646967832.db2.gz XXQWNBDYCRCIRK-ZDUSSCGKSA-N 0 3 291.391 2.840 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886507330 647023023 /nfs/dbraw/zinc/02/30/23/647023023.db2.gz FNNXPDNEQTXKAC-NSHDSACASA-N 0 3 277.343 2.777 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2CCc3cccnc32)c1 ZINC000886547781 647042923 /nfs/dbraw/zinc/04/29/23/647042923.db2.gz RHPFQZDEEDUXDT-AWEZNQCLSA-N 0 3 270.332 2.573 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1F)c1ccccc1[O-] ZINC000886673100 647103279 /nfs/dbraw/zinc/10/32/79/647103279.db2.gz ZZWZYCSNDIUJBC-OCCSQVGLSA-N 0 3 289.350 2.786 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cnn(CCF)c1)c1ccccc1[O-] ZINC000930223880 649209065 /nfs/dbraw/zinc/20/90/65/649209065.db2.gz YBUNNLWMNLPXJH-CQSZACIVSA-N 0 3 277.343 2.799 20 10 CFCDHN C[C@H](C[C@@H](O)c1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000305759930 651075231 /nfs/dbraw/zinc/07/52/31/651075231.db2.gz YBKLECAPRWOMJJ-BXUZGUMPSA-N 0 3 261.321 2.587 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000721417635 770137007 /nfs/dbraw/zinc/13/70/07/770137007.db2.gz RHSLNQBYXLPMNM-CMPLNLGQSA-N 0 3 275.270 2.592 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[C@@H](C2)[NH2+]3)cc1Cl ZINC001235418165 778484580 /nfs/dbraw/zinc/48/45/80/778484580.db2.gz RPBMLBFCQSJCOK-TXEJJXNPSA-N 0 3 294.826 2.889 20 10 CFCDHN CC[N@@H+](Cc1ccccc1[O-])CC1COC(C)(C)OC1 ZINC001209199432 770010982 /nfs/dbraw/zinc/01/09/82/770010982.db2.gz ZSNVUZSGANNGFK-UHFFFAOYSA-N 0 3 279.380 2.613 20 10 CFCDHN CC[N@H+](Cc1ccccc1[O-])CC1COC(C)(C)OC1 ZINC001209199432 770010995 /nfs/dbraw/zinc/01/09/95/770010995.db2.gz ZSNVUZSGANNGFK-UHFFFAOYSA-N 0 3 279.380 2.613 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000721417639 770136139 /nfs/dbraw/zinc/13/61/39/770136139.db2.gz RHSLNQBYXLPMNM-PWSUYJOCSA-N 0 3 275.270 2.592 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C[C@]13C[C@H]1CCCC3)OCO2 ZINC000693521779 770769538 /nfs/dbraw/zinc/76/95/38/770769538.db2.gz KNTGOLBGRQOROK-WBMJQRKESA-N 0 3 275.348 2.791 20 10 CFCDHN CCc1cccc(C[NH2+][C@@H](CCO)C2CCCC2)c1[O-] ZINC000725065415 775260995 /nfs/dbraw/zinc/26/09/95/775260995.db2.gz NZAJTPMBSDFZLM-INIZCTEOSA-N 0 3 277.408 2.985 20 10 CFCDHN C[C@@H]1CCN(Cc2ccc(N(C)C)cc2Cl)CC[C@@H]1O ZINC001140921484 775650673 /nfs/dbraw/zinc/65/06/73/775650673.db2.gz FIYCRXPSCWPNJA-WBMJQRKESA-N 0 3 296.842 2.999 20 10 CFCDHN Cc1ccc(CN2CCc3ncc(C)cc3C2)c(O)c1 ZINC001140954704 775705661 /nfs/dbraw/zinc/70/56/61/775705661.db2.gz WVZTXVQVDBFVQO-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CO)CC2)c1[O-] ZINC000293898487 775730728 /nfs/dbraw/zinc/73/07/28/775730728.db2.gz FGBJPLCSDGHVML-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](CO)CC2)c1[O-] ZINC000293898487 775730732 /nfs/dbraw/zinc/73/07/32/775730732.db2.gz FGBJPLCSDGHVML-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cc(C)ccn2)c1 ZINC000328201449 775732605 /nfs/dbraw/zinc/73/26/05/775732605.db2.gz SXAWGHCBIWXXLM-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@H]2OCC[C@H]21 ZINC001231586149 777268278 /nfs/dbraw/zinc/26/82/78/777268278.db2.gz BLLIQZHCGZEPNP-NVXWUHKLSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@H]2OCC[C@H]21 ZINC001231586149 777268285 /nfs/dbraw/zinc/26/82/85/777268285.db2.gz BLLIQZHCGZEPNP-NVXWUHKLSA-N 0 3 269.344 2.909 20 10 CFCDHN CCN(Cc1ccncc1)Cc1cc(OC)c(O)cc1O ZINC001231635057 777287187 /nfs/dbraw/zinc/28/71/87/777287187.db2.gz UWKXJSHTIHNQQH-UHFFFAOYSA-N 0 3 288.347 2.524 20 10 CFCDHN Cc1cc(C)c(CN2CCN3CC(F)(F)C[C@H]3C2)c(O)c1 ZINC001231847973 777348146 /nfs/dbraw/zinc/34/81/46/777348146.db2.gz GLWJSKAIMDFWJM-ZDUSSCGKSA-N 0 3 296.361 2.534 20 10 CFCDHN CC[C@@]12C[C@@H](CO1)N(Cc1c(C)cc(C)cc1O)C2 ZINC001231847949 777349245 /nfs/dbraw/zinc/34/92/45/777349245.db2.gz GDMJPDOEHQJEMF-BBRMVZONSA-N 0 3 261.365 2.762 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC(F)CC1 ZINC001231848634 777350269 /nfs/dbraw/zinc/35/02/69/777350269.db2.gz JCFVGALDHHZPJD-UHFFFAOYSA-N 0 3 266.360 2.695 20 10 CFCDHN CCO[C@H]1CCCN(Cc2ccc(N(C)C)cc2OC)C1 ZINC001231852871 777352118 /nfs/dbraw/zinc/35/21/18/777352118.db2.gz BXYDQFYZWGRUIF-INIZCTEOSA-N 0 3 292.423 2.762 20 10 CFCDHN COc1cc(N(C)C)ccc1CN(C)CCSC ZINC001231858058 777354220 /nfs/dbraw/zinc/35/42/20/777354220.db2.gz QSXBCWRLGUSNDK-UHFFFAOYSA-N 0 3 268.426 2.556 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1ccc3c[nH]nc3c1)CC2 ZINC001231908281 777378745 /nfs/dbraw/zinc/37/87/45/777378745.db2.gz MGJYFKLSBFZJAW-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1ccc3c[nH]nc3c1)CC2 ZINC001231908281 777378752 /nfs/dbraw/zinc/37/87/52/777378752.db2.gz MGJYFKLSBFZJAW-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN CC[NH+](CC)[C@@H]1CCN(Cc2cc(Cl)c([O-])cc2O)C1 ZINC001232262174 777496485 /nfs/dbraw/zinc/49/64/85/777496485.db2.gz BLQWHVNQIMBGQF-GFCCVEGCSA-N 0 3 298.814 2.667 20 10 CFCDHN COc1cc([O-])c(CN(C)CC[NH+]2CCCC2)cc1Cl ZINC001232270094 777500907 /nfs/dbraw/zinc/50/09/07/777500907.db2.gz SXGJVPGAJBLHJJ-UHFFFAOYSA-N 0 3 298.814 2.582 20 10 CFCDHN Oc1cc(CN2CCCC3(CCCC3)C2)cc(O)c1O ZINC001233012475 777763459 /nfs/dbraw/zinc/76/34/59/777763459.db2.gz HOQQPHGMBJWKFI-UHFFFAOYSA-N 0 3 277.364 2.960 20 10 CFCDHN Cc1cc(CN2CCc3cccc(O)c3C2)cnc1C ZINC001233161267 777811058 /nfs/dbraw/zinc/81/10/58/777811058.db2.gz ZHWDMESOGYJBHJ-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001233287899 777868691 /nfs/dbraw/zinc/86/86/91/777868691.db2.gz MFGYTKNWJGBSIR-BONVTDFDSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001233287899 777868701 /nfs/dbraw/zinc/86/87/01/777868701.db2.gz MFGYTKNWJGBSIR-BONVTDFDSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@](C)(O)[C@@H](C)C2)c1O ZINC001233287899 777868712 /nfs/dbraw/zinc/86/87/12/777868712.db2.gz MFGYTKNWJGBSIR-BONVTDFDSA-N 0 3 299.798 2.647 20 10 CFCDHN CN1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001233451559 777956868 /nfs/dbraw/zinc/95/68/68/777956868.db2.gz PITHXPTUBQCHQQ-UHFFFAOYSA-N 0 3 288.313 2.549 20 10 CFCDHN CN1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001233451559 777956870 /nfs/dbraw/zinc/95/68/70/777956870.db2.gz PITHXPTUBQCHQQ-UHFFFAOYSA-N 0 3 288.313 2.549 20 10 CFCDHN CCN(Cc1cccc(F)c1)Cc1cc(O)c(O)cc1O ZINC001233486283 777964133 /nfs/dbraw/zinc/96/41/33/777964133.db2.gz GRCQRYKVFDJWKH-UHFFFAOYSA-N 0 3 291.322 2.965 20 10 CFCDHN CCN1CCN(c2ccc(OCC[C@H](C)OC)cc2)CC1 ZINC001234658302 778279584 /nfs/dbraw/zinc/27/95/84/778279584.db2.gz ZPFXTYHPDWLWPA-HNNXBMFYSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1c(CN2CC[C@@H]3[NH2+]CC[C@H]32)cccc1-c1ccccc1 ZINC001235048876 778367760 /nfs/dbraw/zinc/36/77/60/778367760.db2.gz LHIXXFUUJTWGNK-ZWKOTPCHSA-N 0 3 294.398 2.995 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3C[C@]3([NH3+])C2)cc1Cl ZINC001235150922 778397862 /nfs/dbraw/zinc/39/78/62/778397862.db2.gz BHJVBJTWNDIJRJ-ZBEGNZNMSA-N 0 3 294.826 2.876 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3[C@H]([NH3+])[C@@H]3C2)cc1Cl ZINC001235284088 778442413 /nfs/dbraw/zinc/44/24/13/778442413.db2.gz JOWPRGGZRBEOTO-QHBPRCKVSA-N 0 3 294.826 2.732 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@H]1O ZINC001235674635 778532393 /nfs/dbraw/zinc/53/23/93/778532393.db2.gz HIHGLRYBXHJLGP-SWLSCSKDSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])CC[C@H]1O ZINC001235674635 778532395 /nfs/dbraw/zinc/53/23/95/778532395.db2.gz HIHGLRYBXHJLGP-SWLSCSKDSA-N 0 3 277.408 2.892 20 10 CFCDHN CC(C)(C)c1ccc(CN2CC3(COC3)C2)c(O)c1 ZINC001235676778 778533045 /nfs/dbraw/zinc/53/30/45/778533045.db2.gz UTHUPAKJINTOOS-UHFFFAOYSA-N 0 3 261.365 2.522 20 10 CFCDHN COC(CN(C)Cc1ccc(C(C)(C)C)cc1O)OC ZINC001235677185 778534245 /nfs/dbraw/zinc/53/42/45/778534245.db2.gz CIVQDAPZMAUNRZ-UHFFFAOYSA-N 0 3 281.396 2.740 20 10 CFCDHN CC(C)(C)c1ccc(CN2CCC3(C2)OCCO3)c(O)c1 ZINC001235685654 778537431 /nfs/dbraw/zinc/53/74/31/778537431.db2.gz URAXTIZTSXPGOV-UHFFFAOYSA-N 0 3 291.391 2.639 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CCN[C@@H](c2ccccc2)C1 ZINC001235859714 778582929 /nfs/dbraw/zinc/58/29/29/778582929.db2.gz NXBNVIFXYUXMHW-MRXNPFEDSA-N 0 3 286.350 2.678 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CCN[C@@H](c2ccccc2)C1 ZINC001235859714 778582931 /nfs/dbraw/zinc/58/29/31/778582931.db2.gz NXBNVIFXYUXMHW-MRXNPFEDSA-N 0 3 286.350 2.678 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@@H]2CCCC[C@@H]2[NH3+])c(Cl)c1 ZINC001236214611 778739502 /nfs/dbraw/zinc/73/95/02/778739502.db2.gz GNYNKRDHEZWMRU-UONOGXRCSA-N 0 3 298.814 2.756 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CCC[C@H]([NH2+]C2CC2)C1 ZINC001236216158 778740209 /nfs/dbraw/zinc/74/02/09/778740209.db2.gz LCNUEPFKBQLWSR-AWEZNQCLSA-N 0 3 280.799 2.762 20 10 CFCDHN CN(Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219797 778744069 /nfs/dbraw/zinc/74/40/69/778744069.db2.gz XOMCMYBCYCWHJB-CHWSQXEVSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@H]1N ZINC001236219797 778744072 /nfs/dbraw/zinc/74/40/72/778744072.db2.gz XOMCMYBCYCWHJB-CHWSQXEVSA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@@H]1CCCC[C@H]1N ZINC001236219797 778744074 /nfs/dbraw/zinc/74/40/74/778744074.db2.gz XOMCMYBCYCWHJB-CHWSQXEVSA-N 0 3 286.778 2.886 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3C[NH2+]C[C@@H]32)cc1Cl ZINC001236285656 778760642 /nfs/dbraw/zinc/76/06/42/778760642.db2.gz BDMLGWKTHZQWMQ-FZMZJTMJSA-N 0 3 294.826 2.747 20 10 CFCDHN CCOc1ccc(CN(C)Cc2ccccc2O)cn1 ZINC001231658420 778866963 /nfs/dbraw/zinc/86/69/63/778866963.db2.gz WKDYIQFJUABRTJ-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN CC[NH+](CC)Cc1cc(O)c(Br)cc1[O-] ZINC001236773899 778931974 /nfs/dbraw/zinc/93/19/74/778931974.db2.gz VTJLJHXUNYZMEX-UHFFFAOYSA-N 0 3 274.158 2.702 20 10 CFCDHN CC[N@H+](Cc1cc(O)c(Br)cc1[O-])C1CC1 ZINC001236773142 778932649 /nfs/dbraw/zinc/93/26/49/778932649.db2.gz OKGOGIVITAUCIQ-UHFFFAOYSA-N 0 3 286.169 2.845 20 10 CFCDHN CC[N@@H+](Cc1cc(O)c(Br)cc1[O-])C1CC1 ZINC001236773142 778932654 /nfs/dbraw/zinc/93/26/54/778932654.db2.gz OKGOGIVITAUCIQ-UHFFFAOYSA-N 0 3 286.169 2.845 20 10 CFCDHN CCc1ccc(CN(C)Cc2ccccn2)c(O)c1 ZINC001236783603 778935987 /nfs/dbraw/zinc/93/59/87/778935987.db2.gz MWIKVPHMRKDBSQ-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C(=O)OC)[C@H]2C)c([O-])c1 ZINC001236787698 778936794 /nfs/dbraw/zinc/93/67/94/778936794.db2.gz JYTIBKYEILUETG-IUODEOHRSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C(=O)OC)[C@H]2C)c([O-])c1 ZINC001236787698 778936799 /nfs/dbraw/zinc/93/67/99/778936799.db2.gz JYTIBKYEILUETG-IUODEOHRSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@@H+]2C[C@@H]3COC[C@H](C2)C3(F)F)c([O-])c1 ZINC001236793555 778939246 /nfs/dbraw/zinc/93/92/46/778939246.db2.gz YUFYTRDLPYIEFL-OKILXGFUSA-N 0 3 297.345 2.668 20 10 CFCDHN CCc1ccc(C[N@H+]2C[C@@H]3COC[C@H](C2)C3(F)F)c([O-])c1 ZINC001236793555 778939250 /nfs/dbraw/zinc/93/92/50/778939250.db2.gz YUFYTRDLPYIEFL-OKILXGFUSA-N 0 3 297.345 2.668 20 10 CFCDHN CCc1ccc(C[N@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC001236795668 778940389 /nfs/dbraw/zinc/94/03/89/778940389.db2.gz YNEIUARKJYMYOF-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+](C)C[C@H]2CCCCO2)c([O-])c1 ZINC001236795668 778940393 /nfs/dbraw/zinc/94/03/93/778940393.db2.gz YNEIUARKJYMYOF-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@](C)(CF)C2)c([O-])c1 ZINC001236807670 778947459 /nfs/dbraw/zinc/94/74/59/778947459.db2.gz IPQXTZUQDDZHFT-OAHLLOKOSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@](C)(CF)C2)c([O-])c1 ZINC001236807670 778947466 /nfs/dbraw/zinc/94/74/66/778947466.db2.gz IPQXTZUQDDZHFT-OAHLLOKOSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1ccc(C[N@@H+]2CCC[C@H]2CN(C)C)c([O-])c1Cl ZINC001236811069 778948645 /nfs/dbraw/zinc/94/86/45/778948645.db2.gz GGWBMAXQZUGYDF-LBPRGKRZSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1ccc(C[N@H+]2CCC[C@H]2CN(C)C)c([O-])c1Cl ZINC001236811069 778948647 /nfs/dbraw/zinc/94/86/47/778948647.db2.gz GGWBMAXQZUGYDF-LBPRGKRZSA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC001236813357 778950348 /nfs/dbraw/zinc/95/03/48/778950348.db2.gz IZXQGDALJWYCPT-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC001236813357 778950351 /nfs/dbraw/zinc/95/03/51/778950351.db2.gz IZXQGDALJWYCPT-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN CCO[C@@H]1CCC[N@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814191 778951048 /nfs/dbraw/zinc/95/10/48/778951048.db2.gz QHTSJSPLTLHMDP-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN CCO[C@@H]1CCC[N@@H+](Cc2c(C)cc(OC)cc2[O-])C1 ZINC001236814191 778951054 /nfs/dbraw/zinc/95/10/54/778951054.db2.gz QHTSJSPLTLHMDP-CYBMUJFWSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC001236813502 778951073 /nfs/dbraw/zinc/95/10/73/778951073.db2.gz LAJVYHAMTHJNLB-LBPRGKRZSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@@H](CF)C2)c([O-])c1 ZINC001236813502 778951078 /nfs/dbraw/zinc/95/10/78/778951078.db2.gz LAJVYHAMTHJNLB-LBPRGKRZSA-N 0 3 267.344 2.891 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236819706 778953774 /nfs/dbraw/zinc/95/37/74/778953774.db2.gz ZMQUBMMZKZSZLN-DYVFJYSZSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236819706 778953777 /nfs/dbraw/zinc/95/37/77/778953777.db2.gz ZMQUBMMZKZSZLN-DYVFJYSZSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236819710 778953921 /nfs/dbraw/zinc/95/39/21/778953921.db2.gz ZMQUBMMZKZSZLN-SUMWQHHRSA-N 0 3 291.391 2.710 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c([O-])c1 ZINC001236819710 778953925 /nfs/dbraw/zinc/95/39/25/778953925.db2.gz ZMQUBMMZKZSZLN-SUMWQHHRSA-N 0 3 291.391 2.710 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@H]2OCC[C@H]21 ZINC001236826788 778954837 /nfs/dbraw/zinc/95/48/37/778954837.db2.gz MYONZBUEFSOHGR-NVXWUHKLSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@H]2OCC[C@H]21 ZINC001236826788 778954843 /nfs/dbraw/zinc/95/48/43/778954843.db2.gz MYONZBUEFSOHGR-NVXWUHKLSA-N 0 3 269.344 2.909 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCO[C@]2(CCOC2)C1 ZINC001236826749 778955433 /nfs/dbraw/zinc/95/54/33/778955433.db2.gz MESPWILVJSHSFM-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCO[C@]2(CCOC2)C1 ZINC001236826749 778955437 /nfs/dbraw/zinc/95/54/37/778955437.db2.gz MESPWILVJSHSFM-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN Oc1cc2ccccc2cc1CN1CCO[C@]2(CCOC2)C1 ZINC001236826749 778955442 /nfs/dbraw/zinc/95/54/42/778955442.db2.gz MESPWILVJSHSFM-GOSISDBHSA-N 0 3 299.370 2.537 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C[C@@H]1O ZINC001236827925 778956373 /nfs/dbraw/zinc/95/63/73/778956373.db2.gz WVOVZQADPFHFDL-PXAZEXFGSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C[C@@H]1O ZINC001236827925 778956377 /nfs/dbraw/zinc/95/63/77/778956377.db2.gz WVOVZQADPFHFDL-PXAZEXFGSA-N 0 3 271.360 2.748 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827442 778956748 /nfs/dbraw/zinc/95/67/48/778956748.db2.gz RZUJHWYIGZGJLE-AWEZNQCLSA-N 0 3 285.343 2.540 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236827442 778956749 /nfs/dbraw/zinc/95/67/49/778956749.db2.gz RZUJHWYIGZGJLE-AWEZNQCLSA-N 0 3 285.343 2.540 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236835087 778959375 /nfs/dbraw/zinc/95/93/75/778959375.db2.gz HWILNECDLSXMRY-GOSISDBHSA-N 0 3 299.370 2.930 20 10 CFCDHN COC(=O)[C@]1(C)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236835087 778959379 /nfs/dbraw/zinc/95/93/79/778959379.db2.gz HWILNECDLSXMRY-GOSISDBHSA-N 0 3 299.370 2.930 20 10 CFCDHN CN(C)C(=O)[C@@H]1CCC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236834046 778959788 /nfs/dbraw/zinc/95/97/88/778959788.db2.gz SNYIYYSLFSKYJA-INIZCTEOSA-N 0 3 298.386 2.598 20 10 CFCDHN CN(C)C(=O)[C@@H]1CCC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236834046 778959796 /nfs/dbraw/zinc/95/97/96/778959796.db2.gz SNYIYYSLFSKYJA-INIZCTEOSA-N 0 3 298.386 2.598 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001237043644 778995996 /nfs/dbraw/zinc/99/59/96/778995996.db2.gz BXDMJIFTEZCJMW-HNNXBMFYSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001237043644 778995998 /nfs/dbraw/zinc/99/59/98/778995998.db2.gz BXDMJIFTEZCJMW-HNNXBMFYSA-N 0 3 279.380 2.790 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c([O-])c1 ZINC001237045433 778997020 /nfs/dbraw/zinc/99/70/20/778997020.db2.gz KPNUEHCLSVTOLY-DOMZBBRYSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@@H](O)CC[C@H]2C)c([O-])c1 ZINC001237045433 778997023 /nfs/dbraw/zinc/99/70/23/778997023.db2.gz KPNUEHCLSVTOLY-DOMZBBRYSA-N 0 3 263.381 2.861 20 10 CFCDHN CC(C)c1ccc(CN2CCCC3(C2)OCCO3)c(O)c1 ZINC001237048412 778999008 /nfs/dbraw/zinc/99/90/08/778999008.db2.gz FRYHYWGILRNHBK-UHFFFAOYSA-N 0 3 291.391 2.855 20 10 CFCDHN [O-]c1cc(OCC(F)(F)F)ccc1C[NH+]1CCC1 ZINC001237051026 779000010 /nfs/dbraw/zinc/00/00/10/779000010.db2.gz GVDCAELZCUFCKW-UHFFFAOYSA-N 0 3 261.243 2.539 20 10 CFCDHN CC(C)c1ccc(CN2C[C@@H]3OCC(F)(F)[C@@H]3C2)c(O)c1 ZINC001237051501 779000442 /nfs/dbraw/zinc/00/04/42/779000442.db2.gz MDCVMEYMAKORDQ-HIFRSBDPSA-N 0 3 297.345 2.982 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@@](C)(O)C2)c([O-])c1 ZINC001237049458 779000460 /nfs/dbraw/zinc/00/04/60/779000460.db2.gz GABNGOQUTKNNLW-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@@](C)(O)C2)c([O-])c1 ZINC001237049458 779000463 /nfs/dbraw/zinc/00/04/63/779000463.db2.gz GABNGOQUTKNNLW-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN OC[C@H]1CCCCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237137147 779023765 /nfs/dbraw/zinc/02/37/65/779023765.db2.gz MUZGECFKAXALDK-GFCCVEGCSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@@H]1CO ZINC001237137147 779023769 /nfs/dbraw/zinc/02/37/69/779023769.db2.gz MUZGECFKAXALDK-GFCCVEGCSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@@H]1CO ZINC001237137147 779023773 /nfs/dbraw/zinc/02/37/73/779023773.db2.gz MUZGECFKAXALDK-GFCCVEGCSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@H]1CC[C@@H](CN)[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001205075779 779028712 /nfs/dbraw/zinc/02/87/12/779028712.db2.gz MUPLLEBFHLWGBI-JSGCOSHPSA-N 0 3 270.376 2.857 20 10 CFCDHN C[C@H]1CC[C@@H](CN)[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001205075779 779028718 /nfs/dbraw/zinc/02/87/18/779028718.db2.gz MUPLLEBFHLWGBI-JSGCOSHPSA-N 0 3 270.376 2.857 20 10 CFCDHN CN1CCCc2cc(CN3CCNC4=CCCC[C@H]43)ccc21 ZINC001237220948 779051538 /nfs/dbraw/zinc/05/15/38/779051538.db2.gz UFLLKUALRQMTCR-LJQANCHMSA-N 0 3 297.446 2.911 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cccc(OC(F)(F)F)c2[O-])C1 ZINC001233727500 779076036 /nfs/dbraw/zinc/07/60/36/779076036.db2.gz NHFWLCPAOFBUOA-SNVBAGLBSA-N 0 3 291.269 2.512 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cccc(OC(F)(F)F)c2[O-])C1 ZINC001233727500 779076040 /nfs/dbraw/zinc/07/60/40/779076040.db2.gz NHFWLCPAOFBUOA-SNVBAGLBSA-N 0 3 291.269 2.512 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](C)[C@](C)(O)CC1 ZINC001237485815 779118131 /nfs/dbraw/zinc/11/81/31/779118131.db2.gz UGFYMIUOSRAYDW-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](C)[C@](C)(O)CC1 ZINC001237485815 779118134 /nfs/dbraw/zinc/11/81/34/779118134.db2.gz UGFYMIUOSRAYDW-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN CCOC(=O)[C@H]1CCCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237492442 779120633 /nfs/dbraw/zinc/12/06/33/779120633.db2.gz PZPJOOXKSQOEAY-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)[C@H]1CCCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237492442 779120635 /nfs/dbraw/zinc/12/06/35/779120635.db2.gz PZPJOOXKSQOEAY-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN COc1cc(CN(C)C2CC(F)(F)C2)c(O)c(OC)c1 ZINC001237674441 779159047 /nfs/dbraw/zinc/15/90/47/779159047.db2.gz HRBMKZJXCJVDNE-UHFFFAOYSA-N 0 3 287.306 2.639 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H]2CO)c1[O-] ZINC001237680665 779159557 /nfs/dbraw/zinc/15/95/57/779159557.db2.gz GNAJVNJGPKWFMF-ZANVPECISA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)C[C@H]2CO)c1[O-] ZINC001237680665 779159561 /nfs/dbraw/zinc/15/95/61/779159561.db2.gz GNAJVNJGPKWFMF-ZANVPECISA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](O)[C@@H](C)C2)c1[O-] ZINC001237681007 779159844 /nfs/dbraw/zinc/15/98/44/779159844.db2.gz KBCBRZIGVUDLGJ-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](O)[C@@H](C)C2)c1[O-] ZINC001237681007 779159848 /nfs/dbraw/zinc/15/98/48/779159848.db2.gz KBCBRZIGVUDLGJ-FZMZJTMJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CO)CC2)c1[O-] ZINC001237680871 779159862 /nfs/dbraw/zinc/15/98/62/779159862.db2.gz JEGSNPKLVSWHHB-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CO)CC2)c1[O-] ZINC001237680871 779159866 /nfs/dbraw/zinc/15/98/66/779159866.db2.gz JEGSNPKLVSWHHB-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)[C@@H](C)CC2)c1[O-] ZINC001237682068 779161540 /nfs/dbraw/zinc/16/15/40/779161540.db2.gz WMCDBLSIYCAKSE-IINYFYTJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)[C@@H](C)CC2)c1[O-] ZINC001237682068 779161542 /nfs/dbraw/zinc/16/15/42/779161542.db2.gz WMCDBLSIYCAKSE-IINYFYTJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c1[O-] ZINC001238063850 779242206 /nfs/dbraw/zinc/24/22/06/779242206.db2.gz MGGBGMIUNLIBEW-MRXNPFEDSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c1[O-] ZINC001238063850 779242208 /nfs/dbraw/zinc/24/22/08/779242208.db2.gz MGGBGMIUNLIBEW-MRXNPFEDSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(C[C@H]3CCO)CC2)c1[O-] ZINC001238063714 779242349 /nfs/dbraw/zinc/24/23/49/779242349.db2.gz LTHJYDAJPBFBEP-CQSZACIVSA-N 0 3 293.382 2.824 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001238059438 779242582 /nfs/dbraw/zinc/24/25/82/779242582.db2.gz CUCNUNKKMZOPIR-LRDDRELGSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(O)[C@@H](C)C2)c1[O-] ZINC001238059438 779242586 /nfs/dbraw/zinc/24/25/86/779242586.db2.gz CUCNUNKKMZOPIR-LRDDRELGSA-N 0 3 281.371 2.823 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)CCc2cccnc2)c1[O-] ZINC001238063526 779242981 /nfs/dbraw/zinc/24/29/81/779242981.db2.gz XXDJYAPWQIJAPP-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)CCc2cccnc2)c1[O-] ZINC001238063526 779242983 /nfs/dbraw/zinc/24/29/83/779242983.db2.gz XXDJYAPWQIJAPP-UHFFFAOYSA-N 0 3 274.339 2.909 20 10 CFCDHN COc1cc(C)c(CN2C[C@H](F)C[C@H]2C)c(O)c1 ZINC001236809663 779642058 /nfs/dbraw/zinc/64/20/58/779642058.db2.gz ZOJVWKWPIQTNNH-GHMZBOCLSA-N 0 3 253.317 2.642 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cncc(F)c2)c1 ZINC000700798215 780719735 /nfs/dbraw/zinc/71/97/35/780719735.db2.gz VJERLALRZVJKQM-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)cc1[O-] ZINC000700816764 780727347 /nfs/dbraw/zinc/72/73/47/780727347.db2.gz NNTSNZOCIVPHGL-STQMWFEESA-N 0 3 280.387 2.914 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(F)ccc1[O-] ZINC000703109212 780986608 /nfs/dbraw/zinc/98/66/08/780986608.db2.gz ZCTZSTRGBXCYJT-MNOVXSKESA-N 0 3 267.344 2.997 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC[C@H]1CCSC1 ZINC000704918736 781129370 /nfs/dbraw/zinc/12/93/70/781129370.db2.gz NHUKDMUHUKTNJC-JTQLQIEISA-N 0 3 255.358 2.764 20 10 CFCDHN CCc1cccc(CN2CCOC[C@@]2(C)CC)c1O ZINC000707696057 781260917 /nfs/dbraw/zinc/26/09/17/781260917.db2.gz ZEUHAGWXUNSBAV-MRXNPFEDSA-N 0 3 263.381 2.956 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)c1 ZINC000711869014 781482493 /nfs/dbraw/zinc/48/24/93/781482493.db2.gz JDJZRHDGMLEARP-YOEHRIQHSA-N 0 3 275.392 2.995 20 10 CFCDHN CC(C)(C)N1CC[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000822133895 781893939 /nfs/dbraw/zinc/89/39/39/781893939.db2.gz WUHYJVIPVOWQKB-KGLIPLIRSA-N 0 3 274.408 2.842 20 10 CFCDHN Cc1ccc([C@H](O)C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000072629604 346933605 /nfs/dbraw/zinc/93/36/05/346933605.db2.gz JTHNPFCSWCMSJI-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc([C@H](O)C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000072629604 346933609 /nfs/dbraw/zinc/93/36/09/346933609.db2.gz JTHNPFCSWCMSJI-QGZVFWFLSA-N 0 3 271.360 2.866 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCCc3n[nH]cc32)cc1F ZINC000368607215 282290779 /nfs/dbraw/zinc/29/07/79/282290779.db2.gz GYWDZWXTOARNHJ-AWEZNQCLSA-N 0 3 288.370 2.782 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](C)CCCCO)cc1C ZINC000295122359 199356549 /nfs/dbraw/zinc/35/65/49/199356549.db2.gz WTYJPYXDKYLIEF-CYBMUJFWSA-N 0 3 251.370 2.650 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1 ZINC000067504317 346806102 /nfs/dbraw/zinc/80/61/02/346806102.db2.gz KHOISTPKZDMOEA-MRXNPFEDSA-N 0 3 297.402 2.608 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCCc2nccs2)c1 ZINC000076892878 347159178 /nfs/dbraw/zinc/15/91/78/347159178.db2.gz QVXRMRIAGIMUPZ-UHFFFAOYSA-N 0 3 262.378 2.880 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)(C)O ZINC000294861686 199218350 /nfs/dbraw/zinc/21/83/50/199218350.db2.gz CAWWPJOZRXKRQM-TVQRCGJNSA-N 0 3 255.333 2.731 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H](C)CCO)c1cc(F)ccc1[O-] ZINC000297378504 200168305 /nfs/dbraw/zinc/16/83/05/200168305.db2.gz QVJJJNFCXUTIBC-WDEREUQCSA-N 0 3 255.333 2.591 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)C1CCCCC1)CC2 ZINC000297531874 200220309 /nfs/dbraw/zinc/22/03/09/200220309.db2.gz DOQUMIRYMROTLD-HOCLYGCPSA-N 0 3 275.392 2.910 20 10 CFCDHN COc1cccc([C@@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)c1 ZINC000297737719 200271864 /nfs/dbraw/zinc/27/18/64/200271864.db2.gz NVUZRNHCEPUBQC-RDJZCZTQSA-N 0 3 299.370 2.711 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCN1CC)c1ccccc1[O-] ZINC000019960437 372215829 /nfs/dbraw/zinc/21/58/29/372215829.db2.gz QKHDDYWIPPPXHV-DZGCQCFKSA-N 0 3 262.397 2.917 20 10 CFCDHN CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000019960335 372215841 /nfs/dbraw/zinc/21/58/41/372215841.db2.gz IFEKNVZZPZUSNS-QWHCGFSZSA-N 0 3 278.396 2.536 20 10 CFCDHN COc1cccc(C[NH2+]CC2(N(C)C)CCCCC2)c1[O-] ZINC000020094582 372231134 /nfs/dbraw/zinc/23/11/34/372231134.db2.gz ZTCYYJGSMAZYHR-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CCN(Cc1ccccc1)c1ccc(CNCCO)cc1 ZINC000033442524 372494764 /nfs/dbraw/zinc/49/47/64/372494764.db2.gz GZDSJEPBJWDQQW-UHFFFAOYSA-N 0 3 284.403 2.795 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2ccncc2)c([O-])c1 ZINC000048261583 373157013 /nfs/dbraw/zinc/15/70/13/373157013.db2.gz ZFOOPCFQTHPFHJ-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H](OC)C2)c([O-])c1 ZINC000091772709 375061796 /nfs/dbraw/zinc/06/17/96/375061796.db2.gz QOFQJZLTZXPMCZ-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H](OC)C2)c([O-])c1 ZINC000091772709 375061804 /nfs/dbraw/zinc/06/18/04/375061804.db2.gz QOFQJZLTZXPMCZ-OAHLLOKOSA-N 0 3 279.380 2.792 20 10 CFCDHN Cc1cc(O)c(CN2CCOC[C@@H]2C2CC2)cc1C ZINC000093645436 375284345 /nfs/dbraw/zinc/28/43/45/375284345.db2.gz MTLIVCIEZJKFJY-OAHLLOKOSA-N 0 3 261.365 2.620 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@]3(CCOC3)C2)c([O-])c1 ZINC000093820549 375316346 /nfs/dbraw/zinc/31/63/46/375316346.db2.gz SHRFEYYNKWLLSN-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)c([O-])c1 ZINC000093820549 375316355 /nfs/dbraw/zinc/31/63/55/375316355.db2.gz SHRFEYYNKWLLSN-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000093506995 375258964 /nfs/dbraw/zinc/25/89/64/375258964.db2.gz SOVOQRYYXJVOPY-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000093506995 375258973 /nfs/dbraw/zinc/25/89/73/375258973.db2.gz SOVOQRYYXJVOPY-CZUORRHYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(O)c(CN2CCOC3(CCCC3)C2)c1 ZINC000093589238 375268811 /nfs/dbraw/zinc/26/88/11/375268811.db2.gz VNGLTFFOHVGIQI-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2cc(C)c(C)cc2[O-])CC1 ZINC000093591802 375270529 /nfs/dbraw/zinc/27/05/29/375270529.db2.gz FMKBWWWTUDHYNM-UHFFFAOYSA-N 0 3 277.408 2.994 20 10 CFCDHN CC(C)[C@@H](C)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658628 375576898 /nfs/dbraw/zinc/57/68/98/375576898.db2.gz NJAZEEKUCIWHGK-SNVBAGLBSA-N 0 3 251.326 2.597 20 10 CFCDHN CC(C)[C@@H](C)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658628 375576903 /nfs/dbraw/zinc/57/69/03/375576903.db2.gz NJAZEEKUCIWHGK-SNVBAGLBSA-N 0 3 251.326 2.597 20 10 CFCDHN CCC(CC)[C@@H](O)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000113341574 376010586 /nfs/dbraw/zinc/01/05/86/376010586.db2.gz BVBTWJUIPSNQEH-HNNXBMFYSA-N 0 3 251.370 2.587 20 10 CFCDHN C[C@H](O)C[C@@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000127706360 377296712 /nfs/dbraw/zinc/29/67/12/377296712.db2.gz VFGBZKZZPXOBAN-JSGCOSHPSA-N 0 3 280.387 2.627 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)CCC2CCOCC2)c1 ZINC000129682634 377461049 /nfs/dbraw/zinc/46/10/49/377461049.db2.gz QZZRGTROXYISTP-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)CCC2CCOCC2)c1 ZINC000129682634 377461059 /nfs/dbraw/zinc/46/10/59/377461059.db2.gz QZZRGTROXYISTP-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN COc1ccc(O)c(CN2CCc3ccccc3C2)c1 ZINC000131684094 377748824 /nfs/dbraw/zinc/74/88/24/377748824.db2.gz UNTSDWRMLXBXHG-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN CCN(CC)c1ccc(CN(C)[C@@H]2CCOC2)cc1 ZINC000132182453 377810521 /nfs/dbraw/zinc/81/05/21/377810521.db2.gz PEVAQAARYBRURO-MRXNPFEDSA-N 0 3 262.397 2.754 20 10 CFCDHN CCN(CC)c1ccc(CN(C)[C@H]2CCOC2)cc1 ZINC000132182675 377812396 /nfs/dbraw/zinc/81/23/96/377812396.db2.gz PEVAQAARYBRURO-INIZCTEOSA-N 0 3 262.397 2.754 20 10 CFCDHN CCOC(=O)CCCC[N@H+](C)Cc1ccccc1[O-] ZINC000133023457 377896609 /nfs/dbraw/zinc/89/66/09/377896609.db2.gz OUZYFHCAAUIZGR-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCOC(=O)CCCC[N@@H+](C)Cc1ccccc1[O-] ZINC000133023457 377896616 /nfs/dbraw/zinc/89/66/16/377896616.db2.gz OUZYFHCAAUIZGR-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCOc1cccc(CN(C)C[C@H]2CCCCO2)c1O ZINC000132608765 377857922 /nfs/dbraw/zinc/85/79/22/377857922.db2.gz PZXWYIGAEZKMPN-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)NC(C)(C)C ZINC000135138679 378089642 /nfs/dbraw/zinc/08/96/42/378089642.db2.gz ZHDGPGLAYHYNHO-STQMWFEESA-N 0 3 291.439 2.706 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H](C)[C@@H](CO)SC)cc1 ZINC000152466252 378418864 /nfs/dbraw/zinc/41/88/64/378418864.db2.gz VFHFVVGVKBZHKC-CZUORRHYSA-N 0 3 296.480 2.735 20 10 CFCDHN Cc1cccc(CNC[C@@H](n2cccn2)C(F)(F)F)c1O ZINC000529636637 383740069 /nfs/dbraw/zinc/74/00/69/383740069.db2.gz FRGMQLDIYLYABI-GFCCVEGCSA-N 0 3 299.296 2.790 20 10 CFCDHN C[C@H](O)CN[C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000179579974 380561495 /nfs/dbraw/zinc/56/14/95/380561495.db2.gz KENZEGXCAMIDMR-STQMWFEESA-N 0 3 280.387 2.847 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2CN2CCCC2)c1 ZINC000179646818 380566376 /nfs/dbraw/zinc/56/63/76/380566376.db2.gz PDSOXLUUVNOJIE-MRXNPFEDSA-N 0 3 274.408 2.761 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H]2CN2CCCC2)c1 ZINC000179646818 380566380 /nfs/dbraw/zinc/56/63/80/380566380.db2.gz PDSOXLUUVNOJIE-MRXNPFEDSA-N 0 3 274.408 2.761 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000180182688 380630439 /nfs/dbraw/zinc/63/04/39/380630439.db2.gz GWYOQKVVHLUDJZ-INIZCTEOSA-N 0 3 292.398 2.982 20 10 CFCDHN CCOC[C@H]1CCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000180257685 380639651 /nfs/dbraw/zinc/63/96/51/380639651.db2.gz IEZFLRBUUOIRSC-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN CCOC[C@H]1CCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000180257685 380639655 /nfs/dbraw/zinc/63/96/55/380639655.db2.gz IEZFLRBUUOIRSC-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN C[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccccc1[O-] ZINC000179899418 380593494 /nfs/dbraw/zinc/59/34/94/380593494.db2.gz FSWLASCCKLYYGC-SUMWQHHRSA-N 0 3 271.360 2.951 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@](C)(O)C2)cc1F ZINC000180189537 380629434 /nfs/dbraw/zinc/62/94/34/380629434.db2.gz JVKLLNGKYRSCNX-INIZCTEOSA-N 0 3 280.387 2.629 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1cccs1 ZINC000180772693 380697180 /nfs/dbraw/zinc/69/71/80/380697180.db2.gz ZCGVUXQEABETSD-AWEZNQCLSA-N 0 3 281.352 2.590 20 10 CFCDHN CC[C@@H]([NH2+]CC1(COC)CCOCC1)c1ccccc1[O-] ZINC000368199126 380954679 /nfs/dbraw/zinc/95/46/79/380954679.db2.gz FEJKNBOULIPJCL-OAHLLOKOSA-N 0 3 293.407 2.876 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1ccccc1 ZINC000288432337 381013738 /nfs/dbraw/zinc/01/37/38/381013738.db2.gz BTQWBOUPYWEAGY-BLLLJJGKSA-N 0 3 257.333 2.604 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1COc2ccc(F)cc2C1 ZINC000288521535 381014033 /nfs/dbraw/zinc/01/40/33/381014033.db2.gz JKIBAYLLXMWOGU-AWEZNQCLSA-N 0 3 273.307 2.625 20 10 CFCDHN CCc1ccc([C@H](O)C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000289099755 381024823 /nfs/dbraw/zinc/02/48/23/381024823.db2.gz CBKSETRIMVCVTA-QGZVFWFLSA-N 0 3 289.350 2.917 20 10 CFCDHN CCc1ccc([C@@H](O)C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000289099749 381025661 /nfs/dbraw/zinc/02/56/61/381025661.db2.gz CBKSETRIMVCVTA-KRWDZBQOSA-N 0 3 289.350 2.917 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2Cc1cc(C)c(C)cc1[O-] ZINC000289264597 381028201 /nfs/dbraw/zinc/02/82/01/381028201.db2.gz FWAGFLUBELVIGB-AIGAYMNCSA-N 0 3 287.403 2.864 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1cc(C)c(C)cc1[O-] ZINC000289264597 381028214 /nfs/dbraw/zinc/02/82/14/381028214.db2.gz FWAGFLUBELVIGB-AIGAYMNCSA-N 0 3 287.403 2.864 20 10 CFCDHN Cc1cccc(C[NH2+]CCC(=O)OC(C)(C)C)c1[O-] ZINC000182445028 381088622 /nfs/dbraw/zinc/08/86/22/381088622.db2.gz QHGJMRWXBNTKRW-UHFFFAOYSA-N 0 3 265.353 2.522 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCCCCO)c1 ZINC000182466938 381093513 /nfs/dbraw/zinc/09/35/13/381093513.db2.gz VEEGVKFWIOIYAG-LBPRGKRZSA-N 0 3 267.369 2.604 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1cc(F)ccc1[O-] ZINC000295854091 381118516 /nfs/dbraw/zinc/11/85/16/381118516.db2.gz BDIYZBFGIGULMZ-VHSXEESVSA-N 0 3 255.333 2.731 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCOC[C@H]1CCCO1)CC2 ZINC000295969627 381187924 /nfs/dbraw/zinc/18/79/24/381187924.db2.gz MQOPSPGBNYWSMI-HUUCEWRRSA-N 0 3 291.391 2.555 20 10 CFCDHN C[C@@H]1CCCN(CC[NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000296019946 381214390 /nfs/dbraw/zinc/21/43/90/381214390.db2.gz PMEHSBOFUIGFOV-UKRRQHHQSA-N 0 3 274.408 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]3COC[C@H]32)c1[O-] ZINC000369214255 381214751 /nfs/dbraw/zinc/21/47/51/381214751.db2.gz JJPBMZSJABUFSN-SMDDNHRTSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]3COC[C@H]32)c1[O-] ZINC000369214255 381214758 /nfs/dbraw/zinc/21/47/58/381214758.db2.gz JJPBMZSJABUFSN-SMDDNHRTSA-N 0 3 281.783 2.965 20 10 CFCDHN C[C@@H]([NH2+]CCCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000183419746 381268833 /nfs/dbraw/zinc/26/88/33/381268833.db2.gz DFUSMNTWRMNKRE-LLVKDONJSA-N 0 3 290.329 2.927 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1[O-] ZINC000183453117 381273769 /nfs/dbraw/zinc/27/37/69/381273769.db2.gz BAGZFNAMLHIIKW-UONOGXRCSA-N 0 3 296.370 2.848 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183538086 381285592 /nfs/dbraw/zinc/28/55/92/381285592.db2.gz ZJMDPJLTRWQHNI-STQMWFEESA-N 0 3 251.370 2.842 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC(C)(C)O)c([O-])c1 ZINC000296281722 381331407 /nfs/dbraw/zinc/33/14/07/381331407.db2.gz FCHZQJUFUPGKHK-NWDGAFQWSA-N 0 3 251.370 2.901 20 10 CFCDHN CC(C)(C)[C@H](CCO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296308162 381341158 /nfs/dbraw/zinc/34/11/58/381341158.db2.gz DZAZQLAIIYEXMQ-JSGCOSHPSA-N 0 3 263.381 2.766 20 10 CFCDHN C[N@H+](CCc1ccncc1)Cc1cc(F)ccc1[O-] ZINC000183756383 381314639 /nfs/dbraw/zinc/31/46/39/381314639.db2.gz ZBGDEJWASFCMMH-UHFFFAOYSA-N 0 3 260.312 2.601 20 10 CFCDHN C[N@@H+](CCc1ccncc1)Cc1cc(F)ccc1[O-] ZINC000183756383 381314643 /nfs/dbraw/zinc/31/46/43/381314643.db2.gz ZBGDEJWASFCMMH-UHFFFAOYSA-N 0 3 260.312 2.601 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CC(C)(C)O)c1 ZINC000296325683 381348455 /nfs/dbraw/zinc/34/84/55/381348455.db2.gz HARRCMAETKWENX-NEPJUHHUSA-N 0 3 251.370 2.901 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000296393563 381376206 /nfs/dbraw/zinc/37/62/06/381376206.db2.gz JZDOWZXJSVEMFT-IAGOWNOFSA-N 0 3 297.398 2.881 20 10 CFCDHN COCCC[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184684074 381460567 /nfs/dbraw/zinc/46/05/67/381460567.db2.gz XATQLDFWGQBGAK-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN COCCC[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184684074 381460572 /nfs/dbraw/zinc/46/05/72/381460572.db2.gz XATQLDFWGQBGAK-UHFFFAOYSA-N 0 3 273.760 2.523 20 10 CFCDHN COc1cc(Cl)cc(CN2CCC([C@@H](C)O)CC2)c1O ZINC000184687406 381460886 /nfs/dbraw/zinc/46/08/86/381460886.db2.gz UWSUQVQICDCROX-SNVBAGLBSA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@@H](NCc1cnn(C)c1)c1cc2c(cc1O)CCCC2 ZINC000185113233 381539594 /nfs/dbraw/zinc/53/95/94/381539594.db2.gz YKIQNMVZJDIPJF-GFCCVEGCSA-N 0 3 285.391 2.855 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)[nH]n1 ZINC000296979614 381548065 /nfs/dbraw/zinc/54/80/65/381548065.db2.gz RVWIEQJAGRBBEV-YGRLFVJLSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)n[nH]1 ZINC000296979614 381548072 /nfs/dbraw/zinc/54/80/72/381548072.db2.gz RVWIEQJAGRBBEV-YGRLFVJLSA-N 0 3 271.364 2.632 20 10 CFCDHN CN(CC[NH2+][C@H]1CCc2cccc([O-])c21)C1CCCC1 ZINC000297931305 381576147 /nfs/dbraw/zinc/57/61/47/381576147.db2.gz XQINDJMOQKADKZ-HNNXBMFYSA-N 0 3 274.408 2.844 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCNC(=O)OC(C)(C)C)c([O-])c1 ZINC000185267273 381582025 /nfs/dbraw/zinc/58/20/25/381582025.db2.gz DTNFEESMUURBQU-GFCCVEGCSA-N 0 3 294.395 2.876 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](CCO)C(C)(C)C)c1 ZINC000185196563 381560470 /nfs/dbraw/zinc/56/04/70/381560470.db2.gz VKCKBGFNWTZPGJ-XHDPSFHLSA-N 0 3 281.396 2.849 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CC(COc2ccccc2)C1 ZINC000297419245 381561505 /nfs/dbraw/zinc/56/15/05/381561505.db2.gz NFGIYVOPLIPLOU-UHFFFAOYSA-N 0 3 269.344 2.903 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185424553 381628678 /nfs/dbraw/zinc/62/86/78/381628678.db2.gz KSVNCHFEKGEDLZ-MEDUHNTESA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@H]([NH2+]Cc1cccc(CO)c1)c1cc(F)ccc1[O-] ZINC000185373535 381614782 /nfs/dbraw/zinc/61/47/82/381614782.db2.gz XCAUPILGLTYAJM-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(F)ccc1[O-] ZINC000185535080 381660065 /nfs/dbraw/zinc/66/00/65/381660065.db2.gz UWJTVBDWXBNCNB-NDMCHQMPSA-N 0 3 279.355 2.995 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185605581 381678690 /nfs/dbraw/zinc/67/86/90/381678690.db2.gz IDIVBPBEDWJDHW-OLZOCXBDSA-N 0 3 281.396 2.850 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)CCO)c([O-])c1 ZINC000185609165 381681660 /nfs/dbraw/zinc/68/16/60/381681660.db2.gz GQMAJQUISCZDEZ-LBPRGKRZSA-N 0 3 251.370 2.760 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)c([O-])c1 ZINC000185672460 381699346 /nfs/dbraw/zinc/69/93/46/381699346.db2.gz CYJZYHSHYBENRF-BFHYXJOUSA-N 0 3 274.408 2.976 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000185672752 381699526 /nfs/dbraw/zinc/69/95/26/381699526.db2.gz SZWNYUYLTWINGZ-GMXVVIOVSA-N 0 3 278.371 2.807 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCc2cccc(C(N)=O)c2)c1 ZINC000185983335 381795052 /nfs/dbraw/zinc/79/50/52/381795052.db2.gz GTLSFIBWCZOVQY-CYBMUJFWSA-N 0 3 298.386 2.693 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CC(=O)N(C(C)(C)C)C1)c1cc(F)ccc1[O-] ZINC000186086591 381821180 /nfs/dbraw/zinc/82/11/80/381821180.db2.gz WRKHDYNHHGFTBT-ZYHUDNBSSA-N 0 3 294.370 2.581 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c1 ZINC000186115000 381826531 /nfs/dbraw/zinc/82/65/31/381826531.db2.gz WIGPCWXEPXEZLR-AAEUAGOBSA-N 0 3 271.364 2.632 20 10 CFCDHN CCOC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2[O-])C1 ZINC000186457570 381917525 /nfs/dbraw/zinc/91/75/25/381917525.db2.gz PVNNIFNFQZTWRD-QWHCGFSZSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@H](C[S@@](C)=O)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000186540742 381940943 /nfs/dbraw/zinc/94/09/43/381940943.db2.gz CBFBCQGSPAZHES-XAAFQQQXSA-N 0 3 295.448 2.689 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@](O)(C2CC2)C1 ZINC000373322843 381979255 /nfs/dbraw/zinc/97/92/55/381979255.db2.gz JVZHFWJZMINGFY-GOSISDBHSA-N 0 3 283.371 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@](O)(C2CC2)C1 ZINC000373322843 381979265 /nfs/dbraw/zinc/97/92/65/381979265.db2.gz JVZHFWJZMINGFY-GOSISDBHSA-N 0 3 283.371 2.892 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000373368140 381988570 /nfs/dbraw/zinc/98/85/70/381988570.db2.gz DEPFWBUKYBGGIE-DLBZAZTESA-N 0 3 275.392 2.995 20 10 CFCDHN COc1ccc([O-])c(C[NH+]2CCC([C@H]3CCOC3)CC2)c1 ZINC000374931120 382061740 /nfs/dbraw/zinc/06/17/40/382061740.db2.gz SVQMJVCZGPRTSX-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000375015904 382065151 /nfs/dbraw/zinc/06/51/51/382065151.db2.gz DBYNJKNGERBFJF-LSDHHAIUSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000375015904 382065161 /nfs/dbraw/zinc/06/51/61/382065161.db2.gz DBYNJKNGERBFJF-LSDHHAIUSA-N 0 3 261.365 2.844 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CC[C@]3(CCOC3)C2)c1 ZINC000375252481 382073235 /nfs/dbraw/zinc/07/32/35/382073235.db2.gz IPMIPJOUEMTUAU-WBMJQRKESA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CC[C@]3(CCOC3)C2)c1 ZINC000375252481 382073237 /nfs/dbraw/zinc/07/32/37/382073237.db2.gz IPMIPJOUEMTUAU-WBMJQRKESA-N 0 3 277.364 2.574 20 10 CFCDHN CN1CCc2cc(CNCc3cnc4n3CCCC4)ccc21 ZINC000376767447 382172590 /nfs/dbraw/zinc/17/25/90/382172590.db2.gz IUOXHDAQZZYHSD-UHFFFAOYSA-N 0 3 296.418 2.502 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@H]2COC)cc1 ZINC000293703872 382242028 /nfs/dbraw/zinc/24/20/28/382242028.db2.gz RTQLOXYHVYBDHS-INIZCTEOSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(O)Cc3ccccc3C2)c([O-])c1 ZINC000363867925 382249175 /nfs/dbraw/zinc/24/91/75/382249175.db2.gz QRGZZFYMEPKCOA-CQSZACIVSA-N 0 3 297.398 2.881 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC3(CCOCC3)[C@H]2C)c1[O-] ZINC000363870687 382250009 /nfs/dbraw/zinc/25/00/09/382250009.db2.gz WXNABWFXHCKLRP-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC3(CCOCC3)[C@H]2C)c1[O-] ZINC000363870687 382250016 /nfs/dbraw/zinc/25/00/16/382250016.db2.gz WXNABWFXHCKLRP-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000293728700 382255023 /nfs/dbraw/zinc/25/50/23/382255023.db2.gz OFDYQHCGTSAMCP-OLZOCXBDSA-N 0 3 278.396 2.595 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1[O-] ZINC000293751090 382263327 /nfs/dbraw/zinc/26/33/27/382263327.db2.gz RISQHFIQLPBZQZ-OCCSQVGLSA-N 0 3 250.386 2.631 20 10 CFCDHN CCCN1CCC[N@@H+]([C@@H](CC)c2ccccc2[O-])CC1=O ZINC000377618235 382303507 /nfs/dbraw/zinc/30/35/07/382303507.db2.gz BWSBPEQZVYDHKP-HNNXBMFYSA-N 0 3 290.407 2.788 20 10 CFCDHN CCCN1CCC[N@H+]([C@@H](CC)c2ccccc2[O-])CC1=O ZINC000377618235 382303510 /nfs/dbraw/zinc/30/35/10/382303510.db2.gz BWSBPEQZVYDHKP-HNNXBMFYSA-N 0 3 290.407 2.788 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]1Cn1cncn1 ZINC000377694602 382322117 /nfs/dbraw/zinc/32/21/17/382322117.db2.gz HBGXVTSHEOTEIY-DZGCQCFKSA-N 0 3 286.379 2.599 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H]1Cn1cncn1 ZINC000377694602 382322119 /nfs/dbraw/zinc/32/21/19/382322119.db2.gz HBGXVTSHEOTEIY-DZGCQCFKSA-N 0 3 286.379 2.599 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c([O-])c1 ZINC000377803454 382349536 /nfs/dbraw/zinc/34/95/36/382349536.db2.gz WQOYQHFOEHOAGA-VXGBXAGGSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3[nH]cnc3C2)c([O-])c1 ZINC000377803454 382349541 /nfs/dbraw/zinc/34/95/41/382349541.db2.gz WQOYQHFOEHOAGA-VXGBXAGGSA-N 0 3 271.364 2.632 20 10 CFCDHN CCN(CC)c1ccc(CN2CC3(C2)CCOC3)cc1 ZINC000293967926 382359376 /nfs/dbraw/zinc/35/93/76/382359376.db2.gz JYIBJMFSAWUZOF-UHFFFAOYSA-N 0 3 274.408 2.755 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)c1[O-] ZINC000294025059 382383089 /nfs/dbraw/zinc/38/30/89/382383089.db2.gz NTOLHDPCINFDTM-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c1[O-] ZINC000294025059 382383102 /nfs/dbraw/zinc/38/31/02/382383102.db2.gz NTOLHDPCINFDTM-KRWDZBQOSA-N 0 3 293.407 2.631 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H](C)[C@H](OC)C2)c1 ZINC000188333468 382393979 /nfs/dbraw/zinc/39/39/79/382393979.db2.gz AMPNXSAAYIDURQ-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H](C)[C@H](OC)C2)c1 ZINC000188333468 382393981 /nfs/dbraw/zinc/39/39/81/382393981.db2.gz AMPNXSAAYIDURQ-BLLLJJGKSA-N 0 3 279.380 2.648 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCCC[C@@H](CO)C2)cc1C ZINC000378344948 382441099 /nfs/dbraw/zinc/44/10/99/382441099.db2.gz FLHJGPZPCMBFCS-CQSZACIVSA-N 0 3 263.381 2.603 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCCC[C@@H](CO)C2)cc1C ZINC000378344948 382441104 /nfs/dbraw/zinc/44/11/04/382441104.db2.gz FLHJGPZPCMBFCS-CQSZACIVSA-N 0 3 263.381 2.603 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000378126341 382402762 /nfs/dbraw/zinc/40/27/62/382402762.db2.gz DNFVMXYMKOHTOJ-MRXNPFEDSA-N 0 3 263.381 2.541 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@](CO)(C(C)C)C2)c1 ZINC000378126341 382402767 /nfs/dbraw/zinc/40/27/67/382402767.db2.gz DNFVMXYMKOHTOJ-MRXNPFEDSA-N 0 3 263.381 2.541 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000378499276 382474105 /nfs/dbraw/zinc/47/41/05/382474105.db2.gz RCPNZCQYNIFKSY-UHFFFAOYSA-N 0 3 261.365 2.785 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000378499276 382474106 /nfs/dbraw/zinc/47/41/06/382474106.db2.gz RCPNZCQYNIFKSY-UHFFFAOYSA-N 0 3 261.365 2.785 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](C)[C@H](C)OC)c([O-])c1 ZINC000189101924 382542311 /nfs/dbraw/zinc/54/23/11/382542311.db2.gz PFKIDYNEZNTHJD-RYUDHWBXSA-N 0 3 267.369 2.694 20 10 CFCDHN CCOCc1cc(CNC[C@H]2CCCO2)ccc1OC ZINC000295115619 382576936 /nfs/dbraw/zinc/57/69/36/382576936.db2.gz VUEQHRYHFJCGOW-OAHLLOKOSA-N 0 3 279.380 2.500 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@@]2(CCO[C@H]2C)C1 ZINC000367294852 382562787 /nfs/dbraw/zinc/56/27/87/382562787.db2.gz NKOQMNZZRCUELY-LXZKKBNFSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@@]2(CCO[C@H]2C)C1 ZINC000367294852 382562790 /nfs/dbraw/zinc/56/27/90/382562790.db2.gz NKOQMNZZRCUELY-LXZKKBNFSA-N 0 3 291.391 2.723 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])Cc1cccnc1N ZINC000295057385 382570396 /nfs/dbraw/zinc/57/03/96/382570396.db2.gz PBVNWLPEMVHQNT-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])Cc1cccnc1N ZINC000295057385 382570401 /nfs/dbraw/zinc/57/04/01/382570401.db2.gz PBVNWLPEMVHQNT-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN CC[C@@H](C)[C@@H](C[NH2+]Cc1cc(OC)c(OC)cc1[O-])OC ZINC000294818283 382531049 /nfs/dbraw/zinc/53/10/49/382531049.db2.gz OPYIFWHFJMWJSU-BDJLRTHQSA-N 0 3 297.395 2.560 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000295234522 382595561 /nfs/dbraw/zinc/59/55/61/382595561.db2.gz OHNZHTCVBNRCNS-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c1[O-] ZINC000295234522 382595565 /nfs/dbraw/zinc/59/55/65/382595565.db2.gz OHNZHTCVBNRCNS-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CC1(C)C[C@H](O)CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000295254835 382600750 /nfs/dbraw/zinc/60/07/50/382600750.db2.gz QQMQXBNFIOSOIK-CYBMUJFWSA-N 0 3 267.344 2.514 20 10 CFCDHN CC1(C)C[C@H](O)CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000295254835 382600754 /nfs/dbraw/zinc/60/07/54/382600754.db2.gz QQMQXBNFIOSOIK-CYBMUJFWSA-N 0 3 267.344 2.514 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2(C)OCCCO2)c1[O-] ZINC000190839658 382681857 /nfs/dbraw/zinc/68/18/57/382681857.db2.gz CKWFATKEUAABAI-UHFFFAOYSA-N 0 3 285.771 2.597 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](C)[C@H]2CCCO2)c1 ZINC000248528773 383253347 /nfs/dbraw/zinc/25/33/47/383253347.db2.gz JSWAZCLCWIIPLE-FIXISWKDSA-N 0 3 265.353 2.619 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000248527924 383253467 /nfs/dbraw/zinc/25/34/67/383253467.db2.gz IFEKNVZZPZUSNS-OLZOCXBDSA-N 0 3 278.396 2.536 20 10 CFCDHN C[C@H]([NH2+][C@H]1Cc2ccccc2[C@H]1O)c1cc(F)ccc1[O-] ZINC000248521305 383253739 /nfs/dbraw/zinc/25/37/39/383253739.db2.gz RKLAXSJHUQSVMA-GLZQIGESSA-N 0 3 287.334 2.840 20 10 CFCDHN CC(C)(O)CC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000267387507 384377527 /nfs/dbraw/zinc/37/75/27/384377527.db2.gz CEMOMLNKAKHXHF-OAHLLOKOSA-N 0 3 293.407 2.534 20 10 CFCDHN CC(C)(O)CC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000267387507 384377533 /nfs/dbraw/zinc/37/75/33/384377533.db2.gz CEMOMLNKAKHXHF-OAHLLOKOSA-N 0 3 293.407 2.534 20 10 CFCDHN Cc1cc(O)c(CN[C@@H]2CCCc3c[nH]nc32)cc1C ZINC000268850650 384675727 /nfs/dbraw/zinc/67/57/27/384675727.db2.gz POADJFHGZMRVAF-CQSZACIVSA-N 0 3 271.364 2.899 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(N(C)C)nc1)c1ccccc1[O-] ZINC000269231150 384739771 /nfs/dbraw/zinc/73/97/71/384739771.db2.gz FYHCZDNBUQQUFL-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@H](CC)C2)c1 ZINC000281260989 385189112 /nfs/dbraw/zinc/18/91/12/385189112.db2.gz NEASHZVAYBQOAF-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@H](CC)C2)c1 ZINC000281260989 385189119 /nfs/dbraw/zinc/18/91/19/385189119.db2.gz NEASHZVAYBQOAF-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])[C@@H](C)C1 ZINC000282180282 385237330 /nfs/dbraw/zinc/23/73/30/385237330.db2.gz FQEUMVUMHXUIRW-GWCFXTLKSA-N 0 3 253.317 2.531 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])[C@@H](C)C1 ZINC000282180282 385237334 /nfs/dbraw/zinc/23/73/34/385237334.db2.gz FQEUMVUMHXUIRW-GWCFXTLKSA-N 0 3 253.317 2.531 20 10 CFCDHN CCCCN(CC(=O)NCCC)Cc1ccccc1O ZINC000282560741 385341812 /nfs/dbraw/zinc/34/18/12/385341812.db2.gz YKHAYKZVHRHLSZ-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN Cc1cccc(CN2CCC[C@@H]2[C@H](O)C(F)(F)F)c1O ZINC000271751033 385390065 /nfs/dbraw/zinc/39/00/65/385390065.db2.gz VIGGXKVFJCYMGW-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1[O-] ZINC000271751033 385390069 /nfs/dbraw/zinc/39/00/69/385390069.db2.gz VIGGXKVFJCYMGW-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1[O-] ZINC000271751033 385390071 /nfs/dbraw/zinc/39/00/71/385390071.db2.gz VIGGXKVFJCYMGW-YPMHNXCESA-N 0 3 289.297 2.588 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](CO)Cc2ccc(F)cc2)c1 ZINC000271228900 385377993 /nfs/dbraw/zinc/37/79/93/385377993.db2.gz PRWLYJAPABTZHX-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN CCn1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000271432263 385381867 /nfs/dbraw/zinc/38/18/67/385381867.db2.gz CAWIKSJTTQQHLI-ZDUSSCGKSA-N 0 3 272.396 2.820 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCn2ccnc2C)c1 ZINC000271773996 385390955 /nfs/dbraw/zinc/39/09/55/385390955.db2.gz DQJVSKDVOZTOAK-LBPRGKRZSA-N 0 3 289.379 2.647 20 10 CFCDHN Cc1cccc(CN2CCOC3(CCCC3)C2)c1O ZINC000271817153 385393743 /nfs/dbraw/zinc/39/37/43/385393743.db2.gz MSOLFLSHOGGCAH-UHFFFAOYSA-N 0 3 261.365 2.846 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)c1[O-] ZINC000271925287 385402940 /nfs/dbraw/zinc/40/29/40/385402940.db2.gz OKXDHOSKHHISCT-CQSZACIVSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H]3CCN(C)C[C@@H]32)cc1C ZINC000272329879 385511839 /nfs/dbraw/zinc/51/18/39/385511839.db2.gz VKWRRRCRMBWPFB-ZBFHGGJFSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H]3CCN(C)C[C@@H]32)cc1C ZINC000272329879 385511843 /nfs/dbraw/zinc/51/18/43/385511843.db2.gz VKWRRRCRMBWPFB-ZBFHGGJFSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C2CCN(C)CC2)c([O-])c1 ZINC000284180477 385545346 /nfs/dbraw/zinc/54/53/46/385545346.db2.gz QZONVOFYOIIPSF-ZDUSSCGKSA-N 0 3 262.397 2.754 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCCn2ccnc2)c([O-])c1 ZINC000284281248 385547746 /nfs/dbraw/zinc/54/77/46/385547746.db2.gz XJIFLKHDGBLKOY-CQSZACIVSA-N 0 3 273.380 2.946 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000272363545 385519048 /nfs/dbraw/zinc/51/90/48/385519048.db2.gz FRVBEBYUSZXICP-CYBMUJFWSA-N 0 3 265.328 2.723 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+][C@H]2CC(=O)N(C(C)C)C2)c([O-])c1 ZINC000285159845 385552781 /nfs/dbraw/zinc/55/27/81/385552781.db2.gz MOGPXJGIPIXDKR-KBPBESRZSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC[C@H](C)O)c([O-])c1 ZINC000285279302 385554060 /nfs/dbraw/zinc/55/40/60/385554060.db2.gz REOJPQDMXSEEPP-STQMWFEESA-N 0 3 251.370 2.821 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H]2CCOC[C@@H]2C)c1 ZINC000285413091 385555748 /nfs/dbraw/zinc/55/57/48/385555748.db2.gz GCJNWDMIVTVYDK-QWHCGFSZSA-N 0 3 279.380 2.553 20 10 CFCDHN CCc1ccc([C@@H](O)C[NH2+]Cc2ccccc2[O-])cc1 ZINC000285672920 385557203 /nfs/dbraw/zinc/55/72/03/385557203.db2.gz UJYGQPIOQJFITH-KRWDZBQOSA-N 0 3 271.360 2.778 20 10 CFCDHN CCOc1cccc(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000273188426 385672832 /nfs/dbraw/zinc/67/28/32/385672832.db2.gz YUNUTWDSXLCLQW-IAGOWNOFSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000273175472 385673158 /nfs/dbraw/zinc/67/31/58/385673158.db2.gz NBXVTJQJSOSDMC-VXGBXAGGSA-N 0 3 267.344 2.826 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(=O)NC(C)C)c([O-])c1C ZINC000273372508 385678324 /nfs/dbraw/zinc/67/83/24/385678324.db2.gz GHESIOIBWGPZSY-ZDUSSCGKSA-N 0 3 278.396 2.574 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN2C)c([O-])c1C ZINC000273376972 385679789 /nfs/dbraw/zinc/67/97/89/385679789.db2.gz HJCSXUPHHCRGKK-KGLIPLIRSA-N 0 3 262.397 2.754 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCOC1)c1cc2c(cc1[O-])CCCC2 ZINC000273384853 385681130 /nfs/dbraw/zinc/68/11/30/385681130.db2.gz JCRJZLYGDIKXOU-QWHCGFSZSA-N 0 3 275.392 2.958 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCn2cccn2)c([O-])c1C ZINC000273432206 385682246 /nfs/dbraw/zinc/68/22/46/385682246.db2.gz VZAFDODDHJIYSQ-AWEZNQCLSA-N 0 3 273.380 2.946 20 10 CFCDHN CC[NH+](CC)CCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273419937 385682516 /nfs/dbraw/zinc/68/25/16/385682516.db2.gz RUNCKVFWWPEXFS-LBPRGKRZSA-N 0 3 295.383 2.683 20 10 CFCDHN CCN(CC)CCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273419937 385682520 /nfs/dbraw/zinc/68/25/20/385682520.db2.gz RUNCKVFWWPEXFS-LBPRGKRZSA-N 0 3 295.383 2.683 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c([O-])c1C ZINC000273513145 385686254 /nfs/dbraw/zinc/68/62/54/385686254.db2.gz SDRVLKYKRQUONF-AGMRTUQYSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCO)c([O-])c1C ZINC000273579182 385689499 /nfs/dbraw/zinc/68/94/99/385689499.db2.gz MFTADGBKAJIRDQ-AAEUAGOBSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)cc2[O-])o1 ZINC000273589310 385689785 /nfs/dbraw/zinc/68/97/85/385689785.db2.gz OSBDRTPIGQZTTG-DOMZBBRYSA-N 0 3 275.348 2.986 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@@H]1C)c1cc(F)ccc1[O-] ZINC000273590387 385689947 /nfs/dbraw/zinc/68/99/47/385689947.db2.gz OYPFDPQOKPDAOD-ZIBATOQPSA-N 0 3 278.371 2.665 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc3c(c1)OCCO3)CC2 ZINC000295944962 285397724 /nfs/dbraw/zinc/39/77/24/285397724.db2.gz LDWVRFSHGKWQJT-CQSZACIVSA-N 0 3 297.354 2.941 20 10 CFCDHN Oc1cccc2c1[C@@H](N[C@H]1CCCc3c[nH]nc31)CC2 ZINC000296660799 285396774 /nfs/dbraw/zinc/39/67/74/285396774.db2.gz FEQNYVMBAGEHFP-STQMWFEESA-N 0 3 269.348 2.770 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCN(CC3CC3)CC1)CC2 ZINC000296031222 285396909 /nfs/dbraw/zinc/39/69/09/285396909.db2.gz QCGYXQXYCHPWMU-INIZCTEOSA-N 0 3 286.419 2.844 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+]Cc2ccc(OC)cc2[O-])C12CCC2 ZINC000372635862 393453795 /nfs/dbraw/zinc/45/37/95/393453795.db2.gz NVWDAOZXXPBVIX-CVEARBPZSA-N 0 3 291.391 2.838 20 10 CFCDHN COCC[N@@H+](Cc1cc(F)ccc1[O-])CC(C)C ZINC000179939265 393471823 /nfs/dbraw/zinc/47/18/23/393471823.db2.gz LHWQZHLQXIBMMX-UHFFFAOYSA-N 0 3 255.333 2.636 20 10 CFCDHN COCC[N@H+](Cc1cc(F)ccc1[O-])CC(C)C ZINC000179939265 393471826 /nfs/dbraw/zinc/47/18/26/393471826.db2.gz LHWQZHLQXIBMMX-UHFFFAOYSA-N 0 3 255.333 2.636 20 10 CFCDHN Cc1ccc(C(=O)NCC[NH2+]Cc2cc(C)ccc2[O-])cc1 ZINC000237586112 393793631 /nfs/dbraw/zinc/79/36/31/393793631.db2.gz XUFZBKVLBHJNSC-UHFFFAOYSA-N 0 3 298.386 2.529 20 10 CFCDHN C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1[O-] ZINC000105447130 393863598 /nfs/dbraw/zinc/86/35/98/393863598.db2.gz KSIFAIQNMIIBRB-LBPRGKRZSA-N 0 3 257.333 2.819 20 10 CFCDHN C[N@H+](CCCCCn1cccn1)Cc1ccccc1[O-] ZINC000109773246 393879375 /nfs/dbraw/zinc/87/93/75/393879375.db2.gz LRSGIEASNLGDOR-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN C[N@@H+](CCCCCn1cccn1)Cc1ccccc1[O-] ZINC000109773246 393879379 /nfs/dbraw/zinc/87/93/79/393879379.db2.gz LRSGIEASNLGDOR-UHFFFAOYSA-N 0 3 273.380 2.891 20 10 CFCDHN CC[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cnn(C)c1 ZINC000122417506 393968918 /nfs/dbraw/zinc/96/89/18/393968918.db2.gz ONBLXLOHEHMMAW-OAHLLOKOSA-N 0 3 290.386 2.866 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H]3CCN(C)C[C@H]32)cc1C ZINC000272329877 394027704 /nfs/dbraw/zinc/02/77/04/394027704.db2.gz VKWRRRCRMBWPFB-GOEBONIOSA-N 0 3 274.408 2.535 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H]3CCN(C)C[C@H]32)cc1C ZINC000272329877 394027707 /nfs/dbraw/zinc/02/77/07/394027707.db2.gz VKWRRRCRMBWPFB-GOEBONIOSA-N 0 3 274.408 2.535 20 10 CFCDHN CCSCC[C@@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000135292567 394215831 /nfs/dbraw/zinc/21/58/31/394215831.db2.gz ZUOLZPAWZUOCGF-SNVBAGLBSA-N 0 3 283.393 2.742 20 10 CFCDHN COC(C)(C)C[C@@H](C)[NH2+]Cc1cccc(C)c1[O-] ZINC000182478055 292066481 /nfs/dbraw/zinc/06/64/81/292066481.db2.gz ZGFUEGIPXJQWJJ-GFCCVEGCSA-N 0 3 251.370 2.994 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccc(C)cc2)c1[O-] ZINC000019962464 170944203 /nfs/dbraw/zinc/94/42/03/170944203.db2.gz DOOQSMNZQBEXMW-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccccc1)c1ccccc1[O-] ZINC000035601321 172289819 /nfs/dbraw/zinc/28/98/19/172289819.db2.gz SQUHBMZFXDKRAO-LRDDRELGSA-N 0 3 257.333 2.776 20 10 CFCDHN COc1ccc(CN[C@@H](C)c2cc(C)ccc2O)cn1 ZINC000035628918 172308002 /nfs/dbraw/zinc/30/80/02/172308002.db2.gz GWYOOWYRSAUNJH-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])cn1 ZINC000035628918 172308006 /nfs/dbraw/zinc/30/80/06/172308006.db2.gz GWYOOWYRSAUNJH-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H](C)N2CCCCC2)c1[O-] ZINC000038028503 174017609 /nfs/dbraw/zinc/01/76/09/174017609.db2.gz LPHMIMGFINZULA-AWEZNQCLSA-N 0 3 292.423 2.755 20 10 CFCDHN COC(=O)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000298794801 260162637 /nfs/dbraw/zinc/16/26/37/260162637.db2.gz UTAFKBVDBKWSII-CYBMUJFWSA-N 0 3 285.343 2.540 20 10 CFCDHN COC(=O)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000298794801 260162638 /nfs/dbraw/zinc/16/26/38/260162638.db2.gz UTAFKBVDBKWSII-CYBMUJFWSA-N 0 3 285.343 2.540 20 10 CFCDHN COc1ccc(O)c([C@H](C)N2CCOCC3(CC3)C2)c1 ZINC000368465238 261318164 /nfs/dbraw/zinc/31/81/64/261318164.db2.gz KAZUDZCBWSYIOC-LBPRGKRZSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCOCC3(CC3)C2)c1 ZINC000368465238 261318165 /nfs/dbraw/zinc/31/81/65/261318165.db2.gz KAZUDZCBWSYIOC-LBPRGKRZSA-N 0 3 277.364 2.574 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCOCC3(CC3)C2)c1 ZINC000368465238 261318168 /nfs/dbraw/zinc/31/81/68/261318168.db2.gz KAZUDZCBWSYIOC-LBPRGKRZSA-N 0 3 277.364 2.574 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1COc2ccc(F)cc2C1 ZINC000367685316 267108778 /nfs/dbraw/zinc/10/87/78/267108778.db2.gz KFVZILDIEVTVRN-CQSZACIVSA-N 0 3 291.297 2.764 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC23CCOCC3)c1 ZINC000368046093 267142107 /nfs/dbraw/zinc/14/21/07/267142107.db2.gz XIYXLVZGXXQHPG-GFCCVEGCSA-N 0 3 277.364 2.717 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC23CCOCC3)c1 ZINC000368046093 267142111 /nfs/dbraw/zinc/14/21/11/267142111.db2.gz XIYXLVZGXXQHPG-GFCCVEGCSA-N 0 3 277.364 2.717 20 10 CFCDHN CC(C)CN1CCC[N@H+](Cc2cccc(F)c2[O-])CC1 ZINC000369852990 267271887 /nfs/dbraw/zinc/27/18/87/267271887.db2.gz PPYWOKLEEYXNLW-UHFFFAOYSA-N 0 3 280.387 2.695 20 10 CFCDHN CC(C)CN1CCC[N@@H+](Cc2cccc(F)c2[O-])CC1 ZINC000369852990 267271890 /nfs/dbraw/zinc/27/18/90/267271890.db2.gz PPYWOKLEEYXNLW-UHFFFAOYSA-N 0 3 280.387 2.695 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000369888659 267274548 /nfs/dbraw/zinc/27/45/48/267274548.db2.gz OVOQEWUTMXDHAZ-OIISXLGYSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000369888659 267274550 /nfs/dbraw/zinc/27/45/50/267274550.db2.gz OVOQEWUTMXDHAZ-OIISXLGYSA-N 0 3 291.391 2.723 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccc(-n2ccnc2)nc1)c1ccccc1[O-] ZINC000370052871 267287171 /nfs/dbraw/zinc/28/71/71/267287171.db2.gz KKOVGFOMIAMGHD-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000378435860 274114788 /nfs/dbraw/zinc/11/47/88/274114788.db2.gz BEOOUNNUARLRBT-ZDUSSCGKSA-N 0 3 299.374 2.570 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000378435860 274114791 /nfs/dbraw/zinc/11/47/91/274114791.db2.gz BEOOUNNUARLRBT-ZDUSSCGKSA-N 0 3 299.374 2.570 20 10 CFCDHN CC1CCN(CC[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000295792610 275940362 /nfs/dbraw/zinc/94/03/62/275940362.db2.gz BRPOXGWZHBALHI-HNNXBMFYSA-N 0 3 274.408 2.701 20 10 CFCDHN CCN(C)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293826315 276071860 /nfs/dbraw/zinc/07/18/60/276071860.db2.gz SGBXDSWZTRSEJI-ZDUSSCGKSA-N 0 3 250.386 2.611 20 10 CFCDHN CCC(CC)(CCO)[NH2+]Cc1cccc(C)c1[O-] ZINC000282975944 276208715 /nfs/dbraw/zinc/20/87/15/276208715.db2.gz IXUPQXOWFIHUET-UHFFFAOYSA-N 0 3 251.370 2.731 20 10 CFCDHN COCCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2[O-])CC1 ZINC000186134055 277203285 /nfs/dbraw/zinc/20/32/85/277203285.db2.gz ZQBKSKSQFLOWNV-LBPRGKRZSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1cccc(CN[C@H]2CCc3c2cccc3O)c1O ZINC000105486512 278013303 /nfs/dbraw/zinc/01/33/03/278013303.db2.gz SYTWOUTYGJCGSY-AWEZNQCLSA-N 0 3 285.343 2.884 20 10 CFCDHN CC[C@H](N[C@@H](C)C[S@](C)=O)c1ccc(N(C)C)cc1 ZINC000184297909 288059810 /nfs/dbraw/zinc/05/98/10/288059810.db2.gz XGCCFZBYUUZGNK-ODYMNIRHSA-N 0 3 282.453 2.560 20 10 CFCDHN CC(C)N(C)CCC[NH2+]Cc1cccc(Cl)c1[O-] ZINC000224540079 279354709 /nfs/dbraw/zinc/35/47/09/279354709.db2.gz QRVTWILPULOOMP-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN CC(C)[N@H+](C)CCCNCc1cccc(Cl)c1[O-] ZINC000224540079 279354711 /nfs/dbraw/zinc/35/47/11/279354711.db2.gz QRVTWILPULOOMP-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN CC(C)[N@@H+](C)CCCNCc1cccc(Cl)c1[O-] ZINC000224540079 279354713 /nfs/dbraw/zinc/35/47/13/279354713.db2.gz QRVTWILPULOOMP-UHFFFAOYSA-N 0 3 270.804 2.866 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@](C)(C(=O)OC)C1 ZINC000368795931 288167526 /nfs/dbraw/zinc/16/75/26/288167526.db2.gz HQCMNUNRXJJCAX-CJNGLKHVSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@](C)(C(=O)OC)C1 ZINC000368795931 288167528 /nfs/dbraw/zinc/16/75/28/288167528.db2.gz HQCMNUNRXJJCAX-CJNGLKHVSA-N 0 3 277.364 2.728 20 10 CFCDHN C[C@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCC[C@H]1O ZINC000297640488 280160120 /nfs/dbraw/zinc/16/01/20/280160120.db2.gz JSYTXFIDOGDWNE-YSVLISHTSA-N 0 3 275.392 2.910 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000375260500 329002123 /nfs/dbraw/zinc/00/21/23/329002123.db2.gz OECTZHGBLJJMOV-GDZNZVCISA-N 0 3 291.391 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC000375260500 329002125 /nfs/dbraw/zinc/00/21/25/329002125.db2.gz OECTZHGBLJJMOV-GDZNZVCISA-N 0 3 291.391 2.963 20 10 CFCDHN CCO[C@H]1C[C@H]([NH2+]Cc2cc(OC)ccc2[O-])C12CCC2 ZINC000181966034 329238612 /nfs/dbraw/zinc/23/86/12/329238612.db2.gz FRBIUUTUOBPLGV-HOTGVXAUSA-N 0 3 291.391 2.838 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C)[C@@H]2C[C@H]2C2CC2)c1 ZINC000527659263 330273489 /nfs/dbraw/zinc/27/34/89/330273489.db2.gz IZFDWUKZXQPPSH-ONERCXAPSA-N 0 3 261.365 2.925 20 10 CFCDHN CCOc1ccc(C[NH2+]CC[C@@H]2CCCOC2)c([O-])c1 ZINC000527739906 330282606 /nfs/dbraw/zinc/28/26/06/330282606.db2.gz QAXSSHLZMIHTDM-ZDUSSCGKSA-N 0 3 279.380 2.697 20 10 CFCDHN O=C1Nc2ccccc2C[C@@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000527999697 330299836 /nfs/dbraw/zinc/29/98/36/330299836.db2.gz ONMFLIUJWGSUTM-GJZGRUSLSA-N 0 3 294.354 2.533 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000527978667 330302283 /nfs/dbraw/zinc/30/22/83/330302283.db2.gz LEBBHXZOWNUSJE-FZQKWOKYSA-N 0 3 253.317 2.749 20 10 CFCDHN COc1ccc(CNC[C@@H](O)c2ccsc2)cc1C ZINC000219101707 333141623 /nfs/dbraw/zinc/14/16/23/333141623.db2.gz LXHMONSVDVVADE-CQSZACIVSA-N 0 3 277.389 2.888 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])[C@@H]1OC ZINC000274988827 520427980 /nfs/dbraw/zinc/42/79/80/520427980.db2.gz YQYRNPWLKBUAFD-GUTXKFCHSA-N 0 3 299.798 2.636 20 10 CFCDHN CCCCOCC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000040506397 520785320 /nfs/dbraw/zinc/78/53/20/520785320.db2.gz HQDQTCURIDWGPJ-GFCCVEGCSA-N 0 3 267.369 2.868 20 10 CFCDHN CC[C@H]([NH2+]CC(O)(CC)CC)c1ccccc1[O-] ZINC000087015314 522568495 /nfs/dbraw/zinc/56/84/95/522568495.db2.gz JPYPJWRBIOJUBB-ZDUSSCGKSA-N 0 3 251.370 2.984 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc(F)ccc1[O-])CN1CCCC1 ZINC000276801849 519269452 /nfs/dbraw/zinc/26/94/52/519269452.db2.gz MQWWCSWJCMITKE-UHFFFAOYSA-N 0 3 280.387 2.743 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CCOCC)c([O-])c1 ZINC000156090107 520344224 /nfs/dbraw/zinc/34/42/24/520344224.db2.gz YMGDUCAWPIVIPX-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CCOCC)c([O-])c1 ZINC000156090107 520344228 /nfs/dbraw/zinc/34/42/28/520344228.db2.gz YMGDUCAWPIVIPX-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)C[C@@H](C)OC)c([O-])c1 ZINC000289888409 520345207 /nfs/dbraw/zinc/34/52/07/520345207.db2.gz WHSDQISDDVJDPG-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)C[C@@H](C)OC)c([O-])c1 ZINC000289888409 520345215 /nfs/dbraw/zinc/34/52/15/520345215.db2.gz WHSDQISDDVJDPG-GFCCVEGCSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](CC)C(C)(C)O)c([O-])c1 ZINC000292916074 520375592 /nfs/dbraw/zinc/37/55/92/520375592.db2.gz FVCHDUCSHQAHPR-OAHLLOKOSA-N 0 3 281.396 2.820 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])[C@H]1[C@@H]1CCCO1 ZINC000291658508 520483298 /nfs/dbraw/zinc/48/32/98/520483298.db2.gz VFHJTQBMSDAFOP-GJZGRUSLSA-N 0 3 261.365 2.782 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])[C@H]1[C@@H]1CCCO1 ZINC000291658508 520483305 /nfs/dbraw/zinc/48/33/05/520483305.db2.gz VFHJTQBMSDAFOP-GJZGRUSLSA-N 0 3 261.365 2.782 20 10 CFCDHN CCN(CC)c1ccc(CNCc2[nH]ncc2C)cc1F ZINC000289441552 520907545 /nfs/dbraw/zinc/90/75/45/520907545.db2.gz FYNMUPNXNLUTKI-UHFFFAOYSA-N 0 3 290.386 2.993 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H](CC)c1ccccc1[O-] ZINC000293613770 521000025 /nfs/dbraw/zinc/00/00/25/521000025.db2.gz FHKFETNYUKHZLM-DZGCQCFKSA-N 0 3 292.423 2.985 20 10 CFCDHN CCC(=O)N1CC[C@H]([NH2+][C@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280247422 521153586 /nfs/dbraw/zinc/15/35/86/521153586.db2.gz WJFBDGMFBKWNBI-DZGCQCFKSA-N 0 3 290.407 2.752 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2CCOC(C)(C)C2)c1 ZINC000160515563 521153800 /nfs/dbraw/zinc/15/38/00/521153800.db2.gz HQJQRMNCORHHPN-CYBMUJFWSA-N 0 3 279.380 2.838 20 10 CFCDHN CCC[C@]1([NH2+]Cc2cc(F)ccc2[O-])CCOC1 ZINC000289972767 521321580 /nfs/dbraw/zinc/32/15/80/521321580.db2.gz ZLUSHSNLISQKQV-AWEZNQCLSA-N 0 3 253.317 2.580 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(CCCO)CC2)c1[O-] ZINC000272968816 521338367 /nfs/dbraw/zinc/33/83/67/521338367.db2.gz RHUYBCGMUPFMAV-UHFFFAOYSA-N 0 3 293.407 2.775 20 10 CFCDHN CCC[N@H+](CCCCCO)Cc1ccccc1[O-] ZINC000076074072 521651963 /nfs/dbraw/zinc/65/19/63/521651963.db2.gz JCGGEGBSPVWOPZ-UHFFFAOYSA-N 0 3 251.370 2.767 20 10 CFCDHN CCC[N@@H+](CCCCCO)Cc1ccccc1[O-] ZINC000076074072 521651965 /nfs/dbraw/zinc/65/19/65/521651965.db2.gz JCGGEGBSPVWOPZ-UHFFFAOYSA-N 0 3 251.370 2.767 20 10 CFCDHN CCOC1CC(O)(C[NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])C1 ZINC000278453267 521653020 /nfs/dbraw/zinc/65/30/20/521653020.db2.gz LRZKDZHMTKKPSG-CBCUQQMYSA-N 0 3 293.407 2.590 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cc(OC)ccc1[O-] ZINC000290265687 521668817 /nfs/dbraw/zinc/66/88/17/521668817.db2.gz XDHPNQFVFYBIJN-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN CCc1nc([C@@H]2CCC[N@H+](Cc3ccccc3[O-])C2)no1 ZINC000361053750 522431823 /nfs/dbraw/zinc/43/18/23/522431823.db2.gz SPHGLBBZAYJECG-CYBMUJFWSA-N 0 3 287.363 2.717 20 10 CFCDHN CCc1nc([C@@H]2CCC[N@@H+](Cc3ccccc3[O-])C2)no1 ZINC000361053750 522431833 /nfs/dbraw/zinc/43/18/33/522431833.db2.gz SPHGLBBZAYJECG-CYBMUJFWSA-N 0 3 287.363 2.717 20 10 CFCDHN CC[C@H]([NH2+]CCCN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952058 522584856 /nfs/dbraw/zinc/58/48/56/522584856.db2.gz BTJRKOZNLKTEQL-HNNXBMFYSA-N 0 3 290.407 2.754 20 10 CFCDHN CC[C@H]([NH2+]CCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000121083500 522594371 /nfs/dbraw/zinc/59/43/71/522594371.db2.gz OVPUJOQQRLQYAR-ZDUSSCGKSA-N 0 3 294.395 2.958 20 10 CFCDHN CC[C@H]([NH2+]CCn1ccnc1C)c1ccc(C)cc1[O-] ZINC000279981362 522607673 /nfs/dbraw/zinc/60/76/73/522607673.db2.gz DQIPCHISOQWOCU-HNNXBMFYSA-N 0 3 273.380 2.946 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)N(C)C)c1ccc(C)cc1[O-] ZINC000280282292 522608034 /nfs/dbraw/zinc/60/80/34/522608034.db2.gz YQDGHXXAJZLJMS-OCCSQVGLSA-N 0 3 250.386 2.691 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000279007709 522619835 /nfs/dbraw/zinc/61/98/35/522619835.db2.gz SMPBJELHQIAFFD-ZFWWWQNUSA-N 0 3 285.391 2.892 20 10 CFCDHN CC[C@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1ccccc1[O-] ZINC000274783141 522621394 /nfs/dbraw/zinc/62/13/94/522621394.db2.gz PPORFCHAHKPOOV-CMPLNLGQSA-N 0 3 277.286 2.746 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CC[S@](C)=O)c1ccc(C)cc1[O-] ZINC000280134082 522688695 /nfs/dbraw/zinc/68/86/95/522688695.db2.gz PDGLRMXBUBLSEQ-PJFSTRORSA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CCCO)c1ccc(C)cc1[O-] ZINC000279988743 522730385 /nfs/dbraw/zinc/73/03/85/522730385.db2.gz FEOZFQCWNWQETH-OCCSQVGLSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CCN(C)C)c1ccccc1[O-] ZINC000049553309 522734190 /nfs/dbraw/zinc/73/41/90/522734190.db2.gz MUPSZENNNWUWFW-OCCSQVGLSA-N 0 3 250.386 2.773 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000280069854 522747181 /nfs/dbraw/zinc/74/71/81/522747181.db2.gz KYWCSVVZEUCGOV-ZMSDIMECSA-N 0 3 293.407 2.935 20 10 CFCDHN COc1cc(O)c(CN2CCC=C(C)C2)cc1OC ZINC000280606233 522773988 /nfs/dbraw/zinc/77/39/88/522773988.db2.gz PYHOVRJCHICRQV-UHFFFAOYSA-N 0 3 263.337 2.561 20 10 CFCDHN COc1cc([O-])c(C[NH+]2C[C@@H]3CCC[C@H]3C2)cc1OC ZINC000160389735 522776619 /nfs/dbraw/zinc/77/66/19/522776619.db2.gz AVCWZIHXRPFRJJ-RYUDHWBXSA-N 0 3 277.364 2.641 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C23CCC(CC2)C3)cc1OC ZINC000366671540 522777985 /nfs/dbraw/zinc/77/79/85/522777985.db2.gz ABQZAKCRWQQRMV-UHFFFAOYSA-N 0 3 277.364 2.832 20 10 CFCDHN CC[C@@H]([NH2+]CC1(C)OCCCO1)c1ccc(C)cc1[O-] ZINC000280134072 522817779 /nfs/dbraw/zinc/81/77/79/522817779.db2.gz PDFQGCNQJZSOBO-CQSZACIVSA-N 0 3 279.380 2.894 20 10 CFCDHN CC[C@@H]([NH2+]CCCCCO)c1ccc(C)cc1[O-] ZINC000280295711 522825743 /nfs/dbraw/zinc/82/57/43/522825743.db2.gz ZMWOKXFNIFHASH-CQSZACIVSA-N 0 3 251.370 2.904 20 10 CFCDHN CC[C@@H]([NH2+]CCn1ccnc1)c1ccc(C)cc1[O-] ZINC000279947534 522845556 /nfs/dbraw/zinc/84/55/56/522845556.db2.gz BNIFYUQHZPLGNN-CQSZACIVSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)[C@@H](CO)SC)c1ccccc1[O-] ZINC000155947795 522934800 /nfs/dbraw/zinc/93/48/00/522934800.db2.gz PGDWHCPVUMLYDZ-MPKXVKKWSA-N 0 3 269.410 2.545 20 10 CFCDHN CN(Cc1ccncc1)Cc1ccc(N2CCOCC2)cc1 ZINC000078730522 523462246 /nfs/dbraw/zinc/46/22/46/523462246.db2.gz QZKGZROBEWKDOY-UHFFFAOYSA-N 0 3 297.402 2.550 20 10 CFCDHN CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000293607611 523540238 /nfs/dbraw/zinc/54/02/38/523540238.db2.gz DVBIABFYFUBZRY-OTYXRUKQSA-N 0 3 253.317 2.607 20 10 CFCDHN CC[C@@](C)(O)C[NH2+][C@H](C)c1c(C)cc(C)cc1[O-] ZINC000284050339 523673799 /nfs/dbraw/zinc/67/37/99/523673799.db2.gz KGEQODLTXQETGY-IUODEOHRSA-N 0 3 251.370 2.821 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4cc(C)ccc4[O-])[C@H]1[C@H]3C2 ZINC000289638325 523789901 /nfs/dbraw/zinc/78/99/01/523789901.db2.gz MHHTUUXKNIQPGJ-UOYADTOYSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4cc(C)ccc4[O-])[C@H]1[C@H]3C2 ZINC000289638325 523789908 /nfs/dbraw/zinc/78/99/08/523789908.db2.gz MHHTUUXKNIQPGJ-UOYADTOYSA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@@](C)(C[NH2+][C@H]1CCc2cccc([O-])c21)C1CC1 ZINC000297467235 523800254 /nfs/dbraw/zinc/80/02/54/523800254.db2.gz YHNJJKXZWUGMPF-BBRMVZONSA-N 0 3 261.365 2.784 20 10 CFCDHN CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000293607606 523952947 /nfs/dbraw/zinc/95/29/47/523952947.db2.gz DVBIABFYFUBZRY-LKFCYVNXSA-N 0 3 253.317 2.607 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@]2(O)CCSC2)c([O-])c1 ZINC000294955683 524329652 /nfs/dbraw/zinc/32/96/52/524329652.db2.gz YRSDPABPNZOAHQ-DOMZBBRYSA-N 0 3 281.421 2.528 20 10 CFCDHN Cc1cccc(C[N@@H+](C)[C@H](CO)CC(C)C)c1[O-] ZINC000290589335 524379295 /nfs/dbraw/zinc/37/92/95/524379295.db2.gz VETFLALVCBLRRD-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc(C[N@H+](C)[C@H](CO)CC(C)C)c1[O-] ZINC000290589335 524379304 /nfs/dbraw/zinc/37/93/04/524379304.db2.gz VETFLALVCBLRRD-AWEZNQCLSA-N 0 3 251.370 2.539 20 10 CFCDHN Cc1cccc(CN[C@H]2CCCc3c[nH]nc32)c1O ZINC000271864736 524440186 /nfs/dbraw/zinc/44/01/86/524440186.db2.gz VVYJGOMWLKMBGO-ZDUSSCGKSA-N 0 3 257.337 2.591 20 10 CFCDHN Cc1cc(CN(C)C[C@@H]2CCCO2)ccc1N(C)C ZINC000293377037 524662751 /nfs/dbraw/zinc/66/27/51/524662751.db2.gz GAJNGGZTIOSIKI-HNNXBMFYSA-N 0 3 262.397 2.672 20 10 CFCDHN Cc1cc(CN(C)CCc2cnccn2)ccc1N(C)C ZINC000293868810 524662861 /nfs/dbraw/zinc/66/28/61/524662861.db2.gz SMAFZOPJFSCTRK-UHFFFAOYSA-N 0 3 284.407 2.526 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280361672 524739840 /nfs/dbraw/zinc/73/98/40/524739840.db2.gz CUJTVCJNZJGRRA-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000280361672 524739849 /nfs/dbraw/zinc/73/98/49/524739849.db2.gz CUJTVCJNZJGRRA-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCCOC(C)C)c1 ZINC000228837577 524750492 /nfs/dbraw/zinc/75/04/92/524750492.db2.gz RHKMJSCTSAIOFA-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@H](O)c2ccc(C)cc2)c1 ZINC000278742755 524752309 /nfs/dbraw/zinc/75/23/09/524752309.db2.gz RKTKSDXRKPJICX-KRWDZBQOSA-N 0 3 287.359 2.532 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CCCSC2)c1 ZINC000290190825 524754167 /nfs/dbraw/zinc/75/41/67/524754167.db2.gz OOXUUVVKIYAFEP-NSHDSACASA-N 0 3 267.394 2.634 20 10 CFCDHN C[C@@H](CO)CCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000230669792 524769492 /nfs/dbraw/zinc/76/94/92/524769492.db2.gz OAGZPWSPBNKABN-MNOVXSKESA-N 0 3 255.333 2.591 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C2CC(F)(F)C2)c1 ZINC000277000570 524769656 /nfs/dbraw/zinc/76/96/56/524769656.db2.gz AFWBABWKHGWOKA-QMMMGPOBSA-N 0 3 257.280 2.849 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CCCO2)c1[O-] ZINC000179671139 524860234 /nfs/dbraw/zinc/86/02/34/524860234.db2.gz XEIZKOFCTDAFIZ-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CCCO2)c1[O-] ZINC000179671139 524860245 /nfs/dbraw/zinc/86/02/45/524860245.db2.gz XEIZKOFCTDAFIZ-ZDUSSCGKSA-N 0 3 269.772 2.965 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)CCCO)c1ccccc1[O-] ZINC000228796464 525311292 /nfs/dbraw/zinc/31/12/92/525311292.db2.gz QYTMCOXIHHMHOT-LBPRGKRZSA-N 0 3 251.370 2.842 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](O)c2ccsc2)c1 ZINC000219094257 525349975 /nfs/dbraw/zinc/34/99/75/525349975.db2.gz PEHJMSCJFBYRTB-CQSZACIVSA-N 0 3 263.362 2.585 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CCO)C(C)C)c1 ZINC000230664122 525363024 /nfs/dbraw/zinc/36/30/24/525363024.db2.gz DWMVYDPZGUSVEL-OCCSQVGLSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)Cn2ccnc2)c1 ZINC000037158370 525365070 /nfs/dbraw/zinc/36/50/70/525365070.db2.gz SQJAZNMFIPFFSL-STQMWFEESA-N 0 3 259.353 2.636 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccccc1[O-] ZINC000278952786 525420621 /nfs/dbraw/zinc/42/06/21/525420621.db2.gz LONCYBWFWRGQJP-QWHCGFSZSA-N 0 3 271.364 2.502 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H](O)c1ccccc1 ZINC000290242838 525434709 /nfs/dbraw/zinc/43/47/09/525434709.db2.gz UUNVGLDYJWYLDT-ZBEGNZNMSA-N 0 3 275.323 2.743 20 10 CFCDHN C[C@H](N[C@@H]1CCCc2c[nH]nc21)c1ccccc1O ZINC000272846852 525562788 /nfs/dbraw/zinc/56/27/88/525562788.db2.gz KJQLNZQIMVKFNT-GXFFZTMASA-N 0 3 257.337 2.844 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cc(F)ccc1[O-] ZINC000094617421 525563868 /nfs/dbraw/zinc/56/38/68/525563868.db2.gz QGRPQTYOCRZIAZ-IINYFYTJSA-N 0 3 289.354 2.993 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)C1CCCC1)c1cc(F)ccc1[O-] ZINC000290122894 525595088 /nfs/dbraw/zinc/59/50/88/525595088.db2.gz JLCDNIIWCLOAMO-IINYFYTJSA-N 0 3 267.344 2.733 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC[C@@H](C)O)c([O-])c1C ZINC000278893892 525725771 /nfs/dbraw/zinc/72/57/71/525725771.db2.gz UIIRHONUOPFMLU-DGCLKSJQSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)c([O-])c1 ZINC000293613917 525729077 /nfs/dbraw/zinc/72/90/77/525729077.db2.gz JHNAXOJDXNTMSI-CHWSQXEVSA-N 0 3 250.386 2.549 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)Cn2cccn2)c([O-])c1C ZINC000273503764 525744440 /nfs/dbraw/zinc/74/44/40/525744440.db2.gz QPACLWZRCXLQPT-TZMCWYRMSA-N 0 3 273.380 2.945 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])cnn1C ZINC000094617581 525903861 /nfs/dbraw/zinc/90/38/61/525903861.db2.gz WBFJDLJJMCSHCB-NXEZZACHSA-N 0 3 277.343 2.985 20 10 CFCDHN COc1cccc(CN2CC(C)(C)[C@H]2[C@@H]2CCCO2)c1O ZINC000291665687 525933420 /nfs/dbraw/zinc/93/34/20/525933420.db2.gz VSHZDKQTZYXCOQ-GOEBONIOSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@@H+]2CCSCC[C@H]2C)c1[O-] ZINC000191817883 525952399 /nfs/dbraw/zinc/95/23/99/525952399.db2.gz FPESYNKFZGVUEE-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCSCC[C@H]2C)c1[O-] ZINC000191817883 525952406 /nfs/dbraw/zinc/95/24/06/525952406.db2.gz FPESYNKFZGVUEE-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[NH2+]CCCC(F)(F)F)c1[O-] ZINC000097988956 526014104 /nfs/dbraw/zinc/01/41/04/526014104.db2.gz UMJGAWMTLGULLC-UHFFFAOYSA-N 0 3 263.259 2.833 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@@H](C)[C@H](OC)C23CCC3)c1[O-] ZINC000365024309 526034130 /nfs/dbraw/zinc/03/41/30/526034130.db2.gz WWFNPVGCKKMUSB-LYRGGWFBSA-N 0 3 291.391 2.694 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)CC(C)(C)OC)c1[O-] ZINC000174556429 526035231 /nfs/dbraw/zinc/03/52/31/526035231.db2.gz STLMBNDBTUZNOP-LLVKDONJSA-N 0 3 267.369 2.694 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2C[C@@](C)(OC)C2(C)C)c1[O-] ZINC000174132951 526035255 /nfs/dbraw/zinc/03/52/55/526035255.db2.gz FEDJDHOXQNJDJK-CZUORRHYSA-N 0 3 279.380 2.694 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@@H]1c1ccncc1)OCO2 ZINC000289849423 526334653 /nfs/dbraw/zinc/33/46/53/526334653.db2.gz PYBHOKKNOOFGDN-CQSZACIVSA-N 0 3 298.342 2.853 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000278128079 526348912 /nfs/dbraw/zinc/34/89/12/526348912.db2.gz BTKQHTWJWKRQSU-HNNXBMFYSA-N 0 3 278.371 2.638 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCCOc1ccccc1 ZINC000052091970 526371506 /nfs/dbraw/zinc/37/15/06/526371506.db2.gz YLUXMENEGUPFJL-UHFFFAOYSA-N 0 3 257.333 2.951 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCc2ccccc2OC1 ZINC000365872089 526373372 /nfs/dbraw/zinc/37/33/72/526373372.db2.gz JVDVCIWYJLKTEA-HNNXBMFYSA-N 0 3 269.344 2.876 20 10 CFCDHN Cc1noc(CC[NH2+][C@H](C)c2ccc(C)c(C)c2[O-])n1 ZINC000273451675 526611079 /nfs/dbraw/zinc/61/10/79/526611079.db2.gz GCRGPGAGPUIPCO-LLVKDONJSA-N 0 3 275.352 2.594 20 10 CFCDHN Cc1ncc(C[NH2+][C@@H]2CCc3cccc([O-])c32)s1 ZINC000297544498 527277910 /nfs/dbraw/zinc/27/79/10/527277910.db2.gz FGFKPBLCQFJPDX-GFCCVEGCSA-N 0 3 260.362 2.934 20 10 CFCDHN Cn1ccnc1[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000365839259 527468472 /nfs/dbraw/zinc/46/84/72/527468472.db2.gz XTZILNKMHXDFSQ-AWEZNQCLSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000365839259 527468474 /nfs/dbraw/zinc/46/84/74/527468474.db2.gz XTZILNKMHXDFSQ-AWEZNQCLSA-N 0 3 271.364 2.505 20 10 CFCDHN COc1cccc(O)c1CNCc1ccccc1N(C)C ZINC000754349876 574090317 /nfs/dbraw/zinc/09/03/17/574090317.db2.gz PSDMDJHFBOMNIY-UHFFFAOYSA-N 0 3 286.375 2.757 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])CCC2)[C@@H]1CCSC1 ZINC000755793432 574187823 /nfs/dbraw/zinc/18/78/23/574187823.db2.gz NOBCGYPQVWJWRW-CQSZACIVSA-N 0 3 263.406 2.818 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])CCC2)[C@@H]1CCSC1 ZINC000755793432 574187824 /nfs/dbraw/zinc/18/78/24/574187824.db2.gz NOBCGYPQVWJWRW-CQSZACIVSA-N 0 3 263.406 2.818 20 10 CFCDHN Cc1cc(O)c(CNCc2cccc(F)n2)cc1C ZINC000747926401 574220620 /nfs/dbraw/zinc/22/06/20/574220620.db2.gz RXKZXXSQMYDXLD-UHFFFAOYSA-N 0 3 260.312 2.833 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](C1CC1)N(C)C)c1cc(F)ccc1[O-] ZINC000756433952 574236651 /nfs/dbraw/zinc/23/66/51/574236651.db2.gz ROUPDHJHWGTGFB-HZMBPMFUSA-N 0 3 266.360 2.522 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756455746 574238771 /nfs/dbraw/zinc/23/87/71/574238771.db2.gz KQURDJXZXCTCCF-CMPLNLGQSA-N 0 3 294.370 2.538 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H]2CCOC2)c2c1c(F)ccc2[O-] ZINC000756455634 574238867 /nfs/dbraw/zinc/23/88/67/574238867.db2.gz ASPGGOSLODWZBE-FOGDFJRCSA-N 0 3 265.328 2.706 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756508301 574242784 /nfs/dbraw/zinc/24/27/84/574242784.db2.gz HNJJJAVSPHUYAU-GWCFXTLKSA-N 0 3 289.354 2.874 20 10 CFCDHN C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)N(C)C ZINC000756537012 574244506 /nfs/dbraw/zinc/24/45/06/574244506.db2.gz YVJBJGMCSSAHIN-FOGDFJRCSA-N 0 3 266.360 2.619 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCN(C3CC3)C2)c2c1c(F)ccc2[O-] ZINC000756532805 574244520 /nfs/dbraw/zinc/24/45/20/574244520.db2.gz GJMNDPWVOWNPIS-JTNHKYCSSA-N 0 3 290.382 2.906 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c1 ZINC000756548595 574245814 /nfs/dbraw/zinc/24/58/14/574245814.db2.gz AJZJZZGGBPQANH-OCCSQVGLSA-N 0 3 290.407 2.536 20 10 CFCDHN C[C@@H](NCc1cc[nH]n1)c1ccc(Br)cc1O ZINC000756553415 574246870 /nfs/dbraw/zinc/24/68/70/574246870.db2.gz KWUXPTLRPGRUBE-MRVPVSSYSA-N 0 3 296.168 2.729 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(Br)cc1[O-] ZINC000756553415 574246871 /nfs/dbraw/zinc/24/68/71/574246871.db2.gz KWUXPTLRPGRUBE-MRVPVSSYSA-N 0 3 296.168 2.729 20 10 CFCDHN CSC[C@@H](CCO)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756603002 574251806 /nfs/dbraw/zinc/25/18/06/574251806.db2.gz HLSFLYPWMSIIBS-CHWSQXEVSA-N 0 3 283.437 2.774 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CCC[C@H]2C)c1 ZINC000756615684 574252464 /nfs/dbraw/zinc/25/24/64/574252464.db2.gz FNTSEXDWDWOXQH-KGLIPLIRSA-N 0 3 262.397 2.836 20 10 CFCDHN C[C@@H]([NH2+]CCN1CC[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000756628456 574253568 /nfs/dbraw/zinc/25/35/68/574253568.db2.gz MHCVQYFDCDPJCL-NWDGAFQWSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCNc2ncccn2)c([O-])c1 ZINC000756642700 574254426 /nfs/dbraw/zinc/25/44/26/574254426.db2.gz QXTDRSNUTLNJJM-ZDUSSCGKSA-N 0 3 286.379 2.643 20 10 CFCDHN C[C@H](CCCO)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756647971 574255333 /nfs/dbraw/zinc/25/53/33/574255333.db2.gz URGQMKOIEPTCST-UMNHJUIQSA-N 0 3 267.344 2.830 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756659230 574255656 /nfs/dbraw/zinc/25/56/56/574255656.db2.gz PVPBKRZCJKXVQP-JBLDHEPKSA-N 0 3 267.344 2.830 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](CO)Cc1ccco1)c1cc(F)ccc1[O-] ZINC000756661187 574256338 /nfs/dbraw/zinc/25/63/38/574256338.db2.gz PLJLVGNVHZBDBY-VXGBXAGGSA-N 0 3 293.338 2.626 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC1)c1cc2c(cc1[O-])CCCC2 ZINC000756768815 574261329 /nfs/dbraw/zinc/26/13/29/574261329.db2.gz NISWLCACYIXULD-ZDUSSCGKSA-N 0 3 274.408 2.627 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H](CO)CC2CC2)c2c1c(F)ccc2[O-] ZINC000756770479 574261842 /nfs/dbraw/zinc/26/18/42/574261842.db2.gz XTBLTPTZUFGPKW-IRUJWGPZSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)C(C)(C)O ZINC000756816818 574265284 /nfs/dbraw/zinc/26/52/84/574265284.db2.gz ARRSWYXKGIGVKN-FXPVBKGRSA-N 0 3 267.344 2.829 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H](O)c2ccc(C)o2)c([O-])c1 ZINC000741261908 574285285 /nfs/dbraw/zinc/28/52/85/574285285.db2.gz RSKUDLOPHBZAOR-HNNXBMFYSA-N 0 3 291.347 2.516 20 10 CFCDHN CC[C@H](C[C@H](C)CO)[NH2+]Cc1cc(C)ccc1[O-] ZINC000743499674 574307473 /nfs/dbraw/zinc/30/74/73/574307473.db2.gz OHWIPFHDPWJLOU-GXTWGEPZSA-N 0 3 251.370 2.587 20 10 CFCDHN CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000743500268 574367278 /nfs/dbraw/zinc/36/72/78/574367278.db2.gz VGPAJCXCSWEBEK-ABAIWWIYSA-N 0 3 265.397 2.896 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](CC)C[C@@H](C)CO)c1[O-] ZINC000743499991 574367452 /nfs/dbraw/zinc/36/74/52/574367452.db2.gz SJTJOJNRSVRDSG-OCCSQVGLSA-N 0 3 281.396 2.678 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](CO)C2CCCC2)c1[O-] ZINC000811518897 617638491 /nfs/dbraw/zinc/63/84/91/617638491.db2.gz QVHKYUNYXINMHW-CQSZACIVSA-N 0 3 283.799 2.995 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(C)CCCO1)c1cc(F)ccc1[O-] ZINC000094798224 617858930 /nfs/dbraw/zinc/85/89/30/617858930.db2.gz FASZKKCFJXYHQP-HZMBPMFUSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1noc(C)c1[C@H](C)NCc1cc2c(cc1O)OCO2 ZINC000078679825 617989660 /nfs/dbraw/zinc/98/96/60/617989660.db2.gz REHNWWFDCFCYIV-QMMMGPOBSA-N 0 3 290.319 2.577 20 10 CFCDHN CC[C@@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC000891251208 618082549 /nfs/dbraw/zinc/08/25/49/618082549.db2.gz AVAUFYXYTCMNDJ-CZUORRHYSA-N 0 3 291.439 2.518 20 10 CFCDHN C[C@](CO)(NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000169268242 618207557 /nfs/dbraw/zinc/20/75/57/618207557.db2.gz WGHDTUFQFXVREU-GOSISDBHSA-N 0 3 283.371 2.619 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCCC[C@@H]2CO)c([O-])c1 ZINC000895151481 618393665 /nfs/dbraw/zinc/39/36/65/618393665.db2.gz JSXPTMMOSQFKSD-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCCC[C@@H]2CO)c([O-])c1 ZINC000895151481 618393671 /nfs/dbraw/zinc/39/36/71/618393671.db2.gz JSXPTMMOSQFKSD-CQSZACIVSA-N 0 3 279.380 2.528 20 10 CFCDHN Oc1cccc2c1CN(Cc1cccc3c1CCOC3)C2 ZINC000895450011 618592429 /nfs/dbraw/zinc/59/24/29/618592429.db2.gz RSFQAKPIEXMBKH-UHFFFAOYSA-N 0 3 281.355 2.981 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(OC)c1[O-])[C@H]1CCOC1 ZINC000311443723 618712378 /nfs/dbraw/zinc/71/23/78/618712378.db2.gz HEGISRYWWAWHGS-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(OC)c1[O-])[C@H]1CCOC1 ZINC000311443723 618712379 /nfs/dbraw/zinc/71/23/79/618712379.db2.gz HEGISRYWWAWHGS-LBPRGKRZSA-N 0 3 285.771 2.665 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](CO)C2)c([O-])c1 ZINC000311717319 618720449 /nfs/dbraw/zinc/72/04/49/618720449.db2.gz TYIQQNLIBBLNOP-MJBXVCDLSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCN(CC3CC3)C2)c(Cl)c1 ZINC000840896522 618813945 /nfs/dbraw/zinc/81/39/45/618813945.db2.gz IGWJEUZXYQPWNN-CYBMUJFWSA-N 0 3 294.826 2.928 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCCCC1=O)c1ccccc1[O-] ZINC000183381907 618905681 /nfs/dbraw/zinc/90/56/81/618905681.db2.gz XNVBTPKLTURGCL-AWEZNQCLSA-N 0 3 290.407 2.836 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC1=Cc2ccccc2OC1 ZINC000726605711 619253148 /nfs/dbraw/zinc/25/31/48/619253148.db2.gz HCUVDAHLNPTKEN-UHFFFAOYSA-N 0 3 267.328 2.958 20 10 CFCDHN CC[C@@H](CSC)[N@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000894497196 619400768 /nfs/dbraw/zinc/40/07/68/619400768.db2.gz VMAPZIIQNJURTQ-LBPRGKRZSA-N 0 3 299.436 2.983 20 10 CFCDHN CC[C@@H](CSC)[N@@H+](C)Cc1ccc(OC)c(OC)c1[O-] ZINC000894497196 619400770 /nfs/dbraw/zinc/40/07/70/619400770.db2.gz VMAPZIIQNJURTQ-LBPRGKRZSA-N 0 3 299.436 2.983 20 10 CFCDHN C[C@]1(Br)C[C@H]1CN1Cc2cccc(O)c2C1 ZINC000895786063 619606682 /nfs/dbraw/zinc/60/66/82/619606682.db2.gz WXKRQUKEDFYQSF-GWCFXTLKSA-N 0 3 282.181 2.881 20 10 CFCDHN C[C@@]1(Br)C[C@@H]1CN1Cc2cccc(O)c2C1 ZINC000895786074 619606720 /nfs/dbraw/zinc/60/67/20/619606720.db2.gz WXKRQUKEDFYQSF-ZWNOBZJWSA-N 0 3 282.181 2.881 20 10 CFCDHN COc1ccc(CNCc2ccc(C)o2)c(O)c1OC ZINC000895771047 619603391 /nfs/dbraw/zinc/60/33/91/619603391.db2.gz UBJLRCLTJQAYNX-UHFFFAOYSA-N 0 3 277.320 2.601 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCC2(C[C@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852379 619622941 /nfs/dbraw/zinc/62/29/41/619622941.db2.gz UNBQSIFPHWOVEO-BNOWGMLFSA-N 0 3 295.354 2.677 20 10 CFCDHN CCn1cc(C[NH2+][C@H](C)c2ccccc2[O-])c(C)n1 ZINC000895852639 619623364 /nfs/dbraw/zinc/62/33/64/619623364.db2.gz YMBCFTQUJRIYQK-GFCCVEGCSA-N 0 3 259.353 2.768 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC1(C2(O)CCC2)CCC1 ZINC000895869175 619626415 /nfs/dbraw/zinc/62/64/15/619626415.db2.gz CDBORFKVMVPASU-UHFFFAOYSA-N 0 3 261.365 2.567 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](CO)CCc1ccccc1 ZINC000896523662 619756080 /nfs/dbraw/zinc/75/60/80/619756080.db2.gz PTDBENLGGKXTCN-MRXNPFEDSA-N 0 3 289.350 2.615 20 10 CFCDHN CCc1cccc(CNCc2cc(C3CC3)nn2C)c1O ZINC000897224232 619953728 /nfs/dbraw/zinc/95/37/28/619953728.db2.gz KWWREDJXGUEDPE-UHFFFAOYSA-N 0 3 285.391 2.855 20 10 CFCDHN CCc1onc(C)c1CNCc1cc(C)cc(OC)c1O ZINC000897336693 619999808 /nfs/dbraw/zinc/99/98/08/619999808.db2.gz LQOXVNPALLGWSQ-UHFFFAOYSA-N 0 3 290.363 2.858 20 10 CFCDHN Cc1ccc(C[NH2+]C2([C@H]3CCCCO3)CC2)c([O-])c1 ZINC000897387046 620089478 /nfs/dbraw/zinc/08/94/78/620089478.db2.gz BLOWBHYMSSBHCY-OAHLLOKOSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000897534365 620221515 /nfs/dbraw/zinc/22/15/15/620221515.db2.gz UEPFDXSVIGLMNB-ZFWWWQNUSA-N 0 3 263.381 2.731 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C1(c2ccc3c(c2)OCCO3)CC1 ZINC000897862705 620294992 /nfs/dbraw/zinc/29/49/92/620294992.db2.gz OXIGFIIDLMWHBD-UHFFFAOYSA-N 0 3 297.354 2.942 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]23C[C@H]2COC32CCC2)c([O-])c1 ZINC000898060759 620329657 /nfs/dbraw/zinc/32/96/57/620329657.db2.gz HQVFNZMYMFUARN-GOEBONIOSA-N 0 3 273.376 2.749 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CCOC23CCCC3)c([O-])c1 ZINC000898113279 620335979 /nfs/dbraw/zinc/33/59/79/620335979.db2.gz WOBLXKFDQMNVJA-INIZCTEOSA-N 0 3 291.391 2.982 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCOC12CCOCC2)c1ccccc1[O-] ZINC000898116642 620336181 /nfs/dbraw/zinc/33/61/81/620336181.db2.gz TZFGAQDNGYLZPM-GDBMZVCRSA-N 0 3 291.391 2.771 20 10 CFCDHN COC(=O)C1(CCCC[NH2+]Cc2ccccc2[O-])CCC1 ZINC000898413286 620459973 /nfs/dbraw/zinc/45/99/73/620459973.db2.gz SKBFEHJMJBMBJC-UHFFFAOYSA-N 0 3 291.391 2.995 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1NCCc2ccccc21 ZINC000841069463 620491663 /nfs/dbraw/zinc/49/16/63/620491663.db2.gz XAZUXNPOHNXWAE-INIZCTEOSA-N 0 3 286.350 2.508 20 10 CFCDHN C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1N)c1cc(F)ccc1[O-] ZINC000902440514 621080521 /nfs/dbraw/zinc/08/05/21/621080521.db2.gz YWHIEJHDCVLDMK-UDTVLSCZSA-N 0 3 286.350 2.807 20 10 CFCDHN CC[C@@H](N[C@@H]1C[NH2+]CC1(C)C)c1ccc(F)cc1[O-] ZINC000902445266 621082858 /nfs/dbraw/zinc/08/28/58/621082858.db2.gz PQDFLKDYXWTKCV-TZMCWYRMSA-N 0 3 266.360 2.570 20 10 CFCDHN CCN(CC)c1ccc(CN[C@H]2CNCCC2(F)F)cc1 ZINC000841075691 621280204 /nfs/dbraw/zinc/28/02/04/621280204.db2.gz UVNHUXPEFNMIJA-HNNXBMFYSA-N 0 3 297.393 2.620 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccccc1[O-] ZINC000903263807 621304007 /nfs/dbraw/zinc/30/40/07/621304007.db2.gz LMPXHQUCJRKVOU-YDHLFZDLSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[C@H](NCc1cn(C)cn1)c1ccc(C)cc1O ZINC000903351192 621343318 /nfs/dbraw/zinc/34/33/18/621343318.db2.gz IQEPOHCHBLZGII-AWEZNQCLSA-N 0 3 259.353 2.675 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2COC[C@H]2C)c2c1c(F)ccc2[O-] ZINC000903397771 621350254 /nfs/dbraw/zinc/35/02/54/621350254.db2.gz ZISCDPAQVKFXBA-LSKIRQOJSA-N 0 3 265.328 2.704 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1Cc3ccccc3[C@@H]1O)CC2 ZINC000903440598 621377069 /nfs/dbraw/zinc/37/70/69/621377069.db2.gz RAZHOOKRDYUJLL-VKJFTORMSA-N 0 3 281.355 2.627 20 10 CFCDHN C[C@@H]([NH2+]CCc1cn2ccccc2n1)c1ccccc1[O-] ZINC000183405305 625487382 /nfs/dbraw/zinc/48/73/82/625487382.db2.gz QZMBOSQQRTZSOB-CYBMUJFWSA-N 0 3 281.359 2.933 20 10 CFCDHN Oc1cc2c(cc1CNCc1ccccc1F)OCO2 ZINC000042879282 621544868 /nfs/dbraw/zinc/54/48/68/621544868.db2.gz CGKAMBOXEJJRFY-UHFFFAOYSA-N 0 3 275.279 2.550 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@]2(C1)CCCC[NH2+]2 ZINC000904431508 621595408 /nfs/dbraw/zinc/59/54/08/621595408.db2.gz VLAMNDRIJUJAOE-HNNXBMFYSA-N 0 3 280.799 2.764 20 10 CFCDHN C[C@H]([NH2+]CCCC(C)(C)CO)c1ccccc1[O-] ZINC000183528127 625514641 /nfs/dbraw/zinc/51/46/41/625514641.db2.gz YQUUOHVUOUOGCM-LBPRGKRZSA-N 0 3 251.370 2.842 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1Cc2ccccc21 ZINC000226606862 623083402 /nfs/dbraw/zinc/08/34/02/623083402.db2.gz DQDAGWAYBCXTBG-LBPRGKRZSA-N 0 3 257.308 2.961 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1ccccc1[O-] ZINC000226867504 623092591 /nfs/dbraw/zinc/09/25/91/623092591.db2.gz JPRVOMIVLCMHQA-GUTXKFCHSA-N 0 3 262.397 2.916 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000168937927 623109998 /nfs/dbraw/zinc/10/99/98/623109998.db2.gz QDZRQWYLXWSMOB-IMJJTQAJSA-N 0 3 273.376 2.830 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](C)SC)c1[O-] ZINC000169092399 623112486 /nfs/dbraw/zinc/11/24/86/623112486.db2.gz GMVOMZPOXSRXKI-QMMMGPOBSA-N 0 3 275.801 2.895 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C2(CO)CCCCC2)c1[O-] ZINC000229051703 623180532 /nfs/dbraw/zinc/18/05/32/623180532.db2.gz NXHLEYLVSZIONS-UHFFFAOYSA-N 0 3 299.798 2.839 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000229312784 623197152 /nfs/dbraw/zinc/19/71/52/623197152.db2.gz RSURNHCUQNICTI-CQSZACIVSA-N 0 3 261.365 2.974 20 10 CFCDHN C[C@@H]1CC[C@@H](C[NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000230402260 623274896 /nfs/dbraw/zinc/27/48/96/623274896.db2.gz NXLGGULLOGFHFM-GHMZBOCLSA-N 0 3 263.337 2.647 20 10 CFCDHN CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1(C)C ZINC000230665883 623289650 /nfs/dbraw/zinc/28/96/50/623289650.db2.gz WPUIUIWGUOULFR-CUOATXAZSA-N 0 3 267.344 2.995 20 10 CFCDHN Cc1cc([O-])c(CN2CCC([NH+](C)C)CC2)cc1Cl ZINC000824575717 623525976 /nfs/dbraw/zinc/52/59/76/623525976.db2.gz NVRLIWLKCKUYPK-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2ccnc(C)c2)c([O-])c1 ZINC000824597895 623529887 /nfs/dbraw/zinc/52/98/87/623529887.db2.gz ZQZWPMMTPRILKE-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN CCCN(Cc1cnc(C)n1C)Cc1ccccc1O ZINC000824649548 623538914 /nfs/dbraw/zinc/53/89/14/623538914.db2.gz DQXINRUERJTXFN-UHFFFAOYSA-N 0 3 273.380 2.846 20 10 CFCDHN COc1cccc2c1CN(Cc1ccccc1O)CC2 ZINC000824983151 623599564 /nfs/dbraw/zinc/59/95/64/623599564.db2.gz RJXMDKXIESXEGV-UHFFFAOYSA-N 0 3 269.344 2.959 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)Cc1cnn(C)c1)c1ccccc1[O-] ZINC000825046217 623615560 /nfs/dbraw/zinc/61/55/60/623615560.db2.gz QVJGUNCAVIMNBS-WFASDCNBSA-N 0 3 273.380 2.798 20 10 CFCDHN CO[C@H]1C[C@H]([N@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104067 623631380 /nfs/dbraw/zinc/63/13/80/623631380.db2.gz LYXMHSSYMXRVOF-GJZGRUSLSA-N 0 3 261.365 2.782 20 10 CFCDHN CO[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2[O-])C12CCC2 ZINC000825104067 623631383 /nfs/dbraw/zinc/63/13/83/623631383.db2.gz LYXMHSSYMXRVOF-GJZGRUSLSA-N 0 3 261.365 2.782 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@@H]1C[C@H](OC)C12CCC2 ZINC000825104379 623631721 /nfs/dbraw/zinc/63/17/21/623631721.db2.gz VTDMUJJAYGFZGT-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@@H]1C[C@H](OC)C12CCC2 ZINC000825104379 623631723 /nfs/dbraw/zinc/63/17/23/623631723.db2.gz VTDMUJJAYGFZGT-CVEARBPZSA-N 0 3 291.391 2.790 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000185030402 625675468 /nfs/dbraw/zinc/67/54/68/625675468.db2.gz AGLIIGCKRUGHQH-AWEZNQCLSA-N 0 3 292.423 3.000 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827699662 624069098 /nfs/dbraw/zinc/06/90/98/624069098.db2.gz KVXVAYSSJYEWNO-XHDPSFHLSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)[C@@](C)(CO)C2)c1[O-] ZINC000827699662 624069103 /nfs/dbraw/zinc/06/91/03/624069103.db2.gz KVXVAYSSJYEWNO-XHDPSFHLSA-N 0 3 283.799 2.804 20 10 CFCDHN C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000827733846 624079176 /nfs/dbraw/zinc/07/91/76/624079176.db2.gz PSCHLICPJLPMSR-SJKOYZFVSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000827733844 624079651 /nfs/dbraw/zinc/07/96/51/624079651.db2.gz PSCHLICPJLPMSR-PXAZEXFGSA-N 0 3 289.350 2.786 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000827751922 624085768 /nfs/dbraw/zinc/08/57/68/624085768.db2.gz YVLKULSLRWEPJZ-GDBMZVCRSA-N 0 3 295.354 2.743 20 10 CFCDHN COc1cccc(O)c1CN(C)CC1=CCSC1 ZINC000827806652 624098459 /nfs/dbraw/zinc/09/84/59/624098459.db2.gz UTQZHWUDBDZABL-UHFFFAOYSA-N 0 3 265.378 2.506 20 10 CFCDHN COc1cccc(O)c1CN[C@@H](c1ccccc1)[C@H](C)O ZINC000827855429 624111890 /nfs/dbraw/zinc/11/18/90/624111890.db2.gz CUFUYBXEWBZQQT-YVEFUNNKSA-N 0 3 287.359 2.613 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)c1ccccc1F)CC2 ZINC000834526748 625702237 /nfs/dbraw/zinc/70/22/37/625702237.db2.gz OLEWNFIDTRCDLX-ZBFHGGJFSA-N 0 3 287.334 2.842 20 10 CFCDHN CC1(C)Cc2n[nH]cc2C[N@@H+](Cc2ccccc2[O-])C1 ZINC000828014014 624154686 /nfs/dbraw/zinc/15/46/86/624154686.db2.gz QWKQANBBPKVEHK-UHFFFAOYSA-N 0 3 271.364 2.700 20 10 CFCDHN CC1(C)Cc2n[nH]cc2C[N@H+](Cc2ccccc2[O-])C1 ZINC000828014014 624154687 /nfs/dbraw/zinc/15/46/87/624154687.db2.gz QWKQANBBPKVEHK-UHFFFAOYSA-N 0 3 271.364 2.700 20 10 CFCDHN C[C@@H]([NH2+]CCOC1CCSCC1)c1ccccc1[O-] ZINC000930201943 624297871 /nfs/dbraw/zinc/29/78/71/624297871.db2.gz NJAOJOKGOHGPFQ-GFCCVEGCSA-N 0 3 281.421 2.955 20 10 CFCDHN COC(=O)CC[N@@H+](Cc1cc(F)ccc1[O-])CC(C)C ZINC000179941965 624985630 /nfs/dbraw/zinc/98/56/30/624985630.db2.gz OLURXMXPTFGTMQ-UHFFFAOYSA-N 0 3 283.343 2.552 20 10 CFCDHN COC(=O)CC[N@H+](Cc1cc(F)ccc1[O-])CC(C)C ZINC000179941965 624985632 /nfs/dbraw/zinc/98/56/32/624985632.db2.gz OLURXMXPTFGTMQ-UHFFFAOYSA-N 0 3 283.343 2.552 20 10 CFCDHN C[C@H](C[C@H](O)c1ccco1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180900912 625047732 /nfs/dbraw/zinc/04/77/32/625047732.db2.gz OYXIEXQZABNQMA-YGRLFVJLSA-N 0 3 279.311 2.726 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1[O-])N(C)C1CC1 ZINC000185369490 625720385 /nfs/dbraw/zinc/72/03/85/625720385.db2.gz MMVAVKNNJIJYOH-MNOVXSKESA-N 0 3 266.360 2.665 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2cccc([O-])c21)c1cc[nH]c(=O)c1 ZINC000834810226 625870868 /nfs/dbraw/zinc/87/08/68/625870868.db2.gz ALOKAZSMIAKIBS-ZWNOBZJWSA-N 0 3 270.332 2.831 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CC)[C@H](C)O)c1ccc(C)cc1[O-] ZINC000834888477 625910670 /nfs/dbraw/zinc/91/06/70/625910670.db2.gz PPJLUSIWYWZFDN-UBHSHLNASA-N 0 3 251.370 2.901 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)Cc1cnn(C)c1)c1cc(F)ccc1[O-] ZINC000834896692 625913456 /nfs/dbraw/zinc/91/34/56/625913456.db2.gz MPZYZLATRZKLSL-WDEREUQCSA-N 0 3 277.343 2.547 20 10 CFCDHN CNC(=O)C[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834900186 625915901 /nfs/dbraw/zinc/91/59/01/625915901.db2.gz NCHRCEULVYOVAU-ZJUUUORDSA-N 0 3 284.787 2.529 20 10 CFCDHN CCO[C@@H]1COC[C@H]1[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834902519 625916347 /nfs/dbraw/zinc/91/63/47/625916347.db2.gz CFPYCYBRTGKIPF-ZLKJLUDKSA-N 0 3 299.798 2.809 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000834914565 625921285 /nfs/dbraw/zinc/92/12/85/625921285.db2.gz OBUFMYOSWUTKKO-ZDDJMSTPSA-N 0 3 265.328 2.583 20 10 CFCDHN CC(C)(C)[S@](=O)CCNCc1ccc2c(c1)CCCO2 ZINC000921752491 626106873 /nfs/dbraw/zinc/10/68/73/626106873.db2.gz SOCVMEWWIZPJLS-HXUWFJFHSA-N 0 3 295.448 2.648 20 10 CFCDHN c1cc(N2CCCCC2)ccc1CNCC1OCCCO1 ZINC000922278133 626258391 /nfs/dbraw/zinc/25/83/91/626258391.db2.gz SFXJJLAGHPSIEY-UHFFFAOYSA-N 0 3 290.407 2.530 20 10 CFCDHN COc1ccc(CNCc2nccc3c2CCCC3)c(O)c1 ZINC000922467639 626293059 /nfs/dbraw/zinc/29/30/59/626293059.db2.gz ZLZFFRPSTDZXMZ-UHFFFAOYSA-N 0 3 298.386 2.964 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000922732730 626355267 /nfs/dbraw/zinc/35/52/67/626355267.db2.gz VNSOOJIPJSCDME-WCBMZHEXSA-N 0 3 275.270 2.689 20 10 CFCDHN Cc1cc(O)c(CNCc2cc(C3CC3)nn2C)cc1C ZINC000922946851 626430284 /nfs/dbraw/zinc/43/02/84/626430284.db2.gz BBRSHACKJMSABC-UHFFFAOYSA-N 0 3 285.391 2.910 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+][C@H]1C[C@H](CO)C1 ZINC000923007277 626441382 /nfs/dbraw/zinc/44/13/82/626441382.db2.gz IROKXKNLKYOJCI-WJYNOGRTSA-N 0 3 283.371 2.920 20 10 CFCDHN C[C@H](O)CCC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000788605310 626483634 /nfs/dbraw/zinc/48/36/34/626483634.db2.gz OWGCVMJLOYIVEK-NHCYSSNCSA-N 0 3 267.344 2.830 20 10 CFCDHN CCC1(CC)CN(Cc2cc3c(cc2O)OCO3)C1 ZINC000839132045 626527985 /nfs/dbraw/zinc/52/79/85/626527985.db2.gz IWMWXXBFZKQXQY-UHFFFAOYSA-N 0 3 263.337 2.743 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC3(C2)CCCOC3)c1O ZINC000839139138 626528289 /nfs/dbraw/zinc/52/82/89/626528289.db2.gz XZBMUGVSHWJHNV-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCC2(C)OCCO2)c2c1c(F)ccc2[O-] ZINC000760892582 626782320 /nfs/dbraw/zinc/78/23/20/626782320.db2.gz YXZNCHROIMHEDS-ZYHUDNBSSA-N 0 3 295.354 2.822 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC3(CCCC3)C1)[C@H](O)CO2 ZINC000768465496 627345425 /nfs/dbraw/zinc/34/54/25/627345425.db2.gz IEQKPRYRPMJLJV-OAHLLOKOSA-N 0 3 289.375 2.584 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC3(CCCC3)C1)[C@H](O)CO2 ZINC000768465496 627345426 /nfs/dbraw/zinc/34/54/26/627345426.db2.gz IEQKPRYRPMJLJV-OAHLLOKOSA-N 0 3 289.375 2.584 20 10 CFCDHN COc1cccc(O)c1CNCc1ccnc(SC)c1 ZINC000771895373 627644865 /nfs/dbraw/zinc/64/48/65/627644865.db2.gz NLJYHKRCSJIRKR-UHFFFAOYSA-N 0 3 290.388 2.808 20 10 CFCDHN C=Cn1cc(CN[C@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000775015705 627984933 /nfs/dbraw/zinc/98/49/33/627984933.db2.gz ZZPVYOXJBOVYPX-CYBMUJFWSA-N 0 3 270.380 2.900 20 10 CFCDHN CC[C@@H]([NH2+]C1CCC(C(=O)NC)CC1)c1ccccc1[O-] ZINC000775495826 628031547 /nfs/dbraw/zinc/03/15/47/628031547.db2.gz CNKIWWXIATVEPM-SSDMNJCBSA-N 0 3 290.407 2.738 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@H]1C)c1ccccc1[O-] ZINC000775512608 628032849 /nfs/dbraw/zinc/03/28/49/628032849.db2.gz LHGDZBJEHRMHBT-UHOFOFEASA-N 0 3 274.408 2.916 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1[O-] ZINC000775512606 628032986 /nfs/dbraw/zinc/03/29/86/628032986.db2.gz LHGDZBJEHRMHBT-RCBQFDQVSA-N 0 3 274.408 2.916 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CCO)CC2CC2)c1[O-] ZINC000775662730 628051144 /nfs/dbraw/zinc/05/11/44/628051144.db2.gz VZNSBJIHBXKRGA-UHFFFAOYSA-N 0 3 269.772 2.558 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CCO)CC2CC2)c1[O-] ZINC000775662730 628051150 /nfs/dbraw/zinc/05/11/50/628051150.db2.gz VZNSBJIHBXKRGA-UHFFFAOYSA-N 0 3 269.772 2.558 20 10 CFCDHN CCN1C[C@H](C)[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000775713979 628058681 /nfs/dbraw/zinc/05/86/81/628058681.db2.gz XZUWOIZMWKVMOE-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN CCN1C[C@H](C)[N@@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000775713979 628058684 /nfs/dbraw/zinc/05/86/84/628058684.db2.gz XZUWOIZMWKVMOE-RYUDHWBXSA-N 0 3 282.815 2.960 20 10 CFCDHN COC(=O)/C(C)=C\CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775836630 628074222 /nfs/dbraw/zinc/07/42/22/628074222.db2.gz OQMKKBRYDVVXGL-KXXVWKPMSA-N 0 3 276.380 2.523 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@H](C)N(C)C[C@@H]2C)c1O ZINC000775985512 628091140 /nfs/dbraw/zinc/09/11/40/628091140.db2.gz LZBWYEVTCWVRMP-QWRGUYRKSA-N 0 3 298.814 2.579 20 10 CFCDHN COc1ccc(O)c(CNCc2ccnc(SC)c2)c1 ZINC000777506715 628231142 /nfs/dbraw/zinc/23/11/42/628231142.db2.gz NYUBNTPEGXMKQS-UHFFFAOYSA-N 0 3 290.388 2.808 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCO[C@@H](C(C)C)C2)c1 ZINC000777969557 628269296 /nfs/dbraw/zinc/26/92/96/628269296.db2.gz SEXHWPJCUMJPEO-OAHLLOKOSA-N 0 3 263.381 2.866 20 10 CFCDHN CSC[C@H](O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000778088909 628277013 /nfs/dbraw/zinc/27/70/13/628277013.db2.gz MSWOUUHIDTWINW-OAHLLOKOSA-N 0 3 295.448 2.861 20 10 CFCDHN CSC[C@H](O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000778088909 628277016 /nfs/dbraw/zinc/27/70/16/628277016.db2.gz MSWOUUHIDTWINW-OAHLLOKOSA-N 0 3 295.448 2.861 20 10 CFCDHN C[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccncc1 ZINC000779088850 628351460 /nfs/dbraw/zinc/35/14/60/628351460.db2.gz WMYIRSPCYLLGSL-NSHDSACASA-N 0 3 260.312 2.820 20 10 CFCDHN CC(C)[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000780499808 628469824 /nfs/dbraw/zinc/46/98/24/628469824.db2.gz UAMRXMFPMYJHPM-WBMJQRKESA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000780499808 628469826 /nfs/dbraw/zinc/46/98/26/628469826.db2.gz UAMRXMFPMYJHPM-WBMJQRKESA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)Cc1ccccc1)c1ccccc1[O-] ZINC000783504881 628713897 /nfs/dbraw/zinc/71/38/97/628713897.db2.gz PCGYGNJSDJVXDM-ZBFHGGJFSA-N 0 3 285.387 2.894 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@H](C)c2ccccc2[O-])n1 ZINC000783518718 628715586 /nfs/dbraw/zinc/71/55/86/628715586.db2.gz NWOCRICSFLVXIW-CYBMUJFWSA-N 0 3 271.364 2.858 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2(N(C)C)CCC2)c1[O-] ZINC000783730120 628738574 /nfs/dbraw/zinc/73/85/74/628738574.db2.gz QGKKCPPWIYNLED-UHFFFAOYSA-N 0 3 282.815 2.928 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC(C)(C)C1 ZINC000784008274 628762216 /nfs/dbraw/zinc/76/22/16/628762216.db2.gz NLGPYLPWKOCUGF-NHYWBVRUSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)CC(C)(C)C1 ZINC000784008274 628762220 /nfs/dbraw/zinc/76/22/20/628762220.db2.gz NLGPYLPWKOCUGF-NHYWBVRUSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H](NCc1ccnc(N)c1)c1ccc(N(C)C)cc1 ZINC000785807390 628914307 /nfs/dbraw/zinc/91/43/07/628914307.db2.gz HVOVZRSDBJEGTQ-GFCCVEGCSA-N 0 3 270.380 2.581 20 10 CFCDHN CN(C)c1ccc(/C=C\CN(C)CCn2cccn2)cc1 ZINC000835028500 629323101 /nfs/dbraw/zinc/32/31/01/629323101.db2.gz KRXKPNKHNICIQO-XQRVVYSFSA-N 0 3 284.407 2.594 20 10 CFCDHN CN(C)c1ccc(/C=C/CN(C)CCn2cccn2)cc1 ZINC000835028210 629324262 /nfs/dbraw/zinc/32/42/62/629324262.db2.gz KRXKPNKHNICIQO-GQCTYLIASA-N 0 3 284.407 2.594 20 10 CFCDHN C[C@H](NC/C=C\c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000835041041 629334739 /nfs/dbraw/zinc/33/47/39/629334739.db2.gz IUBHEMKODZSRKT-ZFDPJTLLSA-N 0 3 270.380 2.840 20 10 CFCDHN CN(C)c1ccc(/C=C/CNCC2(C)OCCCO2)cc1 ZINC000835048643 629348250 /nfs/dbraw/zinc/34/82/50/629348250.db2.gz KCZXBEUIQFTFIA-GQCTYLIASA-N 0 3 290.407 2.509 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@](C)(OC)CC1 ZINC000793342362 629529051 /nfs/dbraw/zinc/52/90/51/629529051.db2.gz ZMCKBAJLPIRWSF-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000793342362 629529053 /nfs/dbraw/zinc/52/90/53/629529053.db2.gz ZMCKBAJLPIRWSF-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc3cccc(C)n23)c([O-])c1 ZINC000793390274 629535865 /nfs/dbraw/zinc/53/58/65/629535865.db2.gz NQFHTVWWWRJYGG-UHFFFAOYSA-N 0 3 297.358 2.647 20 10 CFCDHN Cc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)n(C)n1 ZINC000793561995 629572106 /nfs/dbraw/zinc/57/21/06/629572106.db2.gz SMGJNRCRXJMTSX-RNCFNFMXSA-N 0 3 289.354 2.911 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c([O-])c1 ZINC000793575131 629574220 /nfs/dbraw/zinc/57/42/20/629574220.db2.gz UGUIGELUEFBSBD-WOSRLPQWSA-N 0 3 295.423 2.509 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000793609067 629578555 /nfs/dbraw/zinc/57/85/55/629578555.db2.gz MZFWQTVLKBPKMY-XJKSGUPXSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000793609067 629578557 /nfs/dbraw/zinc/57/85/57/629578557.db2.gz MZFWQTVLKBPKMY-XJKSGUPXSA-N 0 3 277.364 2.544 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCCN(C)C1)c1ccc(C)cc1[O-] ZINC000794804791 629687917 /nfs/dbraw/zinc/68/79/17/629687917.db2.gz WGGDTGIBXVXDOH-DZGCQCFKSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCCN1C)c1ccc(C)cc1[O-] ZINC000794802040 629688042 /nfs/dbraw/zinc/68/80/42/629688042.db2.gz LVIQTISKZOABBE-HIFRSBDPSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C[S@](C)=O)c1ccc(C)cc1[O-] ZINC000794813569 629689520 /nfs/dbraw/zinc/68/95/20/629689520.db2.gz AYMOZJXCLBODEJ-YNKQFZHNSA-N 0 3 269.410 2.508 20 10 CFCDHN CC[C@H]([NH2+]CCc1ccn(C)n1)c1ccc(C)cc1[O-] ZINC000794812737 629689774 /nfs/dbraw/zinc/68/97/74/629689774.db2.gz FICREYVDLQVAGR-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCC[C@@H]1C(=O)NC)c1ccc(C)cc1[O-] ZINC000794817845 629690457 /nfs/dbraw/zinc/69/04/57/629690457.db2.gz PKEBDQSMHUVLGT-KKUMJFAQSA-N 0 3 290.407 2.656 20 10 CFCDHN [O-]c1cc2c(cc1C[NH+]1CCC3(CCC3)CC1)[C@H](O)CO2 ZINC000795713681 629827030 /nfs/dbraw/zinc/82/70/30/629827030.db2.gz JXTRWLKQGCXWCQ-OAHLLOKOSA-N 0 3 289.375 2.584 20 10 CFCDHN CCOc1ccc(O)c(CNCc2cnn3ccccc23)c1 ZINC000796480951 629924837 /nfs/dbraw/zinc/92/48/37/629924837.db2.gz PEKVKKXGZQIKQU-UHFFFAOYSA-N 0 3 297.358 2.728 20 10 CFCDHN CC[C@@H](NCc1ccon1)c1ccc(F)cc1O ZINC000796791464 629968714 /nfs/dbraw/zinc/96/87/14/629968714.db2.gz XMBLWWWMBDUFMR-GFCCVEGCSA-N 0 3 250.273 2.760 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCCSC ZINC000798963896 630265354 /nfs/dbraw/zinc/26/53/54/630265354.db2.gz FQHTWLNIVARPAG-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCCSC ZINC000798963896 630265356 /nfs/dbraw/zinc/26/53/56/630265356.db2.gz FQHTWLNIVARPAG-UHFFFAOYSA-N 0 3 255.383 2.586 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2([S@](C)=O)CC2)c2c1c(F)ccc2[O-] ZINC000799727517 630340362 /nfs/dbraw/zinc/34/03/62/630340362.db2.gz NCDSQOOWPHOBAW-SSBAMLGTSA-N 0 3 297.395 2.580 20 10 CFCDHN CCOc1cccc(CN2CC[C@H](OC(F)F)C2)c1O ZINC000802658696 630536502 /nfs/dbraw/zinc/53/65/02/630536502.db2.gz NNXUOABMELNSKT-NSHDSACASA-N 0 3 287.306 2.604 20 10 CFCDHN CC[C@H](CO)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672230 631026069 /nfs/dbraw/zinc/02/60/69/631026069.db2.gz HBSCNYMIZCAGKR-GXSJLCMTSA-N 0 3 257.761 2.776 20 10 CFCDHN CC(=O)NCCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808674194 631026967 /nfs/dbraw/zinc/02/69/67/631026967.db2.gz OKYQTIXYIAAOIE-JTQLQIEISA-N 0 3 284.787 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCCC(=O)N(C)C)c1[O-] ZINC000808682276 631028332 /nfs/dbraw/zinc/02/83/32/631028332.db2.gz QEPHIXABHVHGDW-NSHDSACASA-N 0 3 298.814 2.873 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCOC2)c1[O-] ZINC000808708855 631031922 /nfs/dbraw/zinc/03/19/22/631031922.db2.gz RAQOYVDUGLWKQL-ONGXEEELSA-N 0 3 255.745 2.794 20 10 CFCDHN Oc1cc2c(cc1CNCc1ccc(F)c(F)c1)OCO2 ZINC000042880558 650002206 /nfs/dbraw/zinc/00/22/06/650002206.db2.gz XVPCKQTYQCFZLO-UHFFFAOYSA-N 0 3 293.269 2.689 20 10 CFCDHN Cc1cccc(CN2CCO[C@@H](C3CCC3)C2)c1O ZINC000840954958 631283009 /nfs/dbraw/zinc/28/30/09/631283009.db2.gz NVPRSRSVFMVZLT-OAHLLOKOSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CS[C@@H](C)C2)c([O-])c1 ZINC000840957470 631284952 /nfs/dbraw/zinc/28/49/52/631284952.db2.gz BURGQQBPKKSLOQ-JQWIXIFHSA-N 0 3 267.394 2.775 20 10 CFCDHN CO[C@@](C)([C@H](C)[NH2+]Cc1cc(F)ccc1[O-])C1CC1 ZINC000840961204 631285488 /nfs/dbraw/zinc/28/54/88/631285488.db2.gz SGXXKLYYIOKGDY-BONVTDFDSA-N 0 3 267.344 2.825 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)[C@H]2CC2(F)F)c([O-])c1 ZINC000840968097 631289368 /nfs/dbraw/zinc/28/93/68/631289368.db2.gz NMOWRKRUPNHOTG-LDYMZIIASA-N 0 3 257.280 2.534 20 10 CFCDHN NC1(C[NH2+]Cc2cccc(F)c2[O-])CCCCCC1 ZINC000841042036 631318942 /nfs/dbraw/zinc/31/89/42/631318942.db2.gz DBSRGSAQTOQOPT-UHFFFAOYSA-N 0 3 266.360 2.673 20 10 CFCDHN CC1(C)C[NH2+]CC[C@@H]1NCc1c([O-])ccc(Cl)c1F ZINC000841071746 631330469 /nfs/dbraw/zinc/33/04/69/631330469.db2.gz AHCQZQJCEKKBRG-LBPRGKRZSA-N 0 3 286.778 2.662 20 10 CFCDHN [O-]c1c(F)cccc1CNc1ccc2c(c1)C[NH2+]CCO2 ZINC000841080228 631333184 /nfs/dbraw/zinc/33/31/84/631333184.db2.gz AHJDHWRXGRJTFZ-UHFFFAOYSA-N 0 3 288.322 2.625 20 10 CFCDHN [O-]c1c(Cl)cccc1C[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000841089461 631337257 /nfs/dbraw/zinc/33/72/57/631337257.db2.gz NMFOWOAQWRSKGK-LBPRGKRZSA-N 0 3 280.799 2.810 20 10 CFCDHN [O-]c1ccc(Cl)c(F)c1CN[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000841088620 631337374 /nfs/dbraw/zinc/33/73/74/631337374.db2.gz BFEIKMKRKUSJFS-JTQLQIEISA-N 0 3 298.789 2.949 20 10 CFCDHN Fc1cc(CN2CC(C3CC3)C2)ccc1N1CCOCC1 ZINC000812776427 631770677 /nfs/dbraw/zinc/77/06/77/631770677.db2.gz VBXOPFFKYGYUJM-UHFFFAOYSA-N 0 3 290.382 2.504 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@](C)(OC)C2CC2)c([O-])c1 ZINC000812772483 631771073 /nfs/dbraw/zinc/77/10/73/631771073.db2.gz NBRSCYQSGXIVHO-INIZCTEOSA-N 0 3 279.380 2.696 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[N@H+](C1CC1)C1CCNCC1 ZINC000843043854 631811455 /nfs/dbraw/zinc/81/14/55/631811455.db2.gz LRTNXHKELSWNHW-UHFFFAOYSA-N 0 3 298.789 2.901 20 10 CFCDHN [O-]c1c(F)cc(Cl)cc1C[N@@H+](C1CC1)C1CCNCC1 ZINC000843043854 631811463 /nfs/dbraw/zinc/81/14/63/631811463.db2.gz LRTNXHKELSWNHW-UHFFFAOYSA-N 0 3 298.789 2.901 20 10 CFCDHN C[C@@H]([NH3+])[C@@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000843052414 631815994 /nfs/dbraw/zinc/81/59/94/631815994.db2.gz SUQLSTIOUSSZCN-NXEZZACHSA-N 0 3 286.778 2.744 20 10 CFCDHN Nc1ccc(Cc2noc(C3CCN(C4CC4)CC3)n2)cc1 ZINC000843161004 631872253 /nfs/dbraw/zinc/87/22/53/631872253.db2.gz NORSRZUMZGKZIV-UHFFFAOYSA-N 0 3 298.390 2.584 20 10 CFCDHN CC(C)O[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000843413717 631948055 /nfs/dbraw/zinc/94/80/55/631948055.db2.gz OJVKPNVOOGXZNP-CQSZACIVSA-N 0 3 280.387 2.891 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843417076 631949073 /nfs/dbraw/zinc/94/90/73/631949073.db2.gz OWENVHZDHHUAKJ-UKRRQHHQSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000843417076 631949075 /nfs/dbraw/zinc/94/90/75/631949075.db2.gz OWENVHZDHHUAKJ-UKRRQHHQSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1ccc(O)c(CN2CCOC[C@H]2C2CCC2)c1 ZINC000843429275 631956769 /nfs/dbraw/zinc/95/67/69/631956769.db2.gz UPFFBGKRWMSCLB-HNNXBMFYSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](CO)C(C)C)c([O-])c1 ZINC000815626119 632300642 /nfs/dbraw/zinc/30/06/42/632300642.db2.gz WDJGKIQFTRXVOM-ZIAGYGMSSA-N 0 3 265.397 2.924 20 10 CFCDHN [NH3+]C[C@]12CCC[C@H]1CN(Cc1c([O-])ccc(Cl)c1F)C2 ZINC000844903036 632332077 /nfs/dbraw/zinc/33/20/77/632332077.db2.gz YVOFQHUYHNCRML-BONVTDFDSA-N 0 3 298.789 2.746 20 10 CFCDHN [O-]c1c(C[NH+]2CCN(C3CC3)CC2)ccc2ccccc21 ZINC000816484737 632468548 /nfs/dbraw/zinc/46/85/48/632468548.db2.gz MWWXOXGYOACQFJ-UHFFFAOYSA-N 0 3 282.387 2.825 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@]2(O)CCC[C@H]2C)c1[O-] ZINC000816661408 632507079 /nfs/dbraw/zinc/50/70/79/632507079.db2.gz MTAFAXYDJNGXIV-IAQYHMDHSA-N 0 3 283.799 2.995 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cnc(C3CC3)nc2)c1 ZINC000845973033 632606668 /nfs/dbraw/zinc/60/66/68/632606668.db2.gz WBQKMXZGTACDKX-NSHDSACASA-N 0 3 299.374 2.919 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccc(F)nc2)c1 ZINC000845973316 632606835 /nfs/dbraw/zinc/60/68/35/632606835.db2.gz YRFDGOAJLWYMCV-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN C[C@H](O)[C@@H](NCc1ccccc1O)c1ccccc1F ZINC000846016921 632615385 /nfs/dbraw/zinc/61/53/85/632615385.db2.gz KLVBBSXJEZSZGE-MEDUHNTESA-N 0 3 275.323 2.743 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@@](C)(O)c1ccccc1 ZINC000846040336 632620940 /nfs/dbraw/zinc/62/09/40/632620940.db2.gz WGJJDIGJUPQQAU-SJKOYZFVSA-N 0 3 289.350 2.917 20 10 CFCDHN CO[C@@H]1[C@H](C)[C@H]([NH2+]Cc2cc(F)ccc2[O-])C1(C)C ZINC000817407979 632621934 /nfs/dbraw/zinc/62/19/34/632621934.db2.gz BQZZUAWVYHRCER-BIGNPOOSSA-N 0 3 267.344 2.680 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2c1c(F)ccc2[O-] ZINC000846189128 632657809 /nfs/dbraw/zinc/65/78/09/632657809.db2.gz KPERVXMKROBCRS-BVPDVSAISA-N 0 3 277.339 2.989 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@@]2(O)CCOC2)c1[O-] ZINC000846194155 632658439 /nfs/dbraw/zinc/65/84/39/632658439.db2.gz RMIBCEXMUFADGU-IAQYHMDHSA-N 0 3 299.798 2.546 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@]2(O)CCOC2)c1[O-] ZINC000846194154 632658619 /nfs/dbraw/zinc/65/86/19/632658619.db2.gz RMIBCEXMUFADGU-ABAIWWIYSA-N 0 3 299.798 2.546 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCc2cccnc2CC1 ZINC000817574848 632667945 /nfs/dbraw/zinc/66/79/45/632667945.db2.gz SEXLSKUJXGLDLN-OAHLLOKOSA-N 0 3 268.360 2.824 20 10 CFCDHN COC1([C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000817588815 632671930 /nfs/dbraw/zinc/67/19/30/632671930.db2.gz ROQXPQNSHUJGNF-GXTWGEPZSA-N 0 3 291.391 2.553 20 10 CFCDHN CON1CCC([NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)CC1 ZINC000817589590 632672263 /nfs/dbraw/zinc/67/22/63/632672263.db2.gz ZDEOTAZPCNXZTB-GXFFZTMASA-N 0 3 294.370 2.695 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCNC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940560 632743904 /nfs/dbraw/zinc/74/39/04/632743904.db2.gz KDHCSFPJHHCIIC-NXEZZACHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H](N[C@@H]1CCC[NH2+]C1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940560 632743907 /nfs/dbraw/zinc/74/39/07/632743907.db2.gz KDHCSFPJHHCIIC-NXEZZACHSA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H]1CCCCN1)c1ccc(F)cc1[O-] ZINC000817949835 632750780 /nfs/dbraw/zinc/75/07/80/632750780.db2.gz NSMGGYUEXUMYMQ-JSGCOSHPSA-N 0 3 266.360 2.714 20 10 CFCDHN C[C@@H](NC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817951147 632751546 /nfs/dbraw/zinc/75/15/46/632751546.db2.gz AGKMAWVVYBCUKC-KOLCDFICSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@H](NC[C@H]1CCC[NH2+]1)c1cc(Cl)ccc1[O-] ZINC000817951676 632751976 /nfs/dbraw/zinc/75/19/76/632751976.db2.gz JHQZJKKBIPXLST-YPMHNXCESA-N 0 3 268.788 2.838 20 10 CFCDHN CC[NH2+]CCN[C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817951572 632752114 /nfs/dbraw/zinc/75/21/14/632752114.db2.gz GPNXVLGQCDNKOL-SECBINFHSA-N 0 3 276.302 2.671 20 10 CFCDHN CCNCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817951572 632752117 /nfs/dbraw/zinc/75/21/17/632752117.db2.gz GPNXVLGQCDNKOL-SECBINFHSA-N 0 3 276.302 2.671 20 10 CFCDHN N[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000817955345 632754845 /nfs/dbraw/zinc/75/48/45/632754845.db2.gz WBUMCQUWPKTBIK-CABCVRRESA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@H]([NH2+][C@@H](CN)C1CC1)c1ccc(Br)cc1[O-] ZINC000817959761 632757993 /nfs/dbraw/zinc/75/79/93/632757993.db2.gz IJTCZIRCFZGXCQ-UFBFGSQYSA-N 0 3 299.212 2.543 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CN)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817961468 632760433 /nfs/dbraw/zinc/76/04/33/632760433.db2.gz ZIFMGLWFKBVHOR-CHWSQXEVSA-N 0 3 268.788 2.824 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000817969300 632767761 /nfs/dbraw/zinc/76/77/61/632767761.db2.gz BBXHPOFAVPJRED-LEWSCRJBSA-N 0 3 266.360 2.570 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CNCC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000817969728 632768396 /nfs/dbraw/zinc/76/83/96/632768396.db2.gz YUVNZZWVHPHLAJ-LEWSCRJBSA-N 0 3 266.360 2.570 20 10 CFCDHN C[C@H](N[C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Cl)c(Cl)cc1[O-] ZINC000817977643 632775315 /nfs/dbraw/zinc/77/53/15/632775315.db2.gz MNWFNPOEZUMZNB-HEXRFXHZSA-N 0 3 287.190 2.567 20 10 CFCDHN CC[C@H]([NH2+][C@H](CN)C1CCCC1)c1ccccc1[O-] ZINC000817980987 632777660 /nfs/dbraw/zinc/77/76/60/632777660.db2.gz GCEVZSQFINIXDL-LSDHHAIUSA-N 0 3 262.397 2.950 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CN)C1CCCC1)c1ccccc1[O-] ZINC000817980980 632777776 /nfs/dbraw/zinc/77/77/76/632777776.db2.gz GCEVZSQFINIXDL-CABCVRRESA-N 0 3 262.397 2.950 20 10 CFCDHN CC[C@H](N[C@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 ZINC000817981076 632778073 /nfs/dbraw/zinc/77/80/73/632778073.db2.gz PSRMXUNYKPQOBD-GJZGRUSLSA-N 0 3 297.393 2.791 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1cc(F)cc(F)c1[O-] ZINC000817985930 632781731 /nfs/dbraw/zinc/78/17/31/632781731.db2.gz OJHNLIHXXSNWPV-JQWIXIFHSA-N 0 3 296.361 2.996 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c1[O-] ZINC000857060696 635921738 /nfs/dbraw/zinc/92/17/38/635921738.db2.gz DZAHSYONVRGUOC-PWSUYJOCSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c1[O-] ZINC000857060696 635921740 /nfs/dbraw/zinc/92/17/40/635921740.db2.gz DZAHSYONVRGUOC-PWSUYJOCSA-N 0 3 299.798 2.505 20 10 CFCDHN CCc1cccc(CN2CC(CO)(c3ccccc3)C2)c1O ZINC000848915770 633399475 /nfs/dbraw/zinc/39/94/75/633399475.db2.gz AELCPALKVFAIIG-UHFFFAOYSA-N 0 3 297.398 2.701 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOCC(F)(F)F)c([O-])c1 ZINC000108942847 633745307 /nfs/dbraw/zinc/74/53/07/633745307.db2.gz IJJJRDRSPKBZJT-SNVBAGLBSA-N 0 3 277.286 2.930 20 10 CFCDHN Cc1nc(CNCCCSc2nccs2)[nH]c1C ZINC000850147990 633855938 /nfs/dbraw/zinc/85/59/38/633855938.db2.gz YIKACTXJVFWICL-UHFFFAOYSA-N 0 3 282.438 2.755 20 10 CFCDHN COc1ccc(N2CC[C@H](NCc3ccco3)C2)cc1 ZINC000850346272 633948682 /nfs/dbraw/zinc/94/86/82/633948682.db2.gz RJWZSKAVTWMSFC-ZDUSSCGKSA-N 0 3 272.348 2.657 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCOC2(C)C)c([O-])c1 ZINC000850409730 633981632 /nfs/dbraw/zinc/98/16/32/633981632.db2.gz ZHSAIJLPKWLGNK-ZDUSSCGKSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@@H]([S@@](C)=O)C1)c1cc(F)ccc1[O-] ZINC000850500459 634019552 /nfs/dbraw/zinc/01/95/52/634019552.db2.gz DNBZVHGMYGQNEA-MNIFOHHSSA-N 0 3 299.411 2.872 20 10 CFCDHN C[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000850502462 634021055 /nfs/dbraw/zinc/02/10/55/634021055.db2.gz PXVIMFCHEYTSRY-AVUKIGBWSA-N 0 3 293.432 2.659 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000850520717 634028750 /nfs/dbraw/zinc/02/87/50/634028750.db2.gz GSCGOLGKEAYBQM-QXEWZRGKSA-N 0 3 253.317 2.704 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](O)C23CCC3)c([O-])c1 ZINC000850548256 634048423 /nfs/dbraw/zinc/04/84/23/634048423.db2.gz ZTNDTSFGNGWDDL-NILFDRSVSA-N 0 3 261.365 2.655 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCCO)Cc1ccco1 ZINC000109761097 634232349 /nfs/dbraw/zinc/23/23/49/634232349.db2.gz HEICHDBPBJEMSW-UHFFFAOYSA-N 0 3 275.348 2.760 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCCO)Cc1ccco1 ZINC000109761097 634232356 /nfs/dbraw/zinc/23/23/56/634232356.db2.gz HEICHDBPBJEMSW-UHFFFAOYSA-N 0 3 275.348 2.760 20 10 CFCDHN OCCCCN(Cc1ccco1)Cc1ccccc1O ZINC000109761097 634232361 /nfs/dbraw/zinc/23/23/61/634232361.db2.gz HEICHDBPBJEMSW-UHFFFAOYSA-N 0 3 275.348 2.760 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCOCCF)c2c1c(F)ccc2[O-] ZINC000853238404 634948481 /nfs/dbraw/zinc/94/84/81/634948481.db2.gz ICJCZAWDKFUBIP-MWLCHTKSSA-N 0 3 271.307 2.655 20 10 CFCDHN CC[C@@H]([NH2+]CCOCCF)c1ccc(C)cc1[O-] ZINC000853238839 634948697 /nfs/dbraw/zinc/94/86/97/634948697.db2.gz SNEAZKSNNXBRPD-CYBMUJFWSA-N 0 3 255.333 2.727 20 10 CFCDHN CC(C)[C@H]([NH3+])CCNCc1c([O-])ccc(Cl)c1F ZINC000853247331 634950164 /nfs/dbraw/zinc/95/01/64/634950164.db2.gz LXXXPMNCJMVYEW-LLVKDONJSA-N 0 3 274.767 2.648 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CNC)c1cccc(Cl)c1[O-] ZINC000854231642 635267468 /nfs/dbraw/zinc/26/74/68/635267468.db2.gz IJGLMDKEPUEEKJ-CABZTGNLSA-N 0 3 256.777 2.694 20 10 CFCDHN CC[C@H](N[C@@H](C)C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000854231642 635267473 /nfs/dbraw/zinc/26/74/73/635267473.db2.gz IJGLMDKEPUEEKJ-CABZTGNLSA-N 0 3 256.777 2.694 20 10 CFCDHN O=C(N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc([O-])cs1 ZINC000855814991 635659712 /nfs/dbraw/zinc/65/97/12/635659712.db2.gz MVGRSPHNOIXGRY-NSHDSACASA-N 0 3 294.420 2.591 20 10 CFCDHN O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cc([O-])cs1 ZINC000855814991 635659718 /nfs/dbraw/zinc/65/97/18/635659718.db2.gz MVGRSPHNOIXGRY-NSHDSACASA-N 0 3 294.420 2.591 20 10 CFCDHN O=C(N[C@H]1CCN(C2CCCCC2)C1)C1=CC(=O)CS1 ZINC000855814991 635659723 /nfs/dbraw/zinc/65/97/23/635659723.db2.gz MVGRSPHNOIXGRY-NSHDSACASA-N 0 3 294.420 2.591 20 10 CFCDHN CN(C)c1ccc(CNCc2ccnc(F)c2)cc1 ZINC000858088893 636121196 /nfs/dbraw/zinc/12/11/96/636121196.db2.gz XGWZBSHYOXHABI-UHFFFAOYSA-N 0 3 259.328 2.577 20 10 CFCDHN CN1CCCc2cc(CNCc3ccnc(F)c3)ccc21 ZINC000858116965 636131879 /nfs/dbraw/zinc/13/18/79/636131879.db2.gz UTFLLPNDZRVITR-UHFFFAOYSA-N 0 3 285.366 2.893 20 10 CFCDHN CCC[C@](C)(O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135332 636135764 /nfs/dbraw/zinc/13/57/64/636135764.db2.gz RNUTUXWMJITPSP-HNNXBMFYSA-N 0 3 286.366 2.672 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@]2(C)CCCOC2)cc1F ZINC000858156377 636143126 /nfs/dbraw/zinc/14/31/26/636143126.db2.gz NXHGKGGNGFJNNL-OAHLLOKOSA-N 0 3 284.350 2.690 20 10 CFCDHN CC[C@@](C)(CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858172950 636147126 /nfs/dbraw/zinc/14/71/26/636147126.db2.gz MDDLZCLMBWHXRQ-HNNXBMFYSA-N 0 3 286.366 2.936 20 10 CFCDHN CCC[N@H+](CCC(=O)OC(C)C)Cc1ccccc1[O-] ZINC000076073927 650366290 /nfs/dbraw/zinc/36/62/90/650366290.db2.gz MVKSCYOTUJFNGG-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN CCC[N@@H+](CCC(=O)OC(C)C)Cc1ccccc1[O-] ZINC000076073927 650366294 /nfs/dbraw/zinc/36/62/94/650366294.db2.gz MVKSCYOTUJFNGG-UHFFFAOYSA-N 0 3 279.380 2.946 20 10 CFCDHN COc1ccc(F)cc1CNCc1ccccc1O ZINC000189201042 650368042 /nfs/dbraw/zinc/36/80/42/650368042.db2.gz FXPQPLGXGPBFAN-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H]2C[C@H]3CO[C@H]1[C@H]3C2)c1cc(F)ccc1[O-] ZINC000866444372 638822255 /nfs/dbraw/zinc/82/22/55/638822255.db2.gz GRBOZDINKRDITQ-RIJNBJNWSA-N 0 3 277.339 2.605 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@@H]1CCCn3nccc31)CC2 ZINC000866632938 638857971 /nfs/dbraw/zinc/85/79/71/638857971.db2.gz DKERXHDIXWNBNN-OLZOCXBDSA-N 0 3 269.348 2.701 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@H](O)C1CCCC1)CC2 ZINC000866638432 638859565 /nfs/dbraw/zinc/85/95/65/638859565.db2.gz HTESZALNKXEJFD-CABCVRRESA-N 0 3 275.392 2.910 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1C[C@@H]3CCC[C@@H]3O1)CC2 ZINC000872106934 641638830 /nfs/dbraw/zinc/63/88/30/641638830.db2.gz JBQPUUYXKPQLGC-AYDFFVQHSA-N 0 3 273.376 2.927 20 10 CFCDHN C[C@@H]([NH2+]CCC[C@@H]1CCOC1=O)c1cc(F)ccc1[O-] ZINC000872112879 641643593 /nfs/dbraw/zinc/64/35/93/641643593.db2.gz LKXXWUCYMQLFSF-GHMZBOCLSA-N 0 3 281.327 2.525 20 10 CFCDHN C[C@H]([NH2+]CCC[C@H]1CCOC1=O)c1cc(F)ccc1[O-] ZINC000872112881 641643780 /nfs/dbraw/zinc/64/37/80/641643780.db2.gz LKXXWUCYMQLFSF-QWRGUYRKSA-N 0 3 281.327 2.525 20 10 CFCDHN CCCOc1ccc(CN[C@H](C(=O)NC)C(C)C)cc1C ZINC000873091945 642011514 /nfs/dbraw/zinc/01/15/14/642011514.db2.gz XWMCHUXYFZXVQE-INIZCTEOSA-N 0 3 292.423 2.644 20 10 CFCDHN CCCOc1ccc(CN[C@H](C)C(=O)N(C)CC)cc1C ZINC000873113261 642015141 /nfs/dbraw/zinc/01/51/41/642015141.db2.gz WFEYBGYIFQAQBN-CQSZACIVSA-N 0 3 292.423 2.740 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c([O-])c1 ZINC000873156728 642039414 /nfs/dbraw/zinc/03/94/14/642039414.db2.gz MTZPTMQDSDGGHT-NUTKFTJISA-N 0 3 291.391 2.838 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1C[C@H]([NH2+]Cc2ccccc2[O-])C1 ZINC000873182004 642053908 /nfs/dbraw/zinc/05/39/08/642053908.db2.gz HCXPRHJLJFRSLC-JOCQHMNTSA-N 0 3 277.364 2.602 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CCCn1cnc2ccccc21 ZINC000020130237 642303866 /nfs/dbraw/zinc/30/38/66/642303866.db2.gz CLOTXEMXRCVZJC-UHFFFAOYSA-N 0 3 281.359 2.922 20 10 CFCDHN CCN1CCC([NH2+]Cc2c([O-])cccc2Cl)CC1 ZINC000083551520 650765017 /nfs/dbraw/zinc/76/50/17/650765017.db2.gz ZFIBLDDKIBLVMR-UHFFFAOYSA-N 0 3 268.788 2.620 20 10 CFCDHN Cc1ccnc(N2CCN(Cc3ccc(C)cc3O)CC2)c1 ZINC000876619258 642947858 /nfs/dbraw/zinc/94/78/58/642947858.db2.gz SCOGUZASGJVRDB-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN CCOC(=O)CC[N@H+](Cc1c(C)cccc1[O-])C1CC1 ZINC000876641397 642954465 /nfs/dbraw/zinc/95/44/65/642954465.db2.gz NLHMEAYSYKATMV-UHFFFAOYSA-N 0 3 277.364 2.618 20 10 CFCDHN CCOC(=O)CC[N@@H+](Cc1c(C)cccc1[O-])C1CC1 ZINC000876641397 642954468 /nfs/dbraw/zinc/95/44/68/642954468.db2.gz NLHMEAYSYKATMV-UHFFFAOYSA-N 0 3 277.364 2.618 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000876679709 642970207 /nfs/dbraw/zinc/97/02/07/642970207.db2.gz JGDCCCREFAEUQU-AWEZNQCLSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000876679709 642970211 /nfs/dbraw/zinc/97/02/11/642970211.db2.gz JGDCCCREFAEUQU-AWEZNQCLSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876783364 643006722 /nfs/dbraw/zinc/00/67/22/643006722.db2.gz ZYEOCLGYENAMMZ-ZFWWWQNUSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876783364 643006736 /nfs/dbraw/zinc/00/67/36/643006736.db2.gz ZYEOCLGYENAMMZ-ZFWWWQNUSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC000876794197 643012723 /nfs/dbraw/zinc/01/27/23/643012723.db2.gz OJMJYUAVPRDNQS-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC3(C2)CCOCC3)c([O-])c1 ZINC000876794197 643012726 /nfs/dbraw/zinc/01/27/26/643012726.db2.gz OJMJYUAVPRDNQS-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]3COCC[C@H]32)c([O-])c1 ZINC000876804676 643016203 /nfs/dbraw/zinc/01/62/03/643016203.db2.gz RMQYYDZPEDGQOF-LSDHHAIUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c([O-])c1 ZINC000876804676 643016210 /nfs/dbraw/zinc/01/62/10/643016210.db2.gz RMQYYDZPEDGQOF-LSDHHAIUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876807327 643018613 /nfs/dbraw/zinc/01/86/13/643018613.db2.gz BJYHAMGRIGZCKN-GDBMZVCRSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c([O-])c1 ZINC000876807327 643018619 /nfs/dbraw/zinc/01/86/19/643018619.db2.gz BJYHAMGRIGZCKN-GDBMZVCRSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+]Cc2c(C)cccc2[O-])n1 ZINC000876882063 643048984 /nfs/dbraw/zinc/04/89/84/643048984.db2.gz YOVLXXGRXQUVLK-UHFFFAOYSA-N 0 3 273.380 2.694 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc2c(c1)OCCO2 ZINC000876892582 643054147 /nfs/dbraw/zinc/05/41/47/643054147.db2.gz KZDLEOAFZQJGPF-UHFFFAOYSA-N 0 3 299.370 2.804 20 10 CFCDHN Cc1csc(CC[NH2+]Cc2ccc(C)cc2[O-])n1 ZINC000876930310 643068788 /nfs/dbraw/zinc/06/87/88/643068788.db2.gz VGONQZJQESZKKM-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)N2CCCCC2)c([O-])c1 ZINC000876957488 643080012 /nfs/dbraw/zinc/08/00/12/643080012.db2.gz XOHPYWHTRRYILJ-CQSZACIVSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1cccc(O)c1CNCc1cccc2c1OCO2 ZINC000876958237 643081201 /nfs/dbraw/zinc/08/12/01/643081201.db2.gz WPZCGLGKYVZPMD-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN Cc1ccc(C[NH2+]C2CCN(CC(F)F)CC2)c([O-])c1 ZINC000876991467 643096704 /nfs/dbraw/zinc/09/67/04/643096704.db2.gz OLPUUCIVQIDYNB-UHFFFAOYSA-N 0 3 284.350 2.520 20 10 CFCDHN Cc1ccc(C[NH2+]CC(C)(C)C[C@H](C)O)c([O-])c1 ZINC000877055097 643124247 /nfs/dbraw/zinc/12/42/47/643124247.db2.gz OSPPGQRCSUILKC-LBPRGKRZSA-N 0 3 251.370 2.587 20 10 CFCDHN COC(C)(C)C[C@@H](C)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877064227 643129643 /nfs/dbraw/zinc/12/96/43/643129643.db2.gz OUUVUMNIXGUETL-GFCCVEGCSA-N 0 3 251.370 2.994 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c([O-])c1 ZINC000877070835 643134329 /nfs/dbraw/zinc/13/43/29/643134329.db2.gz WXCDKUUEEUJKRS-NUEKZKHPSA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(C)CCCC[C@@H]1O ZINC000877082243 643141286 /nfs/dbraw/zinc/14/12/86/643141286.db2.gz YYMWFMHIHHGEQQ-JKSUJKDBSA-N 0 3 263.381 2.731 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)cc1[O-])C1CCOCC1 ZINC000877084620 643143998 /nfs/dbraw/zinc/14/39/98/643143998.db2.gz RDNQAQURDHPANN-HNNXBMFYSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cnc(C3CC3)nc2)c([O-])c1 ZINC000877124604 643163978 /nfs/dbraw/zinc/16/39/78/643163978.db2.gz YDCLDSICHBCSNL-UHFFFAOYSA-N 0 3 283.375 2.700 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1ccc(C)cc1[O-])C(=O)OC ZINC000877174594 643190562 /nfs/dbraw/zinc/19/05/62/643190562.db2.gz GQLIAXCJCUDGTJ-UHFFFAOYSA-N 0 3 279.380 2.770 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCOCC3(CCC3)C2)c([O-])c1 ZINC000877349942 643246863 /nfs/dbraw/zinc/24/68/63/643246863.db2.gz PNLKXKISQKKUMA-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CCOCC3(CCC3)C2)c([O-])c1 ZINC000877349942 643246867 /nfs/dbraw/zinc/24/68/67/643246867.db2.gz PNLKXKISQKKUMA-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@]1(C)CCO[C@H]1C1CC1 ZINC000877395688 643257410 /nfs/dbraw/zinc/25/74/10/643257410.db2.gz LZIGCADOTHEWAE-IRXDYDNUSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc(C)cc2[O-])cc1 ZINC000877464371 643284097 /nfs/dbraw/zinc/28/40/97/643284097.db2.gz IJTOXLHNDOEBFH-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN CO[C@H](CC[NH2+]Cc1c(C)cccc1[O-])C(F)(F)F ZINC000877466687 643287422 /nfs/dbraw/zinc/28/74/22/643287422.db2.gz PCSZFUZHUKIITL-GFCCVEGCSA-N 0 3 277.286 2.758 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC000877508096 643318701 /nfs/dbraw/zinc/31/87/01/643318701.db2.gz RYKKRBBNYNUPHY-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)c([O-])c1 ZINC000877508096 643318705 /nfs/dbraw/zinc/31/87/05/643318705.db2.gz RYKKRBBNYNUPHY-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2Cc1ccc(C)cc1[O-] ZINC000877518431 643322787 /nfs/dbraw/zinc/32/27/87/643322787.db2.gz UMKWAQJBLGWQJT-WLRQEKSISA-N 0 3 273.376 2.556 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1ccc(C)cc1[O-] ZINC000877518431 643322789 /nfs/dbraw/zinc/32/27/89/643322789.db2.gz UMKWAQJBLGWQJT-WLRQEKSISA-N 0 3 273.376 2.556 20 10 CFCDHN CCc1nc(C)c(CNCc2c(C)cccc2O)o1 ZINC000877548261 643349828 /nfs/dbraw/zinc/34/98/28/643349828.db2.gz UGILXCNGIOAAFR-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN Cc1nocc1CNCc1cc(Cl)cc(C)c1O ZINC000877562768 643363000 /nfs/dbraw/zinc/36/30/00/643363000.db2.gz CGNHVKLVAWOUMV-UHFFFAOYSA-N 0 3 266.728 2.940 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c([O-])c1 ZINC000877573438 643371874 /nfs/dbraw/zinc/37/18/74/643371874.db2.gz QQXWSUBKDXODQB-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c([O-])c1 ZINC000877573438 643371879 /nfs/dbraw/zinc/37/18/79/643371879.db2.gz QQXWSUBKDXODQB-CQSZACIVSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(CC[NH2+]Cc2c(C)cccc2[O-])nc1 ZINC000877577913 643375584 /nfs/dbraw/zinc/37/55/84/643375584.db2.gz NIXKPNHBCXTNNA-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CO[C@@](C)([C@@H](C)[NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877587941 643382979 /nfs/dbraw/zinc/38/29/79/643382979.db2.gz JWKOGZBTVXMSTH-WBMJQRKESA-N 0 3 263.381 2.994 20 10 CFCDHN CC[C@@H]([NH2+]Cc1c(C)cccc1[O-])[C@H](O)C(C)C ZINC000877591461 643385445 /nfs/dbraw/zinc/38/54/45/643385445.db2.gz ULSBSULEFPGJFE-UKRRQHHQSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](CCO)CC2)c([O-])c1 ZINC000877596922 643388773 /nfs/dbraw/zinc/38/87/73/643388773.db2.gz VLBMUHIRPBARJM-CQSZACIVSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](CCO)CC2)c([O-])c1 ZINC000877596922 643388781 /nfs/dbraw/zinc/38/87/81/643388781.db2.gz VLBMUHIRPBARJM-CQSZACIVSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCCN3CCCC[C@@H]23)c([O-])c1 ZINC000877618878 643405375 /nfs/dbraw/zinc/40/53/75/643405375.db2.gz HSUBGGOHZRPJCB-HOTGVXAUSA-N 0 3 274.408 2.807 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)c2ccccn2)c([O-])c1 ZINC000877620385 643406570 /nfs/dbraw/zinc/40/65/70/643406570.db2.gz HUTIJPUHGSBPTH-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](OCc2ccccn2)C1 ZINC000877645377 643428773 /nfs/dbraw/zinc/42/87/73/643428773.db2.gz JOAGJQTZQABIEJ-MRXNPFEDSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](OCc2ccccn2)C1 ZINC000877645377 643428781 /nfs/dbraw/zinc/42/87/81/643428781.db2.gz JOAGJQTZQABIEJ-MRXNPFEDSA-N 0 3 298.386 2.887 20 10 CFCDHN CCC[C@H](C[NH2+]Cc1c(C)cccc1[O-])OCC ZINC000877649941 643431038 /nfs/dbraw/zinc/43/10/38/643431038.db2.gz LZWVRHVFTXDQDW-CYBMUJFWSA-N 0 3 251.370 2.995 20 10 CFCDHN CC[C@]1(O)CCC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000877690851 643456220 /nfs/dbraw/zinc/45/62/20/643456220.db2.gz FHODNWBIMQZKDO-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@]1(O)CCC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000877690851 643456228 /nfs/dbraw/zinc/45/62/28/643456228.db2.gz FHODNWBIMQZKDO-HNNXBMFYSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@@]1(O)CCC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000877690852 643456568 /nfs/dbraw/zinc/45/65/68/643456568.db2.gz FHODNWBIMQZKDO-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN CC[C@@]1(O)CCC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000877690852 643456569 /nfs/dbraw/zinc/45/65/69/643456569.db2.gz FHODNWBIMQZKDO-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@@H]2CN3CCC2CC3)cc1Cl ZINC000877706053 643472792 /nfs/dbraw/zinc/47/27/92/643472792.db2.gz FNPQYQGKBPLFBT-OAHLLOKOSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@@H]2CN3CCC2CC3)cc1Cl ZINC000877706053 643472795 /nfs/dbraw/zinc/47/27/95/643472795.db2.gz FNPQYQGKBPLFBT-OAHLLOKOSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000877727640 643488673 /nfs/dbraw/zinc/48/86/73/643488673.db2.gz DXPAMABHLLGQME-CQSZACIVSA-N 0 3 275.392 2.997 20 10 CFCDHN CN1CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000877740171 643509200 /nfs/dbraw/zinc/50/92/00/643509200.db2.gz IVVOZZJZSZPXOE-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000877740171 643509205 /nfs/dbraw/zinc/50/92/05/643509205.db2.gz IVVOZZJZSZPXOE-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1Cl ZINC000877741046 643511419 /nfs/dbraw/zinc/51/14/19/643511419.db2.gz MGSDNYAKWWIUHU-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)cc1Cl ZINC000877741046 643511421 /nfs/dbraw/zinc/51/14/21/643511421.db2.gz MGSDNYAKWWIUHU-IUODEOHRSA-N 0 3 294.826 2.880 20 10 CFCDHN C[C@H](CCn1cccn1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000877757084 643536963 /nfs/dbraw/zinc/53/69/63/643536963.db2.gz FOYBNSJVRGKMLQ-OLZOCXBDSA-N 0 3 259.353 2.718 20 10 CFCDHN COC(=O)c1cc(CN[C@@H](C)c2ccccc2O)oc1C ZINC000877757333 643537599 /nfs/dbraw/zinc/53/75/99/643537599.db2.gz QHLOEKUNIWLSFV-JTQLQIEISA-N 0 3 289.331 2.931 20 10 CFCDHN CC(=O)NCC1CCC([NH2+][C@@H](C)c2ccccc2[O-])CC1 ZINC000877758283 643538213 /nfs/dbraw/zinc/53/82/13/643538213.db2.gz QZPNKSBNTPKIQO-GRTSSRMGSA-N 0 3 290.407 2.738 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@]12CCCO2 ZINC000877758314 643538518 /nfs/dbraw/zinc/53/85/18/643538518.db2.gz SHWAVSXJTPZENF-WBQNTZJQSA-N 0 3 291.391 2.769 20 10 CFCDHN Cc1ccc(C[NH2+]CCOC(F)(F)C(F)(F)F)c([O-])c1 ZINC000877806903 643568850 /nfs/dbraw/zinc/56/88/50/643568850.db2.gz SOTHFZHNMBGCBI-UHFFFAOYSA-N 0 3 299.239 2.962 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000877820203 643586483 /nfs/dbraw/zinc/58/64/83/643586483.db2.gz CNICFOWGVWRPFR-CYBMUJFWSA-N 0 3 277.364 2.557 20 10 CFCDHN COC(=O)CC[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000877820203 643586492 /nfs/dbraw/zinc/58/64/92/643586492.db2.gz CNICFOWGVWRPFR-CYBMUJFWSA-N 0 3 277.364 2.557 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000878242463 643805167 /nfs/dbraw/zinc/80/51/67/643805167.db2.gz RTOKKGXGVUIRRV-IVMMDQJWSA-N 0 3 261.365 2.782 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000878242463 643805173 /nfs/dbraw/zinc/80/51/73/643805173.db2.gz RTOKKGXGVUIRRV-IVMMDQJWSA-N 0 3 261.365 2.782 20 10 CFCDHN c1cc(N2CCCCC2)ccc1CN1CCN(C2CC2)CC1 ZINC000127884043 644354756 /nfs/dbraw/zinc/35/47/56/644354756.db2.gz UCNVJKXSBYSACK-UHFFFAOYSA-N 0 3 299.462 2.957 20 10 CFCDHN CCOC(=O)CCCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648399 644361249 /nfs/dbraw/zinc/36/12/49/644361249.db2.gz NCELKSLIVWFISE-GFCCVEGCSA-N 0 3 265.353 2.776 20 10 CFCDHN C[C@@H]([NH2+]CCCCCCCO)c1ccccc1[O-] ZINC000879648523 644361315 /nfs/dbraw/zinc/36/13/15/644361315.db2.gz SEUZHAMSIFGARF-CYBMUJFWSA-N 0 3 251.370 2.986 20 10 CFCDHN C[C@@H]([NH2+]CCO[C@@H]1CCCCO1)c1ccccc1[O-] ZINC000879648846 644362323 /nfs/dbraw/zinc/36/23/23/644362323.db2.gz BYCXMZKIAQZSLB-IUODEOHRSA-N 0 3 265.353 2.586 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccnc(N(C)C)c1)c1ccccc1[O-] ZINC000879649562 644362947 /nfs/dbraw/zinc/36/29/47/644362947.db2.gz WDSCQGFKEJALGG-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN CC(=O)c1nc(CC[NH2+][C@@H](C)c2ccccc2[O-])[nH]c1C ZINC000879650723 644363967 /nfs/dbraw/zinc/36/39/67/644363967.db2.gz PMQYQXQZLMQKMZ-JTQLQIEISA-N 0 3 287.363 2.520 20 10 CFCDHN C[C@H]([NH2+]CCO[C@@H]1CCCCO1)c1ccccc1[O-] ZINC000879650476 644364120 /nfs/dbraw/zinc/36/41/20/644364120.db2.gz BYCXMZKIAQZSLB-SWLSCSKDSA-N 0 3 265.353 2.586 20 10 CFCDHN C[C@H](NCc1cc(-c2cnn(C)c2)no1)c1ccccc1O ZINC000879650830 644364968 /nfs/dbraw/zinc/36/49/68/644364968.db2.gz SEVOPBDWNAWLSX-NSHDSACASA-N 0 3 298.346 2.632 20 10 CFCDHN C[C@H]([NH2+]CC(=O)N1CCc2ccccc21)c1ccccc1[O-] ZINC000879652710 644365771 /nfs/dbraw/zinc/36/57/71/644365771.db2.gz GPSVFTCHWYNZDW-ZDUSSCGKSA-N 0 3 296.370 2.632 20 10 CFCDHN CC[C@@H]1CN(Cc2cc(C)ccc2O)CCN1CC(F)F ZINC000093767235 650946124 /nfs/dbraw/zinc/94/61/24/650946124.db2.gz JIIZQIIWCSPTAQ-CQSZACIVSA-N 0 3 298.377 2.862 20 10 CFCDHN CCC[C@H]1C(=O)NCCN1Cc1c(O)ccc2ccccc21 ZINC000128881003 644937253 /nfs/dbraw/zinc/93/72/53/644937253.db2.gz YDVHSAOMFJSSKI-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)C[C@@H]1CCC[N@@H+]1C ZINC000211595274 644970546 /nfs/dbraw/zinc/97/05/46/644970546.db2.gz LCKFOFHQHLALNA-NSHDSACASA-N 0 3 268.788 2.572 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)C[C@@H]1CCC[N@H+]1C ZINC000211595274 644970552 /nfs/dbraw/zinc/97/05/52/644970552.db2.gz LCKFOFHQHLALNA-NSHDSACASA-N 0 3 268.788 2.572 20 10 CFCDHN Cc1cccc(NCc2ccc(N3CCN(C)CC3)cc2)n1 ZINC000882880461 645488727 /nfs/dbraw/zinc/48/87/27/645488727.db2.gz TXNMIDOTYLPIAT-UHFFFAOYSA-N 0 3 296.418 2.754 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)[S@](C)=O)c([O-])c1 ZINC000252809534 651026220 /nfs/dbraw/zinc/02/62/20/651026220.db2.gz LSNIJWBOEWEVMN-SOZUMNATSA-N 0 3 269.410 2.508 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000883364433 645771601 /nfs/dbraw/zinc/77/16/01/645771601.db2.gz GJQASXXERAJING-GFCCVEGCSA-N 0 3 277.364 2.592 20 10 CFCDHN Oc1ccccc1CNCc1cnc2ccccc2n1 ZINC000134294468 646323668 /nfs/dbraw/zinc/32/36/68/646323668.db2.gz QMMWUBWGCSVQGL-UHFFFAOYSA-N 0 3 265.316 2.625 20 10 CFCDHN Oc1ccccc1CNCc1ccc(Br)cn1 ZINC000134626789 646371950 /nfs/dbraw/zinc/37/19/50/646371950.db2.gz RSQUTQLGZZDMHX-UHFFFAOYSA-N 0 3 293.164 2.840 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC2(CO)CCCC2)c1 ZINC000135073588 646455069 /nfs/dbraw/zinc/45/50/69/646455069.db2.gz HCWHQTDMJSFKGI-ZDUSSCGKSA-N 0 3 263.381 2.904 20 10 CFCDHN C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886517560 647025807 /nfs/dbraw/zinc/02/58/07/647025807.db2.gz IJHOBYLNZAUADH-QWRGUYRKSA-N 0 3 254.349 2.522 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886522588 647027966 /nfs/dbraw/zinc/02/79/66/647027966.db2.gz MUIXNSGOMBASEI-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[NH+](CC)C[C@@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886522588 647027969 /nfs/dbraw/zinc/02/79/69/647027969.db2.gz MUIXNSGOMBASEI-NEPJUHHUSA-N 0 3 268.376 2.912 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)Cc1ccccc1F)c1ccccc1[O-] ZINC000886673098 647103508 /nfs/dbraw/zinc/10/35/08/647103508.db2.gz ZZWZYCSNDIUJBC-GXTWGEPZSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CC[C@@]2(CO[C@H](C)C2)O1)c1ccccc1[O-] ZINC000886764411 647130080 /nfs/dbraw/zinc/13/00/80/647130080.db2.gz SFIYPRKSBBUJSF-XJIUQZFPSA-N 0 3 291.391 2.769 20 10 CFCDHN CO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1(C)C ZINC000300419442 647331073 /nfs/dbraw/zinc/33/10/73/647331073.db2.gz WPUIUIWGUOULFR-BIGNPOOSSA-N 0 3 267.344 2.995 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(C)cc1[O-] ZINC000926949802 648668504 /nfs/dbraw/zinc/66/85/04/648668504.db2.gz QISPXDMHQJBZKH-LGWLGOQQSA-N 0 3 291.391 2.545 20 10 CFCDHN CCCC[N@H+](CCO[C@@H]1CCOC1)Cc1ccccc1[O-] ZINC000930350419 649235451 /nfs/dbraw/zinc/23/54/51/649235451.db2.gz HNUXETVOSWXFMM-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN CCCC[N@@H+](CCO[C@@H]1CCOC1)Cc1ccccc1[O-] ZINC000930350419 649235455 /nfs/dbraw/zinc/23/54/55/649235455.db2.gz HNUXETVOSWXFMM-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN CCN(Cc1ccc(C(F)(F)F)cc1[O-])[C@@H]1CC[NH2+]C1 ZINC001235970492 778633159 /nfs/dbraw/zinc/63/31/59/778633159.db2.gz KHOBVYSWENHVEJ-GFCCVEGCSA-N 0 3 288.313 2.595 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC001207166916 770542347 /nfs/dbraw/zinc/54/23/47/770542347.db2.gz GGDUBEMNXOYUSZ-QWHCGFSZSA-N 0 3 293.432 2.894 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC001207166916 770542354 /nfs/dbraw/zinc/54/23/54/770542354.db2.gz GGDUBEMNXOYUSZ-QWHCGFSZSA-N 0 3 293.432 2.894 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@@H]2COCC[C@H]2C1 ZINC000723661167 770644125 /nfs/dbraw/zinc/64/41/25/770644125.db2.gz RAHKURLKUZVHTI-NWANDNLSSA-N 0 3 261.365 2.687 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCCSCC2)c([O-])c1 ZINC000692437930 775237682 /nfs/dbraw/zinc/23/76/82/775237682.db2.gz XTELXSAZGVRQSE-LBPRGKRZSA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@H]([NH2+][C@@H](CCO)C1CCCC1)c1ccccc1[O-] ZINC000725105319 775273059 /nfs/dbraw/zinc/27/30/59/775273059.db2.gz UBIIWDIHWQUVSN-WFASDCNBSA-N 0 3 263.381 2.984 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2C[C@H](C)CC23CC3)c(OC)c1 ZINC001141031021 775796059 /nfs/dbraw/zinc/79/60/59/775796059.db2.gz VUIWVPLNEOZUSL-LLVKDONJSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2C[C@H](C)CC23CC3)c(OC)c1 ZINC001141031021 775796062 /nfs/dbraw/zinc/79/60/62/775796062.db2.gz VUIWVPLNEOZUSL-LLVKDONJSA-N 0 3 277.364 2.784 20 10 CFCDHN COc1ccc(CN2CCc3ccc(OC)cc3C2)c(O)c1 ZINC000092507756 776397732 /nfs/dbraw/zinc/39/77/32/776397732.db2.gz NJDOYNSPQSXYSP-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC000722320590 776466663 /nfs/dbraw/zinc/46/66/63/776466663.db2.gz GMASMRCXULKBMV-DZGCQCFKSA-N 0 3 265.328 2.579 20 10 CFCDHN CC(C)O[C@@]1(C[NH2+][C@@H](C)c2ccccc2[O-])CCOC1 ZINC000722353206 776513772 /nfs/dbraw/zinc/51/37/72/776513772.db2.gz OOCWEIQQFVMNLK-XJKSGUPXSA-N 0 3 279.380 2.627 20 10 CFCDHN CC(C)O[C@]1(C[NH2+][C@@H](C)c2ccccc2[O-])CCOC1 ZINC000722353197 776514004 /nfs/dbraw/zinc/51/40/04/776514004.db2.gz OOCWEIQQFVMNLK-BBRMVZONSA-N 0 3 279.380 2.627 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1c[nH]c3cccnc13)CC2 ZINC001231492730 777241199 /nfs/dbraw/zinc/24/11/99/777241199.db2.gz OEUFRLKMHLWFMO-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1c[nH]c3cccnc13)CC2 ZINC001231492730 777241205 /nfs/dbraw/zinc/24/12/05/777241205.db2.gz OEUFRLKMHLWFMO-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588540 777269877 /nfs/dbraw/zinc/26/98/77/777269877.db2.gz UACKINBDFOHZRV-YPMHNXCESA-N 0 3 257.333 2.501 20 10 CFCDHN C[C@@H]1C[C@H](O)C[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588540 777269883 /nfs/dbraw/zinc/26/98/83/777269883.db2.gz UACKINBDFOHZRV-YPMHNXCESA-N 0 3 257.333 2.501 20 10 CFCDHN COCC1C[NH+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231588211 777270019 /nfs/dbraw/zinc/27/00/19/777270019.db2.gz NEDUMKCCFKXILZ-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN CC(=O)N1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C ZINC001231590876 777271486 /nfs/dbraw/zinc/27/14/86/777271486.db2.gz OYSUKVVIRRQVRS-ZDUSSCGKSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N1CC[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C ZINC001231590876 777271489 /nfs/dbraw/zinc/27/14/89/777271489.db2.gz OYSUKVVIRRQVRS-ZDUSSCGKSA-N 0 3 298.386 2.598 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001231855019 777351686 /nfs/dbraw/zinc/35/16/86/777351686.db2.gz OKTFBRJSDYZPTH-QEJZJMRPSA-N 0 3 278.371 2.694 20 10 CFCDHN CCN(Cc1ccc(C(=O)OC)[nH]1)Cc1ccccc1O ZINC001232078470 777433092 /nfs/dbraw/zinc/43/30/92/777433092.db2.gz YQDJLJWZWZSAKX-UHFFFAOYSA-N 0 3 288.347 2.529 20 10 CFCDHN Oc1cccc2c1CN(Cc1cc3ccncc3[nH]1)CC2 ZINC001232096101 777440354 /nfs/dbraw/zinc/44/03/54/777440354.db2.gz UOMZFNCZJXVMQZ-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN CCN(Cc1cccc(COC)n1)Cc1ccccc1O ZINC001232256927 777495249 /nfs/dbraw/zinc/49/52/49/777495249.db2.gz FPOZMEHGJBCJIZ-UHFFFAOYSA-N 0 3 286.375 2.956 20 10 CFCDHN Oc1cc(CN2CC[C@@H](c3ccccc3)C2)cc(O)c1O ZINC001233010561 777762494 /nfs/dbraw/zinc/76/24/94/777762494.db2.gz QLPXOVKILMKUAE-CQSZACIVSA-N 0 3 285.343 2.793 20 10 CFCDHN Cc1cc(C)c(CN2CCc3cccc(O)c3C2)cn1 ZINC001233013959 777764682 /nfs/dbraw/zinc/76/46/82/777764682.db2.gz ZERJKVZWSDFGPM-UHFFFAOYSA-N 0 3 268.360 2.962 20 10 CFCDHN CC[C@@H]1CCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233017049 777765968 /nfs/dbraw/zinc/76/59/68/777765968.db2.gz QSMCHNMGXXZEID-LLVKDONJSA-N 0 3 251.326 2.568 20 10 CFCDHN CC[N@H+](Cc1ccccc1[O-])Cc1cc(C)c[nH]c1=O ZINC001233194691 777823735 /nfs/dbraw/zinc/82/37/35/777823735.db2.gz WWXSEWHGKPFLOP-UHFFFAOYSA-N 0 3 272.348 2.823 20 10 CFCDHN CC[N@@H+](Cc1ccccc1[O-])Cc1cc(C)c[nH]c1=O ZINC001233194691 777823738 /nfs/dbraw/zinc/82/37/38/777823738.db2.gz WWXSEWHGKPFLOP-UHFFFAOYSA-N 0 3 272.348 2.823 20 10 CFCDHN Cc1ccc(CN2CCc3cccc(O)c3C2)cc1O ZINC001233235479 777838287 /nfs/dbraw/zinc/83/82/87/777838287.db2.gz VEGMAIGTTWEICN-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c1[O-] ZINC001233287802 777869124 /nfs/dbraw/zinc/86/91/24/777869124.db2.gz HVJFXPPBKBUESH-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@H]2CO)c1[O-] ZINC001233287802 777869132 /nfs/dbraw/zinc/86/91/32/777869132.db2.gz HVJFXPPBKBUESH-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](CO)CC[C@H]2C)c1[O-] ZINC001233288097 777869675 /nfs/dbraw/zinc/86/96/75/777869675.db2.gz WGAQWUYQPLBRJI-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](CO)CC[C@H]2C)c1[O-] ZINC001233288097 777869683 /nfs/dbraw/zinc/86/96/83/777869683.db2.gz WGAQWUYQPLBRJI-MNOVXSKESA-N 0 3 299.798 2.647 20 10 CFCDHN CCN(CCC(F)(F)F)Cc1cc2c(cc1O)OCO2 ZINC000688517864 777958334 /nfs/dbraw/zinc/95/83/34/777958334.db2.gz ADSYXLRDZQYOIB-UHFFFAOYSA-N 0 3 291.269 2.895 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+](C)CCN(C)C)c2c1 ZINC001234519456 778241813 /nfs/dbraw/zinc/24/18/13/778241813.db2.gz ZDSPJHOTOZUFPJ-UHFFFAOYSA-N 0 3 288.391 2.547 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+](C)CCN(C)C)c2c1 ZINC001234519456 778241819 /nfs/dbraw/zinc/24/18/19/778241819.db2.gz ZDSPJHOTOZUFPJ-UHFFFAOYSA-N 0 3 288.391 2.547 20 10 CFCDHN [O-]c1c(CN2C[C@H]3CC[C@@H](C2)[NH2+]3)cccc1-c1ccccc1 ZINC001235394107 778474148 /nfs/dbraw/zinc/47/41/48/778474148.db2.gz XQHGTSUYRSKFHJ-CALCHBBNSA-N 0 3 294.398 2.995 20 10 CFCDHN C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1O ZINC001235676025 778532661 /nfs/dbraw/zinc/53/26/61/778532661.db2.gz NTBIZBSQFQLNDU-NHYWBVRUSA-N 0 3 263.381 2.502 20 10 CFCDHN C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1O ZINC001235676025 778532663 /nfs/dbraw/zinc/53/26/63/778532663.db2.gz NTBIZBSQFQLNDU-NHYWBVRUSA-N 0 3 263.381 2.502 20 10 CFCDHN CC(C)(C)c1ccc(CN2CC(C)(CO)C2)c(O)c1 ZINC001235676939 778534353 /nfs/dbraw/zinc/53/43/53/778534353.db2.gz XYBOFNJFBYUYDT-UHFFFAOYSA-N 0 3 263.381 2.504 20 10 CFCDHN [O-]c1c(F)cccc1C[N@@H+]1CCN[C@H](c2ccccc2)C1 ZINC001235859713 778583105 /nfs/dbraw/zinc/58/31/05/778583105.db2.gz NXBNVIFXYUXMHW-INIZCTEOSA-N 0 3 286.350 2.678 20 10 CFCDHN [O-]c1c(F)cccc1C[N@H+]1CCN[C@H](c2ccccc2)C1 ZINC001235859713 778583109 /nfs/dbraw/zinc/58/31/09/778583109.db2.gz NXBNVIFXYUXMHW-INIZCTEOSA-N 0 3 286.350 2.678 20 10 CFCDHN CC(C)C[C@H]1CN(Cc2c([O-])cccc2Cl)CC[NH2+]1 ZINC001235880580 778588683 /nfs/dbraw/zinc/58/86/83/778588683.db2.gz DETTXQZNZWPQGV-LBPRGKRZSA-N 0 3 282.815 2.866 20 10 CFCDHN C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@H](C)[NH2+]1 ZINC001235903274 778601954 /nfs/dbraw/zinc/60/19/54/778601954.db2.gz WNMDXMRHVANUOX-AOOOYVTPSA-N 0 3 288.313 2.593 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](O)(CF)CC2)c([O-])c1 ZINC001236782219 778934229 /nfs/dbraw/zinc/93/42/29/778934229.db2.gz ACIUFHBXNIUKAE-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](O)(CF)CC2)c([O-])c1 ZINC001236782219 778934231 /nfs/dbraw/zinc/93/42/31/778934231.db2.gz ACIUFHBXNIUKAE-INIZCTEOSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](F)(CO)CC2)c([O-])c1 ZINC001236783597 778935122 /nfs/dbraw/zinc/93/51/22/778935122.db2.gz MSFRLAIJUZMBLR-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](F)(CO)CC2)c([O-])c1 ZINC001236783597 778935123 /nfs/dbraw/zinc/93/51/23/778935123.db2.gz MSFRLAIJUZMBLR-MRXNPFEDSA-N 0 3 281.371 2.641 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](O)[C@@H](C)CC2)c([O-])c1 ZINC001236784672 778935221 /nfs/dbraw/zinc/93/52/21/778935221.db2.gz YCWNXUWBPULXLA-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](C)CC2)c([O-])c1 ZINC001236784672 778935225 /nfs/dbraw/zinc/93/52/25/778935225.db2.gz YCWNXUWBPULXLA-SWLSCSKDSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001236784030 778935832 /nfs/dbraw/zinc/93/58/32/778935832.db2.gz REAHHADOWRZQGK-QGZVFWFLSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001236784030 778935838 /nfs/dbraw/zinc/93/58/38/778935838.db2.gz REAHHADOWRZQGK-QGZVFWFLSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(CN2CCCC[C@H]2C(C)=O)c(O)c1 ZINC001236792340 778938516 /nfs/dbraw/zinc/93/85/16/778938516.db2.gz PRDFFGNJRNXRMF-HNNXBMFYSA-N 0 3 261.365 2.898 20 10 CFCDHN COc1cc([O-])c(CN2CCC[C@H]([NH+](C)C)C2)c(Cl)c1 ZINC001236797980 778941336 /nfs/dbraw/zinc/94/13/36/778941336.db2.gz CNOFSNSFFXYJRC-NSHDSACASA-N 0 3 298.814 2.580 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236807236 778946827 /nfs/dbraw/zinc/94/68/27/778946827.db2.gz DZLVGMFIUPLLSZ-GUYCJALGSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H](C)[C@@](C)(O)CC2)c([O-])c1 ZINC001236807236 778946830 /nfs/dbraw/zinc/94/68/30/778946830.db2.gz DZLVGMFIUPLLSZ-GUYCJALGSA-N 0 3 293.407 2.692 20 10 CFCDHN CC[N@H+](Cc1c(C)cc(OC)cc1[O-])C1CCN(C)CC1 ZINC001236812253 778949101 /nfs/dbraw/zinc/94/91/01/778949101.db2.gz BCUZWCMHGXDCLA-UHFFFAOYSA-N 0 3 292.423 2.625 20 10 CFCDHN CC[N@@H+](Cc1c(C)cc(OC)cc1[O-])C1CCN(C)CC1 ZINC001236812253 778949108 /nfs/dbraw/zinc/94/91/08/778949108.db2.gz BCUZWCMHGXDCLA-UHFFFAOYSA-N 0 3 292.423 2.625 20 10 CFCDHN COc1cc(C)c(CN2CCC[C@@H]2CF)c(O)c1 ZINC001236815684 778950274 /nfs/dbraw/zinc/95/02/74/778950274.db2.gz MRMRVHFUKKBVPA-LLVKDONJSA-N 0 3 253.317 2.643 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c([O-])c1 ZINC001236812867 778950578 /nfs/dbraw/zinc/95/05/78/778950578.db2.gz GEPGLZUXYZASDR-COPLHBTASA-N 0 3 265.328 2.642 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c([O-])c1 ZINC001236812867 778950580 /nfs/dbraw/zinc/95/05/80/778950580.db2.gz GEPGLZUXYZASDR-COPLHBTASA-N 0 3 265.328 2.642 20 10 CFCDHN COc1cc(C)c(C[NH+]2CCC(CF)CC2)c([O-])c1 ZINC001236813392 778950690 /nfs/dbraw/zinc/95/06/90/778950690.db2.gz JVAHQWLNUOCBTR-UHFFFAOYSA-N 0 3 267.344 2.891 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC3(CCCO3)CC2)c([O-])c1 ZINC001237042530 778995645 /nfs/dbraw/zinc/99/56/45/778995645.db2.gz XKXXHFWOSSEPTK-UHFFFAOYSA-N 0 3 291.391 2.936 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](O)C2)c([O-])c1 ZINC001237046680 778998615 /nfs/dbraw/zinc/99/86/15/778998615.db2.gz VMCFRBIRRUNKOL-MLGOLLRUSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@H](O)C2)c([O-])c1 ZINC001237046680 778998620 /nfs/dbraw/zinc/99/86/20/778998620.db2.gz VMCFRBIRRUNKOL-MLGOLLRUSA-N 0 3 263.381 2.718 20 10 CFCDHN CCOC(=O)CC[N@H+](C)Cc1ccc(C(C)C)cc1[O-] ZINC001237048015 778999086 /nfs/dbraw/zinc/99/90/86/778999086.db2.gz BOZJCNITHVPYAB-UHFFFAOYSA-N 0 3 279.380 2.901 20 10 CFCDHN CCOC(=O)CC[N@@H+](C)Cc1ccc(C(C)C)cc1[O-] ZINC001237048015 778999087 /nfs/dbraw/zinc/99/90/87/778999087.db2.gz BOZJCNITHVPYAB-UHFFFAOYSA-N 0 3 279.380 2.901 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@](C)(CO)C2)c([O-])c1 ZINC001237046150 778999323 /nfs/dbraw/zinc/99/93/23/778999323.db2.gz QQSCZQGNHQHFLA-INIZCTEOSA-N 0 3 263.381 2.720 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@](C)(CO)C2)c([O-])c1 ZINC001237046150 778999325 /nfs/dbraw/zinc/99/93/25/778999325.db2.gz QQSCZQGNHQHFLA-INIZCTEOSA-N 0 3 263.381 2.720 20 10 CFCDHN C[C@@]1(O)CCCN(Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237141518 779024032 /nfs/dbraw/zinc/02/40/32/779024032.db2.gz YAGSIZHIBAZGTP-CYBMUJFWSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@@]1(O)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237141518 779024038 /nfs/dbraw/zinc/02/40/38/779024038.db2.gz YAGSIZHIBAZGTP-CYBMUJFWSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@@]1(O)CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237141518 779024047 /nfs/dbraw/zinc/02/40/47/779024047.db2.gz YAGSIZHIBAZGTP-CYBMUJFWSA-N 0 3 289.297 2.758 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3CCO[C@H]3C2)c1[O-] ZINC001237680031 779159771 /nfs/dbraw/zinc/15/97/71/779159771.db2.gz OCLRDCIPMARYAI-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3CCO[C@H]3C2)c1[O-] ZINC001237680031 779159773 /nfs/dbraw/zinc/15/97/73/779159773.db2.gz OCLRDCIPMARYAI-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC[C@@H]3CCO[C@H]3C2)c1O ZINC001237680031 779159777 /nfs/dbraw/zinc/15/97/77/779159777.db2.gz OCLRDCIPMARYAI-RISCZKNCSA-N 0 3 281.783 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c1[O-] ZINC001237686760 779160745 /nfs/dbraw/zinc/16/07/45/779160745.db2.gz NHMOKYVYUUNCRB-PYHGIMPFSA-N 0 3 293.794 2.963 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c1[O-] ZINC001237686760 779160751 /nfs/dbraw/zinc/16/07/51/779160751.db2.gz NHMOKYVYUUNCRB-PYHGIMPFSA-N 0 3 293.794 2.963 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)[C@@H](F)CC2)c1[O-] ZINC001237681379 779161250 /nfs/dbraw/zinc/16/12/50/779161250.db2.gz ONNHXZCNZWFBRO-QWHCGFSZSA-N 0 3 287.762 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)[C@@H](F)CC2)c1[O-] ZINC001237681379 779161254 /nfs/dbraw/zinc/16/12/54/779161254.db2.gz ONNHXZCNZWFBRO-QWHCGFSZSA-N 0 3 287.762 2.649 20 10 CFCDHN CN(CCC[NH+](C)C)Cc1cc(F)c(Cl)cc1[O-] ZINC001237946291 779214425 /nfs/dbraw/zinc/21/44/25/779214425.db2.gz IIVHGAMYXRKMST-UHFFFAOYSA-N 0 3 274.767 2.568 20 10 CFCDHN COC(=O)CC[C@@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065870 779244014 /nfs/dbraw/zinc/24/40/14/779244014.db2.gz CEDZHSGMRLTHPY-GFCCVEGCSA-N 0 3 295.354 2.615 20 10 CFCDHN COC(=O)CC[C@@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])C1 ZINC001238065870 779244018 /nfs/dbraw/zinc/24/40/18/779244018.db2.gz CEDZHSGMRLTHPY-GFCCVEGCSA-N 0 3 295.354 2.615 20 10 CFCDHN C[C@H](COc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000699375873 779251848 /nfs/dbraw/zinc/25/18/48/779251848.db2.gz KYPLFMMWNFKMRS-CYBMUJFWSA-N 0 3 257.333 2.949 20 10 CFCDHN CC(=O)N1CCCN(Cc2cc(C(C)C)ccc2O)CC1 ZINC001205129786 779283578 /nfs/dbraw/zinc/28/35/78/779283578.db2.gz ATXTVTGSJJKVGC-UHFFFAOYSA-N 0 3 290.407 2.570 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@H]1CCCC[C@H]1[NH3+] ZINC001236213676 779501009 /nfs/dbraw/zinc/50/10/09/779501009.db2.gz AVPKNTHIBARGDD-OLZOCXBDSA-N 0 3 268.788 2.747 20 10 CFCDHN Cc1cc(F)cc(CN2CC(N3CCCCC3)C2)c1O ZINC001238071327 779739347 /nfs/dbraw/zinc/73/93/47/779739347.db2.gz VNELYTXRVXXQBC-UHFFFAOYSA-N 0 3 278.371 2.510 20 10 CFCDHN CNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])cc1 ZINC000386568450 779931274 /nfs/dbraw/zinc/93/12/74/779931274.db2.gz PHKNJDAJKRTLFU-ZDUSSCGKSA-N 0 3 298.386 2.911 20 10 CFCDHN O=C1CCN(Cc2ccccc2O)[C@H]2CCCC[C@@H]12 ZINC001203546881 779977755 /nfs/dbraw/zinc/97/77/55/779977755.db2.gz BMGPHNXZWRUVBY-KGLIPLIRSA-N 0 3 259.349 2.726 20 10 CFCDHN CC(C)(C)OC(=O)O[C@@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC001203547791 779979488 /nfs/dbraw/zinc/97/94/88/779979488.db2.gz YSDBWOCOOCPKBA-CYBMUJFWSA-N 0 3 293.363 2.918 20 10 CFCDHN CC(C)(C)OC(=O)O[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC001203547791 779979496 /nfs/dbraw/zinc/97/94/96/779979496.db2.gz YSDBWOCOOCPKBA-CYBMUJFWSA-N 0 3 293.363 2.918 20 10 CFCDHN CCc1nc(C2CC[NH+](Cc3ccccc3[O-])CC2)no1 ZINC001203558657 780074735 /nfs/dbraw/zinc/07/47/35/780074735.db2.gz SNFYLSRJMBGRPQ-UHFFFAOYSA-N 0 3 287.363 2.717 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])OCC ZINC000705376945 781140021 /nfs/dbraw/zinc/14/00/21/781140021.db2.gz KQCLVZVPHQXJHP-ZDUSSCGKSA-N 0 3 255.333 2.826 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H](O)[C@H]2C)c([O-])c1 ZINC000295029951 199308686 /nfs/dbraw/zinc/30/86/86/199308686.db2.gz NWKXTVOZMBPBEM-IUODEOHRSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H](O)[C@H]2C)c([O-])c1 ZINC000295029951 199308688 /nfs/dbraw/zinc/30/86/88/199308688.db2.gz NWKXTVOZMBPBEM-IUODEOHRSA-N 0 3 279.380 2.526 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])[C@@H](O)C(F)F ZINC000295030255 199310032 /nfs/dbraw/zinc/31/00/32/199310032.db2.gz LOYDZMRIYVQWJY-ZYHUDNBSSA-N 0 3 293.741 2.848 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@H]3CCC[C@@H]32)cc1C ZINC000057100722 346619415 /nfs/dbraw/zinc/61/94/15/346619415.db2.gz FMXOGUNQSOYNAC-HOCLYGCPSA-N 0 3 261.365 2.762 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(n3cccn3)CC2)c1 ZINC000092618182 347635169 /nfs/dbraw/zinc/63/51/69/347635169.db2.gz KPRROSRVMUVMMK-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H](O)c2ccc(C)cc2)c1[O-] ZINC000237208858 348239727 /nfs/dbraw/zinc/23/97/27/348239727.db2.gz ABQMSNNIUKJDAM-OAHLLOKOSA-N 0 3 287.359 2.532 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H](C)CCO)c1ccccc1[O-] ZINC000295178861 199390709 /nfs/dbraw/zinc/39/07/09/199390709.db2.gz VHZMZMCGIGEBSM-TZMCWYRMSA-N 0 3 251.370 2.842 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[NH2+][C@H]1C[C@@H](O)C1 ZINC000294862211 199219234 /nfs/dbraw/zinc/21/92/34/199219234.db2.gz OKKRPKZRJWITHS-IYBDPMFKSA-N 0 3 299.370 2.584 20 10 CFCDHN CC(C)(C)[C@@H](CCO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296308158 199849478 /nfs/dbraw/zinc/84/94/78/199849478.db2.gz DZAZQLAIIYEXMQ-GXTWGEPZSA-N 0 3 263.381 2.766 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@H]2CCc3cccc([O-])c32)CC1 ZINC000297037242 200068070 /nfs/dbraw/zinc/06/80/70/200068070.db2.gz UZWWYWVAUJHSNF-XJKSGUPXSA-N 0 3 275.392 2.766 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)Cc1cccc(F)c1)c1ccccc1[O-] ZINC000297338763 200154217 /nfs/dbraw/zinc/15/42/17/200154217.db2.gz OIEUWXOOGCABAG-DOMZBBRYSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1cc(Cl)cc(CN2CC(C(C)(C)O)C2)c1O ZINC000297508475 200214066 /nfs/dbraw/zinc/21/40/66/200214066.db2.gz WYBDTXVVVUPTHU-UHFFFAOYSA-N 0 3 269.772 2.557 20 10 CFCDHN CC(C)(C)OC(=O)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297556735 200227705 /nfs/dbraw/zinc/22/77/05/200227705.db2.gz FXLNFTFJZUSJNN-LBPRGKRZSA-N 0 3 277.364 2.701 20 10 CFCDHN C[C@@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1ccsc1 ZINC000297944214 200307450 /nfs/dbraw/zinc/30/74/50/200307450.db2.gz YFDDFEAIDVGNLO-CZUORRHYSA-N 0 3 289.400 2.938 20 10 CFCDHN C[C@@H](NCC[S@@](=O)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000127304062 296126698 /nfs/dbraw/zinc/12/66/98/296126698.db2.gz HHRMCFBNKHZVPJ-XCLFUZPHSA-N 0 3 296.480 2.950 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2ccccn2)c1[O-] ZINC000019916603 372209872 /nfs/dbraw/zinc/20/98/72/372209872.db2.gz QQXXAEUVEFEUBN-UHFFFAOYSA-N 0 3 272.348 2.518 20 10 CFCDHN CN(C)C1(C[NH2+]Cc2ccccc2[O-])CCCCC1 ZINC000020094551 372230717 /nfs/dbraw/zinc/23/07/17/372230717.db2.gz BAVDNTNJTSORML-UHFFFAOYSA-N 0 3 262.397 2.746 20 10 CFCDHN C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1[O-] ZINC000028396962 372363975 /nfs/dbraw/zinc/36/39/75/372363975.db2.gz ICHQQQQBJRFPDC-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1[O-] ZINC000028396962 372363981 /nfs/dbraw/zinc/36/39/81/372363981.db2.gz ICHQQQQBJRFPDC-UHFFFAOYSA-N 0 3 286.331 2.975 20 10 CFCDHN Cc1cccc(C[NH2+]C2Cc3ccccc3C2)c1[O-] ZINC000083396429 374741651 /nfs/dbraw/zinc/74/16/51/374741651.db2.gz CFJIXVOBNRDACH-UHFFFAOYSA-N 0 3 253.345 2.958 20 10 CFCDHN Cc1nn(C)c(C)c1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000092324402 375101609 /nfs/dbraw/zinc/10/16/09/375101609.db2.gz QVKTUBFEXCFQLE-GFCCVEGCSA-N 0 3 286.423 2.954 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](n3cccn3)C2)c1 ZINC000092968146 375170443 /nfs/dbraw/zinc/17/04/43/375170443.db2.gz XZXCDBRUHVNKOV-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](n3cccn3)C2)c1 ZINC000092968146 375170448 /nfs/dbraw/zinc/17/04/48/375170448.db2.gz XZXCDBRUHVNKOV-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN CCOc1cccc(C[N@H+](CCC(=O)OC)C(C)C)c1[O-] ZINC000093383962 375224879 /nfs/dbraw/zinc/22/48/79/375224879.db2.gz BXZJWFXGJWGBOB-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCC(=O)OC)C(C)C)c1[O-] ZINC000093383962 375224884 /nfs/dbraw/zinc/22/48/84/375224884.db2.gz BXZJWFXGJWGBOB-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644848 375283767 /nfs/dbraw/zinc/28/37/67/375283767.db2.gz WLXODUYAJMGOHB-HIFRSBDPSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644848 375283769 /nfs/dbraw/zinc/28/37/69/375283769.db2.gz WLXODUYAJMGOHB-HIFRSBDPSA-N 0 3 292.423 2.705 20 10 CFCDHN CCOc1cccc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1[O-] ZINC000093661060 375289216 /nfs/dbraw/zinc/28/92/16/375289216.db2.gz JDNZUDBDTPYHFX-BETUJISGSA-N 0 3 261.365 2.879 20 10 CFCDHN CCOc1cccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1[O-] ZINC000093661060 375289224 /nfs/dbraw/zinc/28/92/24/375289224.db2.gz JDNZUDBDTPYHFX-BETUJISGSA-N 0 3 261.365 2.879 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H](Oc3cccnc3)C2)cc1 ZINC000093690487 375297461 /nfs/dbraw/zinc/29/74/61/375297461.db2.gz FSONAPHPGKEMPT-SFHVURJKSA-N 0 3 297.402 2.801 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000093597488 375271735 /nfs/dbraw/zinc/27/17/35/375271735.db2.gz BZDSWGFJWBMZTD-CYBMUJFWSA-N 0 3 294.826 2.963 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(N(C)C)CCC2)c([O-])c1 ZINC000097928440 375588213 /nfs/dbraw/zinc/58/82/13/375588213.db2.gz HLIOWPWQPBTILH-ZDUSSCGKSA-N 0 3 262.397 2.836 20 10 CFCDHN CO[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000130263564 377530213 /nfs/dbraw/zinc/53/02/13/377530213.db2.gz OQBOGLWMBCLVKO-ZDUSSCGKSA-N 0 3 266.360 2.503 20 10 CFCDHN CCCOc1ccc(C[N@H+](CC)CCOC)c([O-])c1 ZINC000133272653 377917318 /nfs/dbraw/zinc/91/73/18/377917318.db2.gz GTIDVBKHWSRCAC-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCCOc1ccc(C[N@@H+](CC)CCOC)c([O-])c1 ZINC000133272653 377917321 /nfs/dbraw/zinc/91/73/21/377917321.db2.gz GTIDVBKHWSRCAC-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN Cc1cc(C)n(CCC[NH2+]Cc2cc(C)ccc2[O-])n1 ZINC000134604614 378037102 /nfs/dbraw/zinc/03/71/02/378037102.db2.gz UPUATWZBHADCRV-UHFFFAOYSA-N 0 3 273.380 2.694 20 10 CFCDHN COc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccccc2[O-])cc1 ZINC000153997516 378530742 /nfs/dbraw/zinc/53/07/42/378530742.db2.gz JQLHITXRPWBGHX-SJCJKPOMSA-N 0 3 287.359 2.785 20 10 CFCDHN C[C@@H](NC[C@H](C)O)c1ccc(N2CCCCC2)c(F)c1 ZINC000179579989 380560361 /nfs/dbraw/zinc/56/03/61/380560361.db2.gz KENZEGXCAMIDMR-QWHCGFSZSA-N 0 3 280.387 2.847 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H]2CN2CCCC2)c1 ZINC000179646834 380566545 /nfs/dbraw/zinc/56/65/45/380566545.db2.gz PDSOXLUUVNOJIE-INIZCTEOSA-N 0 3 274.408 2.761 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H]2CN2CCCC2)c1 ZINC000179646834 380566549 /nfs/dbraw/zinc/56/65/49/380566549.db2.gz PDSOXLUUVNOJIE-INIZCTEOSA-N 0 3 274.408 2.761 20 10 CFCDHN COC[C@H](C)[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179788683 380580407 /nfs/dbraw/zinc/58/04/07/380580407.db2.gz MZHCIBAJNYGGDP-JTQLQIEISA-N 0 3 257.761 2.821 20 10 CFCDHN COC[C@H](C)[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179788683 380580411 /nfs/dbraw/zinc/58/04/11/380580411.db2.gz MZHCIBAJNYGGDP-JTQLQIEISA-N 0 3 257.761 2.821 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCc2ccccc2)cc1OC ZINC000181541972 380821521 /nfs/dbraw/zinc/82/15/21/380821521.db2.gz MCUJUECIZXQZGM-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC2=CCCOC2)c([O-])c1 ZINC000288419163 381011943 /nfs/dbraw/zinc/01/19/43/381011943.db2.gz JODJJYVEEPVLRC-UHFFFAOYSA-N 0 3 277.364 2.617 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1 ZINC000289270398 381027778 /nfs/dbraw/zinc/02/77/78/381027778.db2.gz GHWWIJRGMQDUOM-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1 ZINC000289270398 381027785 /nfs/dbraw/zinc/02/77/85/381027785.db2.gz GHWWIJRGMQDUOM-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H]2COc3ccccc32)c1[O-] ZINC000289223804 381027842 /nfs/dbraw/zinc/02/78/42/381027842.db2.gz AGAVPFAPDHUBID-CQSZACIVSA-N 0 3 269.344 2.966 20 10 CFCDHN CCC1([NH2+]Cc2cc(OC)c(OC)cc2[O-])CCC1 ZINC000182538940 381109516 /nfs/dbraw/zinc/10/95/16/381109516.db2.gz ABBMSISASYUPHO-UHFFFAOYSA-N 0 3 265.353 2.832 20 10 CFCDHN CCCN1CC[C@H](C[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000295976979 381195156 /nfs/dbraw/zinc/19/51/56/381195156.db2.gz MZCTZPYKPVXYLY-HIFRSBDPSA-N 0 3 274.408 2.701 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295996545 381203277 /nfs/dbraw/zinc/20/32/77/381203277.db2.gz OABOZSRBBLDNDF-HOCLYGCPSA-N 0 3 299.370 2.711 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)c1ccccc1)CC2 ZINC000296012553 381211167 /nfs/dbraw/zinc/21/11/67/381211167.db2.gz OZYMIGDCHAUYSX-HOCLYGCPSA-N 0 3 269.344 2.703 20 10 CFCDHN C[C@@H]([NH2+]CCCOC1CCOCC1)c1ccccc1[O-] ZINC000183612024 381293083 /nfs/dbraw/zinc/29/30/83/381293083.db2.gz YTCKZDZNPPHXLV-CYBMUJFWSA-N 0 3 279.380 2.629 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(O)CCc2ccccc21)c1ccccc1[O-] ZINC000183628129 381297216 /nfs/dbraw/zinc/29/72/16/381297216.db2.gz HGUMBAOKUXDWMZ-ACJLOTCBSA-N 0 3 283.371 2.877 20 10 CFCDHN COc1cccc(C[NH2+]CCCC(C)(F)F)c1[O-] ZINC000296204940 381300830 /nfs/dbraw/zinc/30/08/30/381300830.db2.gz ZLOVAXSWFLMJGW-UHFFFAOYSA-N 0 3 259.296 2.926 20 10 CFCDHN COC1(C[NH2+]Cc2cc(F)ccc2[O-])CCCC1 ZINC000296140334 381271734 /nfs/dbraw/zinc/27/17/34/381271734.db2.gz VBYIDNITXYKAOR-UHFFFAOYSA-N 0 3 253.317 2.580 20 10 CFCDHN C[C@H]([NH2+]CCN(C)C(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183484067 381277380 /nfs/dbraw/zinc/27/73/80/381277380.db2.gz DCPDLWQZTXNAIB-LBPRGKRZSA-N 0 3 294.395 2.910 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CO)C2)c([O-])c1C ZINC000296293386 381336211 /nfs/dbraw/zinc/33/62/11/381336211.db2.gz FPASRLRIVQZGJN-MJBXVCDLSA-N 0 3 263.381 2.821 20 10 CFCDHN CCCC[N@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184672548 381458329 /nfs/dbraw/zinc/45/83/29/381458329.db2.gz HGHHUVDBHVUVIB-UHFFFAOYSA-N 0 3 287.787 2.649 20 10 CFCDHN CCCC[N@@H+](CCO)Cc1cc(Cl)cc(OC)c1[O-] ZINC000184672548 381458334 /nfs/dbraw/zinc/45/83/34/381458334.db2.gz HGHHUVDBHVUVIB-UHFFFAOYSA-N 0 3 287.787 2.649 20 10 CFCDHN CC[C@](C)(CCO)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000184710014 381464965 /nfs/dbraw/zinc/46/49/65/381464965.db2.gz NBUNQGPBJSIHLZ-CQSZACIVSA-N 0 3 287.787 2.695 20 10 CFCDHN CC[C@H](C[NH2+][C@H](C)c1cc(OC)ccc1[O-])N1CCCC1 ZINC000184990872 381507913 /nfs/dbraw/zinc/50/79/13/381507913.db2.gz NLXDVMXUTMLREX-ZIAGYGMSSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCN2CCCC[C@@H]2C)c1 ZINC000185028069 381516354 /nfs/dbraw/zinc/51/63/54/381516354.db2.gz QZJXEFIXVBERMY-KBPBESRZSA-N 0 3 292.423 2.926 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCc1ccncc1)CC2 ZINC000297098202 381551443 /nfs/dbraw/zinc/55/14/43/381551443.db2.gz XPAQMLKSXKYCEF-AWEZNQCLSA-N 0 3 254.333 2.607 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](CCO)C(C)(C)C)c1 ZINC000185196521 381560702 /nfs/dbraw/zinc/56/07/02/381560702.db2.gz VKCKBGFNWTZPGJ-NHYWBVRUSA-N 0 3 281.396 2.849 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185350340 381607914 /nfs/dbraw/zinc/60/79/14/381607914.db2.gz GEBUTTTUOMYOGH-ZJUUUORDSA-N 0 3 277.343 2.985 20 10 CFCDHN C[C@@H](O)CC[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185456435 381638132 /nfs/dbraw/zinc/63/81/32/381638132.db2.gz VGOQZYYYBPZRGV-VXGBXAGGSA-N 0 3 263.381 2.693 20 10 CFCDHN C[C@H]([NH2+][C@H]1Cc2ccccc2[C@@H]1O)c1cc(F)ccc1[O-] ZINC000185466713 381642536 /nfs/dbraw/zinc/64/25/36/381642536.db2.gz RKLAXSJHUQSVMA-QXKQMHMISA-N 0 3 287.334 2.840 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](O)c1ccsc1)c1cc(F)ccc1[O-] ZINC000185514035 381655264 /nfs/dbraw/zinc/65/52/64/381655264.db2.gz XUZLNUDEYYMRRJ-YMTOWFKASA-N 0 3 281.352 2.977 20 10 CFCDHN C[C@H]([NH2+]CCCC(C)(C)CO)c1cc(F)ccc1[O-] ZINC000185537825 381659936 /nfs/dbraw/zinc/65/99/36/381659936.db2.gz BAIYPEJCSLLCCZ-NSHDSACASA-N 0 3 269.360 2.981 20 10 CFCDHN CCCN(CC)CC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185631797 381687515 /nfs/dbraw/zinc/68/75/15/381687515.db2.gz LEGXRDMYZQPKIB-CYBMUJFWSA-N 0 3 280.412 2.783 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3c[nH]nc3C2)c([O-])c1C ZINC000359963514 381700268 /nfs/dbraw/zinc/70/02/68/381700268.db2.gz ZRVGYSPWYAFYNE-OCCSQVGLSA-N 0 3 285.391 2.940 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CC[C@H](CO)CC2)c1 ZINC000185735927 381719598 /nfs/dbraw/zinc/71/95/98/381719598.db2.gz HJCRGDUMAGEXOB-MELADBBJSA-N 0 3 263.381 2.902 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)Cc2cc(C)n[nH]2)c1 ZINC000186130882 381829550 /nfs/dbraw/zinc/82/95/50/381829550.db2.gz RNCSSNCAFZBBHR-CMPLNLGQSA-N 0 3 289.379 2.714 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)CC(C)(C)C)c1 ZINC000186143459 381833766 /nfs/dbraw/zinc/83/37/66/381833766.db2.gz ROADPXQPXUMCJD-RYUDHWBXSA-N 0 3 281.396 2.849 20 10 CFCDHN CCOc1cccc(C[N@H+](C)C(C)(C)COC)c1[O-] ZINC000292832891 381855669 /nfs/dbraw/zinc/85/56/69/381855669.db2.gz RLBIRYHYDYNMSL-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)C(C)(C)COC)c1[O-] ZINC000292832891 381855679 /nfs/dbraw/zinc/85/56/79/381855679.db2.gz RLBIRYHYDYNMSL-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCCCS(C)(=O)=O)c([O-])c1 ZINC000186852860 382030282 /nfs/dbraw/zinc/03/02/82/382030282.db2.gz XFDHBJCLTFSTJI-CYBMUJFWSA-N 0 3 299.436 2.566 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000376285154 382128978 /nfs/dbraw/zinc/12/89/78/382128978.db2.gz PQTJNOOZVIYLMC-AHICOJMPSA-N 0 3 275.392 2.936 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000376285154 382128981 /nfs/dbraw/zinc/12/89/81/382128981.db2.gz PQTJNOOZVIYLMC-AHICOJMPSA-N 0 3 275.392 2.936 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC3(CCOCC3)[C@H]2C)c1 ZINC000375235654 382074383 /nfs/dbraw/zinc/07/43/83/382074383.db2.gz BEVPYIGQSNYFJJ-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC3(CCOCC3)[C@H]2C)c1 ZINC000375235654 382074389 /nfs/dbraw/zinc/07/43/89/382074389.db2.gz BEVPYIGQSNYFJJ-CYBMUJFWSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCCN2C)c([O-])c1 ZINC000293586079 382185973 /nfs/dbraw/zinc/18/59/73/382185973.db2.gz FFRAAUOYGZIPFF-ZIAGYGMSSA-N 0 3 262.397 2.754 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H]2OCCC[C@H]12)c1cc(F)ccc1[O-] ZINC000187289034 382147685 /nfs/dbraw/zinc/14/76/85/382147685.db2.gz NGRDPKOUTBNGJO-AGNJHWRGSA-N 0 3 265.328 2.749 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CCC(CO)(c2ccccc2)CC1 ZINC000293521592 382156266 /nfs/dbraw/zinc/15/62/66/382156266.db2.gz BBYAJTUAHQIZQU-UHFFFAOYSA-N 0 3 297.398 2.918 20 10 CFCDHN COc1cccc(CN[C@H]2C[C@@H](CO)c3ccccc32)c1O ZINC000376958357 382197089 /nfs/dbraw/zinc/19/70/89/382197089.db2.gz PKIYFTVEPNGFAN-BBRMVZONSA-N 0 3 299.370 2.711 20 10 CFCDHN CCC[C@@H](C[NH2+][C@H](C)c1cc(OC)ccc1[O-])OC ZINC000293749251 382262435 /nfs/dbraw/zinc/26/24/35/382262435.db2.gz TWPNDWVLZJAUGO-YPMHNXCESA-N 0 3 267.369 2.867 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2C[C@@H](CO)c3ccccc32)c1 ZINC000364540419 382324578 /nfs/dbraw/zinc/32/45/78/382324578.db2.gz CVMBGASOLCTHSD-GUYCJALGSA-N 0 3 299.370 2.711 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2C[C@@H](CO)c3ccccc32)c1 ZINC000364540419 382324583 /nfs/dbraw/zinc/32/45/83/382324583.db2.gz CVMBGASOLCTHSD-GUYCJALGSA-N 0 3 299.370 2.711 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000188035980 382330666 /nfs/dbraw/zinc/33/06/66/382330666.db2.gz BSQAYNASGPQHJT-GZBFAFLISA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c([O-])c1C ZINC000377803361 382349795 /nfs/dbraw/zinc/34/97/95/382349795.db2.gz VKVUDCRXROGYPA-STQMWFEESA-N 0 3 285.391 2.940 20 10 CFCDHN CC(C)[C@@]1(CO)CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000293997732 382371565 /nfs/dbraw/zinc/37/15/65/382371565.db2.gz MAJNQPSNCXCHCX-INIZCTEOSA-N 0 3 281.371 2.762 20 10 CFCDHN CC(C)[C@@]1(CO)CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000293997732 382371568 /nfs/dbraw/zinc/37/15/68/382371568.db2.gz MAJNQPSNCXCHCX-INIZCTEOSA-N 0 3 281.371 2.762 20 10 CFCDHN [O-]c1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000378164143 382410835 /nfs/dbraw/zinc/41/08/35/382410835.db2.gz KXPKIVSKGPVLMS-GFCCVEGCSA-N 0 3 277.755 2.936 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H](CO)C2)c1[O-] ZINC000378436672 382459369 /nfs/dbraw/zinc/45/93/69/382459369.db2.gz CRDOOYPNXRNLGK-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H](CO)C2)c1[O-] ZINC000378436672 382459371 /nfs/dbraw/zinc/45/93/71/382459371.db2.gz CRDOOYPNXRNLGK-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN CCOC[C@H]([NH2+]Cc1cc(OCC)ccc1[O-])C(C)C ZINC000188866164 382495177 /nfs/dbraw/zinc/49/51/77/382495177.db2.gz BSTKWBZFOAHCTO-HNNXBMFYSA-N 0 3 281.396 2.942 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccnc(-n2ccnc2)c1)c1ccccc1[O-] ZINC000378631597 382496007 /nfs/dbraw/zinc/49/60/07/382496007.db2.gz JTBNKYLOKULENT-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN CCOCCOCCN(C)Cc1ccc(N(C)C)c(C)c1 ZINC000294430543 382512553 /nfs/dbraw/zinc/51/25/53/382512553.db2.gz DYLXRXICOQHGPK-UHFFFAOYSA-N 0 3 294.439 2.546 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)cc1C ZINC000366651565 382539500 /nfs/dbraw/zinc/53/95/00/382539500.db2.gz IIDJAJJMOZHUOT-CABCVRRESA-N 0 3 275.392 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)cc1C ZINC000366651565 382539505 /nfs/dbraw/zinc/53/95/05/382539505.db2.gz IIDJAJJMOZHUOT-CABCVRRESA-N 0 3 275.392 2.867 20 10 CFCDHN Cc1ncsc1CC[NH2+]Cc1cccc(C)c1[O-] ZINC000295140514 382578042 /nfs/dbraw/zinc/57/80/42/382578042.db2.gz ZRHDRXKPAKOYFX-UHFFFAOYSA-N 0 3 262.378 2.798 20 10 CFCDHN CC[C@H]([NH2+]CCOCC(F)F)c1ccccc1[O-] ZINC000189846758 382642556 /nfs/dbraw/zinc/64/25/56/382642556.db2.gz RHUIZLWDNXKICP-NSHDSACASA-N 0 3 259.296 2.715 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@](CC)(CO)C2)c1[O-] ZINC000190219942 382657406 /nfs/dbraw/zinc/65/74/06/382657406.db2.gz YUBVDOBBRQHPKQ-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@](CC)(CO)C2)c1[O-] ZINC000190219942 382657407 /nfs/dbraw/zinc/65/74/07/382657407.db2.gz YUBVDOBBRQHPKQ-QGZVFWFLSA-N 0 3 293.407 2.775 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2(C)OCCCO2)c1 ZINC000190658773 382676745 /nfs/dbraw/zinc/67/67/45/382676745.db2.gz MZYQDRPOPIFKAS-GFCCVEGCSA-N 0 3 265.353 2.504 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCCC[C@H]2O)c1 ZINC000246992552 383129229 /nfs/dbraw/zinc/12/92/29/383129229.db2.gz MQVRLCKZQXJFEJ-SLEUVZQESA-N 0 3 279.380 2.603 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c1 ZINC000251695542 383394108 /nfs/dbraw/zinc/39/41/08/383394108.db2.gz JQKKOGWHQXCEDW-DMEJVMROSA-N 0 3 261.365 2.919 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252743429 383432657 /nfs/dbraw/zinc/43/26/57/383432657.db2.gz PMXMBPVGVNZNBF-STQMWFEESA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252743429 383432661 /nfs/dbraw/zinc/43/26/61/383432661.db2.gz PMXMBPVGVNZNBF-STQMWFEESA-N 0 3 280.799 2.762 20 10 CFCDHN Cc1cc([O-])c(CN[C@@H]2CC[NH2+]C23CCC3)c(Cl)c1 ZINC000530245507 383769182 /nfs/dbraw/zinc/76/91/82/383769182.db2.gz YNEQVZVQVWZLKU-CQSZACIVSA-N 0 3 280.799 2.728 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H](OC)C(C)C)c1 ZINC000266623556 384210590 /nfs/dbraw/zinc/21/05/90/384210590.db2.gz MFGNJJFNYZXVPA-HNNXBMFYSA-N 0 3 267.369 2.552 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@H](OC)C(C)C)c([O-])c1 ZINC000266652192 384215409 /nfs/dbraw/zinc/21/54/09/384215409.db2.gz ZAFIOSGKURVPLZ-INIZCTEOSA-N 0 3 281.396 2.942 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1ccccc1[O-] ZINC000267305949 384353962 /nfs/dbraw/zinc/35/39/62/384353962.db2.gz VYYSLEZJXNLSHJ-UHFFFAOYSA-N 0 3 265.353 2.604 20 10 CFCDHN CC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCCO1 ZINC000281255603 385186597 /nfs/dbraw/zinc/18/65/97/385186597.db2.gz MWSCTMAGBFIBSN-CQSZACIVSA-N 0 3 280.387 2.893 20 10 CFCDHN CC1=C(C)CN(Cc2cc3c(cc2O)OCO3)CC1 ZINC000281207719 385187890 /nfs/dbraw/zinc/18/78/90/385187890.db2.gz SKTJLWKRAVUVGB-UHFFFAOYSA-N 0 3 261.321 2.663 20 10 CFCDHN CC1=C(C)C[N@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000281207719 385187901 /nfs/dbraw/zinc/18/79/01/385187901.db2.gz SKTJLWKRAVUVGB-UHFFFAOYSA-N 0 3 261.321 2.663 20 10 CFCDHN CC1=C(C)C[N@@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000281207719 385187910 /nfs/dbraw/zinc/18/79/10/385187910.db2.gz SKTJLWKRAVUVGB-UHFFFAOYSA-N 0 3 261.321 2.663 20 10 CFCDHN CCC[N@H+](CCN1CCCC1)Cc1ccccc1[O-] ZINC000270643621 385175307 /nfs/dbraw/zinc/17/53/07/385175307.db2.gz SCXLGYHUVDWIHO-UHFFFAOYSA-N 0 3 262.397 2.700 20 10 CFCDHN CCC[N@@H+](CCN1CCCC1)Cc1ccccc1[O-] ZINC000270643621 385175310 /nfs/dbraw/zinc/17/53/10/385175310.db2.gz SCXLGYHUVDWIHO-UHFFFAOYSA-N 0 3 262.397 2.700 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCCC23CCOCC3)c1[O-] ZINC000282545798 385338227 /nfs/dbraw/zinc/33/82/27/385338227.db2.gz CNAPANKYPMHVQB-HNNXBMFYSA-N 0 3 291.391 2.840 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(c3ncc[nH]3)CC2)c1 ZINC000271202442 385375404 /nfs/dbraw/zinc/37/54/04/385375404.db2.gz RFKNMRDHZHISOL-UHFFFAOYSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000271450048 385382954 /nfs/dbraw/zinc/38/29/54/385382954.db2.gz FZXJNABFYGSSFJ-ZWNOBZJWSA-N 0 3 290.329 2.717 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c1[O-] ZINC000271504848 385383903 /nfs/dbraw/zinc/38/39/03/385383903.db2.gz LCXKZFPUCDSLFU-ZFWWWQNUSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC(C)(C)CCCO)cc1C ZINC000271521184 385385018 /nfs/dbraw/zinc/38/50/18/385385018.db2.gz MWLMMYYVLTZSAU-UHFFFAOYSA-N 0 3 265.397 2.897 20 10 CFCDHN CCN(CC)c1ccc(CNCC2([S@](C)=O)CC2)cc1 ZINC000282489194 385325843 /nfs/dbraw/zinc/32/58/43/385325843.db2.gz VXLSBAKKOWKUQQ-FQEVSTJZSA-N 0 3 294.464 2.534 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C(C)(C)[C@H](C)O)c1[O-] ZINC000271797197 385392647 /nfs/dbraw/zinc/39/26/47/385392647.db2.gz IFKVGUZKNPPTGZ-VIFPVBQESA-N 0 3 257.761 2.603 20 10 CFCDHN Cc1cccc(C[N@H+](CCO)Cc2ccccc2)c1[O-] ZINC000271835158 385393723 /nfs/dbraw/zinc/39/37/23/385393723.db2.gz RVPJTBKVWPFESX-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN Cc1cccc(C[N@@H+](CCO)Cc2ccccc2)c1[O-] ZINC000271835158 385393725 /nfs/dbraw/zinc/39/37/25/385393725.db2.gz RVPJTBKVWPFESX-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN Cc1cccc(CN(CCO)Cc2ccccc2)c1O ZINC000271835158 385393728 /nfs/dbraw/zinc/39/37/28/385393728.db2.gz RVPJTBKVWPFESX-UHFFFAOYSA-N 0 3 271.360 2.695 20 10 CFCDHN NC(=O)c1ccc(C[N@H+](Cc2ccccc2[O-])C2CC2)cc1 ZINC000272300300 385502796 /nfs/dbraw/zinc/50/27/96/385502796.db2.gz PNJHWRGMEGKJIN-UHFFFAOYSA-N 0 3 296.370 2.656 20 10 CFCDHN NC(=O)c1ccc(C[N@@H+](Cc2ccccc2[O-])C2CC2)cc1 ZINC000272300300 385502799 /nfs/dbraw/zinc/50/27/99/385502799.db2.gz PNJHWRGMEGKJIN-UHFFFAOYSA-N 0 3 296.370 2.656 20 10 CFCDHN CCCOc1ccc(C[NH2+]CCC2(O)CCC2)c([O-])c1 ZINC000283919304 385514089 /nfs/dbraw/zinc/51/40/89/385514089.db2.gz IRTQRZGSOHAFOO-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)n(C)n1 ZINC000284213766 385546468 /nfs/dbraw/zinc/54/64/68/385546468.db2.gz GYYONRSBLOZZSN-ZDUSSCGKSA-N 0 3 272.396 2.645 20 10 CFCDHN Cc1cccc(C[N@@H+](CC2CCC2)[C@@H](C)CO)c1[O-] ZINC000284336993 385547347 /nfs/dbraw/zinc/54/73/47/385547347.db2.gz XPBZCKROWFTRAP-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc(C[N@H+](CC2CCC2)[C@@H](C)CO)c1[O-] ZINC000284336993 385547352 /nfs/dbraw/zinc/54/73/52/385547352.db2.gz XPBZCKROWFTRAP-ZDUSSCGKSA-N 0 3 263.381 2.684 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000284996156 385551094 /nfs/dbraw/zinc/55/10/94/385551094.db2.gz JELYYTZCNZKJNT-KGLIPLIRSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000284996156 385551096 /nfs/dbraw/zinc/55/10/96/385551096.db2.gz JELYYTZCNZKJNT-KGLIPLIRSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284948101 385551291 /nfs/dbraw/zinc/55/12/91/385551291.db2.gz HMGKDKPSRYJBRW-ZBFHGGJFSA-N 0 3 277.364 2.544 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284948101 385551298 /nfs/dbraw/zinc/55/12/98/385551298.db2.gz HMGKDKPSRYJBRW-ZBFHGGJFSA-N 0 3 277.364 2.544 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000285358947 385553762 /nfs/dbraw/zinc/55/37/62/385553762.db2.gz YWCUFEMGKWTBMQ-GJZGRUSLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1[O-] ZINC000285358947 385553767 /nfs/dbraw/zinc/55/37/67/385553767.db2.gz YWCUFEMGKWTBMQ-GJZGRUSLSA-N 0 3 291.391 2.934 20 10 CFCDHN CCC[C@]1([NH2+]Cc2cccc(OCC)c2[O-])CCOC1 ZINC000285462174 385555338 /nfs/dbraw/zinc/55/53/38/385555338.db2.gz JUMSTMXCIQLXCF-INIZCTEOSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)C[C@@H]2CCCC[C@@H]2O)cc1C ZINC000272704527 385592481 /nfs/dbraw/zinc/59/24/81/385592481.db2.gz ZKMWRXHTTUIKSV-HOCLYGCPSA-N 0 3 277.408 2.992 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)cc1C ZINC000272704527 385592486 /nfs/dbraw/zinc/59/24/86/385592486.db2.gz ZKMWRXHTTUIKSV-HOCLYGCPSA-N 0 3 277.408 2.992 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCC[C@@H](C(=O)N(C)C)C1)c1ccccc1[O-] ZINC000272843567 385631547 /nfs/dbraw/zinc/63/15/47/385631547.db2.gz JWHBCDWVSRHFOK-MJBXVCDLSA-N 0 3 290.407 2.690 20 10 CFCDHN COC[C@@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273304003 385677218 /nfs/dbraw/zinc/67/72/18/385677218.db2.gz CHNYEUNMTRXDSI-GXFFZTMASA-N 0 3 251.370 2.942 20 10 CFCDHN Cc1ccc([C@H](C)NC[C@](C)(O)C(F)(F)F)c(O)c1C ZINC000273349500 385677622 /nfs/dbraw/zinc/67/76/22/385677622.db2.gz BLSWJFSGGVIYQP-GWCFXTLKSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1C ZINC000273349500 385677629 /nfs/dbraw/zinc/67/76/29/385677629.db2.gz BLSWJFSGGVIYQP-GWCFXTLKSA-N 0 3 291.313 2.973 20 10 CFCDHN Cc1nccn1CCC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000273364746 385678990 /nfs/dbraw/zinc/67/89/90/385678990.db2.gz DTOLDSOFJKKANM-CYBMUJFWSA-N 0 3 273.380 2.946 20 10 CFCDHN CCN(C)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273375864 385679368 /nfs/dbraw/zinc/67/93/68/385679368.db2.gz HEIXBFMAMNPCNZ-ZDUSSCGKSA-N 0 3 250.386 2.611 20 10 CFCDHN C[C@@H]([NH2+]CCNc1ccccn1)c1cc(F)ccc1[O-] ZINC000273368879 385679474 /nfs/dbraw/zinc/67/94/74/385679474.db2.gz BZETUNOFKMGNCL-LLVKDONJSA-N 0 3 275.327 2.689 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@@H]1O ZINC000273442751 385683267 /nfs/dbraw/zinc/68/32/67/385683267.db2.gz WSOKATNHEDDWCF-HIFRSBDPSA-N 0 3 281.371 2.760 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@@H]1O ZINC000273442751 385683274 /nfs/dbraw/zinc/68/32/74/385683274.db2.gz WSOKATNHEDDWCF-HIFRSBDPSA-N 0 3 281.371 2.760 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[S@@](C)=O)c([O-])c1C ZINC000273513150 385685465 /nfs/dbraw/zinc/68/54/65/385685465.db2.gz SDRVLKYKRQUONF-MJLGCCKJSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cn2cccn2)c([O-])c1C ZINC000273503750 385685795 /nfs/dbraw/zinc/68/57/95/385685795.db2.gz QPACLWZRCXLQPT-JSGCOSHPSA-N 0 3 273.380 2.945 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cc(F)ccc1[O-] ZINC000273516881 385686553 /nfs/dbraw/zinc/68/65/53/385686553.db2.gz SSPRPEOJOUEVKK-WCQYABFASA-N 0 3 295.354 2.868 20 10 CFCDHN C[C@H]([NH2+]CCN(C)CC(F)(F)F)c1cc(F)ccc1[O-] ZINC000273558532 385687408 /nfs/dbraw/zinc/68/74/08/385687408.db2.gz HMBCIFROTWRTDY-VIFPVBQESA-N 0 3 294.292 2.676 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2)N(C)C ZINC000273568671 385690203 /nfs/dbraw/zinc/69/02/03/385690203.db2.gz KDUSNTFEQWBCEO-OLZOCXBDSA-N 0 3 276.424 2.872 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1cc(F)ccc1[O-] ZINC000273596451 385691103 /nfs/dbraw/zinc/69/11/03/385691103.db2.gz QVEXHFBTISRPSY-XHDPSFHLSA-N 0 3 298.427 2.619 20 10 CFCDHN Cc1nccn1CC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000273595875 385691439 /nfs/dbraw/zinc/69/14/39/385691439.db2.gz QMSXWFBTZFDBJN-LBPRGKRZSA-N 0 3 259.353 2.556 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cc(C)ccc2[O-])[C@@]12CCCO2 ZINC000273609482 385691627 /nfs/dbraw/zinc/69/16/27/385691627.db2.gz OBIKUWYUKGGDHW-BBWFWOEESA-N 0 3 291.391 2.517 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c1 ZINC000273161143 385671436 /nfs/dbraw/zinc/67/14/36/385671436.db2.gz UGLGDCAQDNDSRS-DLBZAZTESA-N 0 3 291.391 2.838 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c1 ZINC000273161145 385671452 /nfs/dbraw/zinc/67/14/52/385671452.db2.gz UGLGDCAQDNDSRS-IRXDYDNUSA-N 0 3 291.391 2.838 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCN3CCCC[C@H]13)CC2 ZINC000295967133 285397672 /nfs/dbraw/zinc/39/76/72/285397672.db2.gz MKGTZVNWKUWAAO-RRFJBIMHSA-N 0 3 272.392 2.596 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCN(C3CC3)CC1)CC2 ZINC000295996566 285396941 /nfs/dbraw/zinc/39/69/41/285396941.db2.gz OADKQBCFTDOPNP-OAHLLOKOSA-N 0 3 272.392 2.596 20 10 CFCDHN CC[C@H](NCc1ccc2c(c1)CCN2C)c1cnn(C)c1 ZINC000372422829 393448661 /nfs/dbraw/zinc/44/86/61/393448661.db2.gz SPIYPZKDOWBHMD-INIZCTEOSA-N 0 3 284.407 2.653 20 10 CFCDHN Cc1noc([C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000179941069 393472272 /nfs/dbraw/zinc/47/22/72/393472272.db2.gz GAOYCKUTYZHFCV-NSHDSACASA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1noc([C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000179941069 393472277 /nfs/dbraw/zinc/47/22/77/393472277.db2.gz GAOYCKUTYZHFCV-NSHDSACASA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC(=O)N3CCCC[C@H]23)c([O-])c1 ZINC000374504875 393498482 /nfs/dbraw/zinc/49/84/82/393498482.db2.gz MLOXYYZMBOVMRI-AEGPPILISA-N 0 3 288.391 2.505 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1cc(F)ccc1[O-] ZINC000282279411 394123196 /nfs/dbraw/zinc/12/31/96/394123196.db2.gz BBZUIWWJXBJTGH-HZMBPMFUSA-N 0 3 289.354 2.993 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@@H](O)C2(CC2)C1 ZINC000364448492 394214232 /nfs/dbraw/zinc/21/42/32/394214232.db2.gz QDVHAJAKLOHTDZ-MRXNPFEDSA-N 0 3 269.344 2.502 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@@H](O)C2(CC2)C1 ZINC000364448492 394214237 /nfs/dbraw/zinc/21/42/37/394214237.db2.gz QDVHAJAKLOHTDZ-MRXNPFEDSA-N 0 3 269.344 2.502 20 10 CFCDHN C[N@@H+]1CC[C@@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731378 394276838 /nfs/dbraw/zinc/27/68/38/394276838.db2.gz GGXTXBYUWRRTDX-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@@]2(CCN(Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731378 394276841 /nfs/dbraw/zinc/27/68/41/394276841.db2.gz GGXTXBYUWRRTDX-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN CN1CC[C@@]2(CC[N@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731378 394276844 /nfs/dbraw/zinc/27/68/44/394276844.db2.gz GGXTXBYUWRRTDX-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN CN1CC[C@@]2(CC[N@@H+](Cc3c([O-])cccc3Cl)C2)C1 ZINC000292731378 394276848 /nfs/dbraw/zinc/27/68/48/394276848.db2.gz GGXTXBYUWRRTDX-OAHLLOKOSA-N 0 3 280.799 2.573 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCN(C3CC3)C[C@@H](C)C2)cc1C ZINC000296050062 394305323 /nfs/dbraw/zinc/30/53/23/394305323.db2.gz ONFOWNMRZJCYNX-ZDUSSCGKSA-N 0 3 288.435 2.925 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCN(C3CC3)C[C@@H](C)C2)cc1C ZINC000296050062 394305324 /nfs/dbraw/zinc/30/53/24/394305324.db2.gz ONFOWNMRZJCYNX-ZDUSSCGKSA-N 0 3 288.435 2.925 20 10 CFCDHN CN1CCC[C@H]2C[N@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036199 394353966 /nfs/dbraw/zinc/35/39/66/394353966.db2.gz VQIBVAMSZMEKKQ-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CCC[C@H]2C[N@@H+](Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036199 394353968 /nfs/dbraw/zinc/35/39/68/394353968.db2.gz VQIBVAMSZMEKKQ-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@@H+]1CCC[C@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036199 394353970 /nfs/dbraw/zinc/35/39/70/394353970.db2.gz VQIBVAMSZMEKKQ-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@H]2CN(Cc3cccc(Cl)c3[O-])CC[C@@H]21 ZINC000158036199 394353971 /nfs/dbraw/zinc/35/39/71/394353971.db2.gz VQIBVAMSZMEKKQ-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1[O-] ZINC000527804463 394410026 /nfs/dbraw/zinc/41/00/26/394410026.db2.gz PVCCUVZJYUFASZ-FJJYHAOUSA-N 0 3 279.380 2.692 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1[O-] ZINC000529668163 394418551 /nfs/dbraw/zinc/41/85/51/394418551.db2.gz DMBRFBAPABTOOP-YCWTYVPXSA-N 0 3 299.798 2.956 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H](O)[C@H]2CCCO2)c1[O-] ZINC000527954372 394431439 /nfs/dbraw/zinc/43/14/39/394431439.db2.gz JMNPRYAKOPVJQG-LEWSCRJBSA-N 0 3 299.798 2.545 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)Cc2ccccc2)c1 ZINC000063218538 292165922 /nfs/dbraw/zinc/16/59/22/292165922.db2.gz PMVGSAKCFOAVMA-HOCLYGCPSA-N 0 3 285.387 2.955 20 10 CFCDHN COc1ccc(O)c(CN[C@@H](C)c2ccccn2)c1 ZINC000020123953 171005923 /nfs/dbraw/zinc/00/59/23/171005923.db2.gz QBSAGLFGXJXDNK-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)NCc1ccc(N(C)C)cc1 ZINC000020351385 171156344 /nfs/dbraw/zinc/15/63/44/171156344.db2.gz QSMDQQHMDSRBHO-LBPRGKRZSA-N 0 3 272.396 2.645 20 10 CFCDHN COc1ccc(CN[C@H](C)c2cc(C)ccc2O)cn1 ZINC000035628917 172307672 /nfs/dbraw/zinc/30/76/72/172307672.db2.gz GWYOOWYRSAUNJH-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2[O-])cn1 ZINC000035628917 172307675 /nfs/dbraw/zinc/30/76/75/172307675.db2.gz GWYOOWYRSAUNJH-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134234 267147301 /nfs/dbraw/zinc/14/73/01/267147301.db2.gz LLPMLSGQUXHGMR-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134234 267147303 /nfs/dbraw/zinc/14/73/03/267147303.db2.gz LLPMLSGQUXHGMR-DOMZBBRYSA-N 0 3 294.826 2.962 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000369875600 267272906 /nfs/dbraw/zinc/27/29/06/267272906.db2.gz VVZSFIJIPKGMAH-RDJZCZTQSA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2ccccc2[O-])C[C@]2(CCCOC2)O1 ZINC000369875600 267272908 /nfs/dbraw/zinc/27/29/08/267272908.db2.gz VVZSFIJIPKGMAH-RDJZCZTQSA-N 0 3 291.391 2.552 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1C[C@@H](CO)c2ccccc21 ZINC000373636708 267696601 /nfs/dbraw/zinc/69/66/01/267696601.db2.gz XIPBNODSAUYMPV-XJKSGUPXSA-N 0 3 269.344 2.703 20 10 CFCDHN C[C@@H](CN1CCCCC1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295767349 278254277 /nfs/dbraw/zinc/25/42/77/278254277.db2.gz ACSOFCLIYJWAEP-DZGCQCFKSA-N 0 3 274.408 2.844 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)O[C@@]2(CCOC2)C1 ZINC000377700757 281025553 /nfs/dbraw/zinc/02/55/53/281025553.db2.gz RTZJNWJMXYTHNS-UNEWFSDZSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)O[C@@]2(CCOC2)C1 ZINC000377700757 281025554 /nfs/dbraw/zinc/02/55/54/281025554.db2.gz RTZJNWJMXYTHNS-UNEWFSDZSA-N 0 3 291.391 2.723 20 10 CFCDHN Cc1cccnc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295845911 281409393 /nfs/dbraw/zinc/40/93/93/281409393.db2.gz AUMCVNIIAZLCJM-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN C/C=C/C[C@H](CO)NCc1ccc(OC)c(COCC)c1 ZINC000185810715 327846193 /nfs/dbraw/zinc/84/61/93/327846193.db2.gz KIZKWYFVAAEPHL-MQDFFIGUSA-N 0 3 293.407 2.648 20 10 CFCDHN CCOC1(C)CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000292722081 328477162 /nfs/dbraw/zinc/47/71/62/328477162.db2.gz FJRNPJMHKDIAFJ-UHFFFAOYSA-N 0 3 267.344 2.922 20 10 CFCDHN COC[C@@]1([NH2+]Cc2ccccc2[O-])COc2ccccc2C1 ZINC000527802212 330284297 /nfs/dbraw/zinc/28/42/97/330284297.db2.gz WHUQZGWZFVUEMQ-GOSISDBHSA-N 0 3 299.370 2.502 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)c1 ZINC000527928164 330296819 /nfs/dbraw/zinc/29/68/19/330296819.db2.gz NHIGYLDLTHOKRE-OLZOCXBDSA-N 0 3 279.380 2.868 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[C@@H]2CCCOC2)c1 ZINC000527928167 330296908 /nfs/dbraw/zinc/29/69/08/330296908.db2.gz NHIGYLDLTHOKRE-STQMWFEESA-N 0 3 279.380 2.868 20 10 CFCDHN Cc1c2ccccc2n(C)c1CNc1cccc(N(C)C)n1 ZINC000490033290 332077650 /nfs/dbraw/zinc/07/76/50/332077650.db2.gz SBPRILAYYVVGRL-UHFFFAOYSA-N 0 3 294.402 2.982 20 10 CFCDHN CC1CCN(CC[NH2+][C@@H]2CCc3cccc([O-])c32)CC1 ZINC000295792614 334904268 /nfs/dbraw/zinc/90/42/68/334904268.db2.gz BRPOXGWZHBALHI-OAHLLOKOSA-N 0 3 274.408 2.701 20 10 CFCDHN CCCCN(C)C[C@@H](C)[NH2+]Cc1ccccc1[O-] ZINC000289776149 520413858 /nfs/dbraw/zinc/41/38/58/520413858.db2.gz JGEBLKIMTSZPNQ-CYBMUJFWSA-N 0 3 250.386 2.602 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000230661829 520938942 /nfs/dbraw/zinc/93/89/42/520938942.db2.gz NLQPDWVQBAQYAC-SWLSCSKDSA-N 0 3 251.370 2.902 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000280048404 521191340 /nfs/dbraw/zinc/19/13/40/521191340.db2.gz JKKMQZSBDREXLT-JSGCOSHPSA-N 0 3 251.370 2.902 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000094617602 521710994 /nfs/dbraw/zinc/71/09/94/521710994.db2.gz YKSOLVQLMLLCKU-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN CC(C)(C)c1ncc(CNCc2ccccc2O)cn1 ZINC000284190961 519111921 /nfs/dbraw/zinc/11/19/21/519111921.db2.gz BDKCZMIVBCWAHB-UHFFFAOYSA-N 0 3 271.364 2.770 20 10 CFCDHN CC(C)OCCCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000228837666 519760927 /nfs/dbraw/zinc/76/09/27/519760927.db2.gz KDCIVXNMVSJSDC-UHFFFAOYSA-N 0 3 255.333 2.826 20 10 CFCDHN CC(C)[C@H](C(=O)Nc1ccc(N)cc1)N1CCCCC1 ZINC000062461311 519809995 /nfs/dbraw/zinc/80/99/95/519809995.db2.gz DWGXCLCREBSEHT-OAHLLOKOSA-N 0 3 275.396 2.718 20 10 CFCDHN CCCC(O)(CCC)C[NH2+]Cc1ccccc1[O-] ZINC000265651664 519886439 /nfs/dbraw/zinc/88/64/39/519886439.db2.gz NNJUAARPXIQFAK-UHFFFAOYSA-N 0 3 251.370 2.813 20 10 CFCDHN CCCOc1ccc(C[NH2+]CC2(O)CCCCC2)c([O-])c1 ZINC000102426078 520365873 /nfs/dbraw/zinc/36/58/73/520365873.db2.gz UUNVSMXVKKZVRW-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@]2(O)CCC[C@@H]2C)c([O-])c1 ZINC000293237991 520369040 /nfs/dbraw/zinc/36/90/40/520369040.db2.gz ZQMYEOGNQYTAII-SUMWQHHRSA-N 0 3 293.407 2.822 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H](CO)C2CCCC2)c([O-])c1 ZINC000289481934 520371027 /nfs/dbraw/zinc/37/10/27/520371027.db2.gz FLLHESUYIFZRLU-INIZCTEOSA-N 0 3 293.407 2.822 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](CO)CC2CCC2)c([O-])c1 ZINC000279631497 520374052 /nfs/dbraw/zinc/37/40/52/520374052.db2.gz BWBFGYUKTNHRPS-HNNXBMFYSA-N 0 3 293.407 2.822 20 10 CFCDHN CC1(C)CC[N@H+](Cc2cc3c(cc2[O-])OCO3)CCS1 ZINC000278851377 520380674 /nfs/dbraw/zinc/38/06/74/520380674.db2.gz UHZVLFKNHSPXPN-UHFFFAOYSA-N 0 3 295.404 2.838 20 10 CFCDHN CC1(C)CC[N@@H+](Cc2cc3c(cc2[O-])OCO3)CCS1 ZINC000278851377 520380682 /nfs/dbraw/zinc/38/06/82/520380682.db2.gz UHZVLFKNHSPXPN-UHFFFAOYSA-N 0 3 295.404 2.838 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(OC)c2[O-])C12CCC2 ZINC000266191234 520430220 /nfs/dbraw/zinc/43/02/20/520430220.db2.gz YQEHFRQSFVYWMC-LSDHHAIUSA-N 0 3 291.391 2.838 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)Cn2cccn2)cc1 ZINC000035259083 520907952 /nfs/dbraw/zinc/90/79/52/520907952.db2.gz LLZJCBXPHCZVBZ-HNNXBMFYSA-N 0 3 286.423 2.908 20 10 CFCDHN CCN(CC)c1ccc(CNCc2[nH]ncc2C)cc1 ZINC000290055703 520908628 /nfs/dbraw/zinc/90/86/28/520908628.db2.gz XKBBWMABYHSFDJ-UHFFFAOYSA-N 0 3 272.396 2.854 20 10 CFCDHN CCC(=O)N1CC[C@@H]([NH2+][C@H](CC)c2ccc(C)cc2[O-])C1 ZINC000280247430 521139154 /nfs/dbraw/zinc/13/91/54/521139154.db2.gz WJFBDGMFBKWNBI-UKRRQHHQSA-N 0 3 290.407 2.752 20 10 CFCDHN CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2[O-])C1 ZINC000280913329 521139946 /nfs/dbraw/zinc/13/99/46/521139946.db2.gz DBKIAADFTDLECX-XQQFMLRXSA-N 0 3 277.364 2.775 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@]2(CC)CO)c1 ZINC000191958347 521144164 /nfs/dbraw/zinc/14/41/64/521144164.db2.gz PKSCGJAGAMBEHX-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@]2(CC)CO)c1 ZINC000191958347 521144172 /nfs/dbraw/zinc/14/41/72/521144172.db2.gz PKSCGJAGAMBEHX-INIZCTEOSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000230661787 521294985 /nfs/dbraw/zinc/29/49/85/521294985.db2.gz KYVKYNOEUAVQPA-ABAIWWIYSA-N 0 3 267.369 2.603 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000230661878 521296308 /nfs/dbraw/zinc/29/63/08/521296308.db2.gz UKGBOBJDEFEKAO-YGRLFVJLSA-N 0 3 255.333 2.733 20 10 CFCDHN CCOc1cccc(C[NH+]2CCC(COC)CC2)c1[O-] ZINC000156035193 521336451 /nfs/dbraw/zinc/33/64/51/521336451.db2.gz YDKKVHJCJYADAG-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[NH2+]CCC(O)(CC)CC)c1[O-] ZINC000276252619 521362869 /nfs/dbraw/zinc/36/28/69/521362869.db2.gz RDWGISHJZBTBEV-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](O)c2ccc(C)o2)c1[O-] ZINC000265992963 521364764 /nfs/dbraw/zinc/36/47/64/521364764.db2.gz NXDVZCKAYVFZEV-CYBMUJFWSA-N 0 3 291.347 2.516 20 10 CFCDHN CCOc1cccc(C[NH2+][C@H](C)CN(C)C(C)C)c1[O-] ZINC000289763234 521373845 /nfs/dbraw/zinc/37/38/45/521373845.db2.gz JCYMZASBFZSHTG-CYBMUJFWSA-N 0 3 280.412 2.609 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000276736348 521652675 /nfs/dbraw/zinc/65/26/75/521652675.db2.gz YOGHJLDGNILKPW-GFCCVEGCSA-N 0 3 251.370 2.984 20 10 CFCDHN CCOC1CC2(C1)CC[N@H+](Cc1cccc(OC)c1[O-])C2 ZINC000289932781 521653880 /nfs/dbraw/zinc/65/38/80/521653880.db2.gz XZDFNPIVOAOVFC-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOC1CC2(C1)CC[N@@H+](Cc1cccc(OC)c1[O-])C2 ZINC000289932781 521653883 /nfs/dbraw/zinc/65/38/83/521653883.db2.gz XZDFNPIVOAOVFC-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CO[C@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000280368740 521751262 /nfs/dbraw/zinc/75/12/62/521751262.db2.gz VANKYDIRNFQNCC-MRXNPFEDSA-N 0 3 293.363 2.512 20 10 CFCDHN CO[C@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OCO3)CC1 ZINC000280368740 521751266 /nfs/dbraw/zinc/75/12/66/521751266.db2.gz VANKYDIRNFQNCC-MRXNPFEDSA-N 0 3 293.363 2.512 20 10 CFCDHN COCC[C@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000228672892 521918539 /nfs/dbraw/zinc/91/85/39/521918539.db2.gz KDNOSHBSMCESHY-VIFPVBQESA-N 0 3 273.760 2.569 20 10 CFCDHN CN(C)c1ccc(CN2CCCSCC2)cc1F ZINC000272856211 522177164 /nfs/dbraw/zinc/17/71/64/522177164.db2.gz UBJARORNEXKALU-UHFFFAOYSA-N 0 3 268.401 2.831 20 10 CFCDHN COc1cc(Cl)cc(CN2CC[C@H](C)[C@@H](OC)C2)c1O ZINC000188309369 522536211 /nfs/dbraw/zinc/53/62/11/522536211.db2.gz YYXNKIKVXSUWAO-HZMBPMFUSA-N 0 3 299.798 2.911 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273792562 522541186 /nfs/dbraw/zinc/54/11/86/522541186.db2.gz VLRPCWBHNDYOCR-WDEREUQCSA-N 0 3 299.798 2.959 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H]2C2CC2)c1[O-] ZINC000230935405 522542811 /nfs/dbraw/zinc/54/28/11/522542811.db2.gz PNXLCKAFBHZUFW-SWLSCSKDSA-N 0 3 297.782 2.711 20 10 CFCDHN CC[C@H]([NH2+]CCCN(C)CCOC)c1ccc(C)cc1[O-] ZINC000280065950 522580042 /nfs/dbraw/zinc/58/00/42/522580042.db2.gz KSGYNSDWXGCKQI-INIZCTEOSA-N 0 3 294.439 2.710 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCSCC1)c1ccc(C)cc1[O-] ZINC000280207938 522594861 /nfs/dbraw/zinc/59/48/61/522594861.db2.gz TXQZZJNJFVGILU-HNNXBMFYSA-N 0 3 294.464 2.790 20 10 CFCDHN CC[C@H]([NH2+]CCc1cnn(C)c1)c1ccc(C)cc1[O-] ZINC000280184387 522603757 /nfs/dbraw/zinc/60/37/57/522603757.db2.gz RWCHSXSGMGEEII-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1ccccc1[O-] ZINC000155698632 522605453 /nfs/dbraw/zinc/60/54/53/522605453.db2.gz GYGVLCZFOZRRNL-DOMZBBRYSA-N 0 3 262.397 2.916 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CC[S@](C)=O)c1ccccc1[O-] ZINC000253013911 522733140 /nfs/dbraw/zinc/73/31/40/522733140.db2.gz FPGRDYLIYQVIJY-YNKQFZHNSA-N 0 3 269.410 2.590 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)CC(C)C)c1ccccc1[O-] ZINC000040774182 522747060 /nfs/dbraw/zinc/74/70/60/522747060.db2.gz SJWADDJDPIMURU-JSGCOSHPSA-N 0 3 251.370 2.840 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1[O-])[C@H]1CCCO1 ZINC000278832456 522760151 /nfs/dbraw/zinc/76/01/51/522760151.db2.gz OZYRPUQIZVHFAB-CWRNSKLLSA-N 0 3 293.407 2.854 20 10 CFCDHN COc1cc([O-])c(C[NH2+][C@@H]2CCC2(C)C)cc1OC ZINC000289664530 522781140 /nfs/dbraw/zinc/78/11/40/522781140.db2.gz DAVNUVYDBPBACF-CQSZACIVSA-N 0 3 265.353 2.688 20 10 CFCDHN CC[C@@H]([NH2+]CC1(C(N)=O)CCCC1)c1ccc(C)cc1[O-] ZINC000280270983 522817882 /nfs/dbraw/zinc/81/78/82/522817882.db2.gz XXTWSFVCYOYHCF-CQSZACIVSA-N 0 3 290.407 2.787 20 10 CFCDHN CC[C@H](O)CNCc1ccc(N(CC)CC)c(F)c1 ZINC000291771072 522818128 /nfs/dbraw/zinc/81/81/28/522818128.db2.gz SVYXTPVIZDRQGQ-ZDUSSCGKSA-N 0 3 268.376 2.532 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@](C)(O)CCOC)c1ccc(C)cc1[O-] ZINC000279926028 522857083 /nfs/dbraw/zinc/85/70/83/522857083.db2.gz AKJKULZIEQILCM-ZBFHGGJFSA-N 0 3 281.396 2.529 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1cc(OC)ccc1[O-] ZINC000230943349 522984085 /nfs/dbraw/zinc/98/40/85/522984085.db2.gz SXUQSPHIGORINN-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccc1F ZINC000264755183 523385764 /nfs/dbraw/zinc/38/57/64/523385764.db2.gz XRDVGDOBUVWFSL-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccccc1F ZINC000264755183 523385769 /nfs/dbraw/zinc/38/57/69/523385769.db2.gz XRDVGDOBUVWFSL-INIZCTEOSA-N 0 3 275.323 2.697 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370476 523975777 /nfs/dbraw/zinc/97/57/77/523975777.db2.gz HKZFWXOYLHTCKT-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2cccc(Cl)c2[O-])C1 ZINC000290370476 523975781 /nfs/dbraw/zinc/97/57/81/523975781.db2.gz HKZFWXOYLHTCKT-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370476 523975784 /nfs/dbraw/zinc/97/57/84/523975784.db2.gz HKZFWXOYLHTCKT-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2cccc(Cl)c2[O-])C1 ZINC000290370476 523975793 /nfs/dbraw/zinc/97/57/93/523975793.db2.gz HKZFWXOYLHTCKT-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CN(C)CC(C)(C)C[NH2+]Cc1c([O-])cccc1Cl ZINC000083551157 524046454 /nfs/dbraw/zinc/04/64/54/524046454.db2.gz KLFWHCRJEGBNPP-UHFFFAOYSA-N 0 3 270.804 2.723 20 10 CFCDHN C[NH+](C)CC(C)(C)CNCc1c([O-])cccc1Cl ZINC000083551157 524046456 /nfs/dbraw/zinc/04/64/56/524046456.db2.gz KLFWHCRJEGBNPP-UHFFFAOYSA-N 0 3 270.804 2.723 20 10 CFCDHN COc1ccc(CNC[C@@H](c2ccco2)N(C)C)cc1C ZINC000035052616 524071476 /nfs/dbraw/zinc/07/14/76/524071476.db2.gz VQXNGXMMDUAUQN-HNNXBMFYSA-N 0 3 288.391 2.989 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000062748263 524168735 /nfs/dbraw/zinc/16/87/35/524168735.db2.gz XNKJHDZPFZZJFF-MNOVXSKESA-N 0 3 254.349 2.522 20 10 CFCDHN Cc1cccc(C(=O)NCC[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000272858165 524195639 /nfs/dbraw/zinc/19/56/39/524195639.db2.gz MHONMHQNIHUBFP-CQSZACIVSA-N 0 3 298.386 2.781 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC2([S@@](C)=O)CC2)c([O-])c1 ZINC000285298391 524333689 /nfs/dbraw/zinc/33/36/89/524333689.db2.gz RXSAPPWXEMBWIE-HXPMCKFVSA-N 0 3 281.421 2.571 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC000245948527 524403012 /nfs/dbraw/zinc/40/30/12/524403012.db2.gz WHIDAULZJSYJJB-ZFWWWQNUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1[O-] ZINC000245948527 524403014 /nfs/dbraw/zinc/40/30/14/524403014.db2.gz WHIDAULZJSYJJB-ZFWWWQNUSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc(C[NH2+]CC[C@H](O)c2ccccc2)c1[O-] ZINC000289439137 524432411 /nfs/dbraw/zinc/43/24/11/524432411.db2.gz LRRPTGSLUWGIKN-INIZCTEOSA-N 0 3 271.360 2.914 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](CCO)C(C)(C)C)c1[O-] ZINC000231073728 524434393 /nfs/dbraw/zinc/43/43/93/524434393.db2.gz OHGKDPKUHJIQSO-ZDUSSCGKSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc(CN[C@@]2(CO)CCc3ccccc32)c1O ZINC000305772254 524438507 /nfs/dbraw/zinc/43/85/07/524438507.db2.gz HVDDNHCVDLRMJE-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc(C[NH2+][C@@]2(CO)CCc3ccccc32)c1[O-] ZINC000305772254 524438515 /nfs/dbraw/zinc/43/85/15/524438515.db2.gz HVDDNHCVDLRMJE-GOSISDBHSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+]Cc2cccc(C)c2[O-])c1 ZINC000191683166 524468115 /nfs/dbraw/zinc/46/81/15/524468115.db2.gz FRAXMMBZWLBJBH-QGZVFWFLSA-N 0 3 285.387 2.702 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2ccccc2[O-])C[C@H]1n1ccnc1 ZINC000245629358 524513146 /nfs/dbraw/zinc/51/31/46/524513146.db2.gz UTZHPBPQVFNEKU-UKRRQHHQSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@H]1n1ccnc1 ZINC000245629358 524513157 /nfs/dbraw/zinc/51/31/57/524513157.db2.gz UTZHPBPQVFNEKU-UKRRQHHQSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@H](CO)[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000289415945 524539677 /nfs/dbraw/zinc/53/96/77/524539677.db2.gz IMFFXUYCQDKAJU-CYBMUJFWSA-N 0 3 271.360 2.872 20 10 CFCDHN C[C@H](CO)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000289415945 524539682 /nfs/dbraw/zinc/53/96/82/524539682.db2.gz IMFFXUYCQDKAJU-CYBMUJFWSA-N 0 3 271.360 2.872 20 10 CFCDHN Cc1ccc(CN[C@@H](C)c2ccc(N(C)C)cc2)c(=O)n1C ZINC000279584518 524595206 /nfs/dbraw/zinc/59/52/06/524595206.db2.gz UWTIMYUSOXKYCJ-AWEZNQCLSA-N 0 3 299.418 2.611 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000292755954 524747537 /nfs/dbraw/zinc/74/75/37/524747537.db2.gz IYXJCMHEORGWHA-UONOGXRCSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000292755954 524747546 /nfs/dbraw/zinc/74/75/46/524747546.db2.gz IYXJCMHEORGWHA-UONOGXRCSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c1 ZINC000292755954 524747559 /nfs/dbraw/zinc/74/75/59/524747559.db2.gz IYXJCMHEORGWHA-UONOGXRCSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2cccc(F)c2)c1 ZINC000036778566 524749587 /nfs/dbraw/zinc/74/95/87/524749587.db2.gz UPVKQXZCBVZFLX-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2CCSCC2)c1 ZINC000164692020 524751297 /nfs/dbraw/zinc/75/12/97/524751297.db2.gz YHPUCWHNJRDYNX-UHFFFAOYSA-N 0 3 267.394 2.634 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CCCCN2C2CC2)c1 ZINC000278335646 524752891 /nfs/dbraw/zinc/75/28/91/524752891.db2.gz HFRUBJBDTXLPJH-HNNXBMFYSA-N 0 3 290.407 2.507 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1 ZINC000245880002 524756505 /nfs/dbraw/zinc/75/65/05/524756505.db2.gz KQEFDHLZFSHDOW-NUEKZKHPSA-N 0 3 291.391 2.694 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CSCCS2)c1 ZINC000168818737 524771306 /nfs/dbraw/zinc/77/13/06/524771306.db2.gz QSXLNBKRCJAJMY-CMPLNLGQSA-N 0 3 299.461 2.900 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ncccc2C)c1 ZINC000071339346 524772453 /nfs/dbraw/zinc/77/24/53/524772453.db2.gz BPTLIBNJFPUCIU-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c1[O-] ZINC000276053723 524865477 /nfs/dbraw/zinc/86/54/77/524865477.db2.gz UQHZLMUCZQIKDX-CYBMUJFWSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c1[O-] ZINC000276053723 524865487 /nfs/dbraw/zinc/86/54/87/524865487.db2.gz UQHZLMUCZQIKDX-CYBMUJFWSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC[C@H](C)O)c1[O-] ZINC000279422194 524870019 /nfs/dbraw/zinc/87/00/19/524870019.db2.gz PEBWAUQWGZZTNS-JTQLQIEISA-N 0 3 257.761 2.605 20 10 CFCDHN COc1ncccc1CC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000290155683 525044496 /nfs/dbraw/zinc/04/44/96/525044496.db2.gz LNVOVVNWEXIEMI-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1cc(O)c(CN2CCO[C@H]3CCC[C@H]32)cc1C ZINC000299133655 525319101 /nfs/dbraw/zinc/31/91/01/525319101.db2.gz FMXOGUNQSOYNAC-ZBFHGGJFSA-N 0 3 261.365 2.762 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(O)CCCC2(C)C)c1 ZINC000292979824 525349037 /nfs/dbraw/zinc/34/90/37/525349037.db2.gz MZRHYNQQIGGFKT-INIZCTEOSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H](CC(C)C)N(C)C)c1 ZINC000071406830 525349577 /nfs/dbraw/zinc/34/95/77/525349577.db2.gz YJVQSIUBWUMEFE-HNNXBMFYSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000273043590 525352471 /nfs/dbraw/zinc/35/24/71/525352471.db2.gz BBTLLRFITZDTOK-CVEARBPZSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C2CCN(C3CC3)CC2)c1 ZINC000037141077 525359431 /nfs/dbraw/zinc/35/94/31/525359431.db2.gz QQYANRWTOUTZCZ-CYBMUJFWSA-N 0 3 274.408 2.978 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)N[C@@H](C)c2cnn(C)c2)c1 ZINC000273554471 525362381 /nfs/dbraw/zinc/36/23/81/525362381.db2.gz GOPLWFDJIBJUIP-NWDGAFQWSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2)c1 ZINC000273554471 525362387 /nfs/dbraw/zinc/36/23/87/525362387.db2.gz GOPLWFDJIBJUIP-NWDGAFQWSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)Cc2ccccc2)c1 ZINC000063218539 525362555 /nfs/dbraw/zinc/36/25/55/525362555.db2.gz PMVGSAKCFOAVMA-GDBMZVCRSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c1 ZINC000168838966 525364850 /nfs/dbraw/zinc/36/48/50/525364850.db2.gz JCEHAGNKGJBIBC-OAVHHTNSSA-N 0 3 269.410 2.508 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]Cc2ccc(C)n(C)c2=O)c1 ZINC000279396125 525364904 /nfs/dbraw/zinc/36/49/04/525364904.db2.gz CNXZJXQOWUZMSV-ZDUSSCGKSA-N 0 3 286.375 2.559 20 10 CFCDHN Cc1ccc(O)c([C@H](C)NCc2ccc(C)n(C)c2=O)c1 ZINC000279396125 525364912 /nfs/dbraw/zinc/36/49/12/525364912.db2.gz CNXZJXQOWUZMSV-ZDUSSCGKSA-N 0 3 286.375 2.559 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000062999529 525543890 /nfs/dbraw/zinc/54/38/90/525543890.db2.gz XNEKQJUDDODELO-WFASDCNBSA-N 0 3 257.333 2.776 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)CC(C)C)c([O-])c1 ZINC000040774951 525742978 /nfs/dbraw/zinc/74/29/78/525742978.db2.gz BRSGHCLYFQJBHA-CHWSQXEVSA-N 0 3 251.370 2.758 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2)c([O-])c1 ZINC000273462959 525934851 /nfs/dbraw/zinc/93/48/51/525934851.db2.gz DCUMPTLFJAZLMG-RYUDHWBXSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CO[C@@H]2CCOC2)c([O-])c1C ZINC000273598694 525940485 /nfs/dbraw/zinc/94/04/85/525940485.db2.gz RKKVLFQEUVZJSK-VHDGCEQUSA-N 0 3 293.407 2.854 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1[O-] ZINC000273047718 526016476 /nfs/dbraw/zinc/01/64/76/526016476.db2.gz JTVITDZCSLTZAQ-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc(CNCc2ccc3c(c2)CCO3)c1O ZINC000263703859 526026316 /nfs/dbraw/zinc/02/63/16/526026316.db2.gz RTJKLHYZXZSLAQ-UHFFFAOYSA-N 0 3 285.343 2.626 20 10 CFCDHN COc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1[O-] ZINC000263703859 526026322 /nfs/dbraw/zinc/02/63/22/526026322.db2.gz RTJKLHYZXZSLAQ-UHFFFAOYSA-N 0 3 285.343 2.626 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCc1ccc(F)cc1)OCO2 ZINC000042879126 526337065 /nfs/dbraw/zinc/33/70/65/526337065.db2.gz LQFOISAUIOMZTD-UHFFFAOYSA-N 0 3 289.306 2.592 20 10 CFCDHN [O-]c1cccc(Cl)c1CNCCC[NH+]1CCCC1 ZINC000083551577 526363202 /nfs/dbraw/zinc/36/32/02/526363202.db2.gz CQYQOLDBFVYFOL-UHFFFAOYSA-N 0 3 268.788 2.621 20 10 CFCDHN [O-]c1cccc(Cl)c1C[NH2+]CCCN1CCCC1 ZINC000083551577 526363208 /nfs/dbraw/zinc/36/32/08/526363208.db2.gz CQYQOLDBFVYFOL-UHFFFAOYSA-N 0 3 268.788 2.621 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245584745 526372590 /nfs/dbraw/zinc/37/25/90/526372590.db2.gz DCSMWMGYDVSDDP-WMLDXEAASA-N 0 3 286.419 2.841 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245584745 526372593 /nfs/dbraw/zinc/37/25/93/526372593.db2.gz DCSMWMGYDVSDDP-WMLDXEAASA-N 0 3 286.419 2.841 20 10 CFCDHN Cc1ncc(C[NH2+]Cc2cc(F)ccc2[O-])s1 ZINC000226607350 527271636 /nfs/dbraw/zinc/27/16/36/527271636.db2.gz UYPMOQYXIJFWGK-UHFFFAOYSA-N 0 3 252.314 2.586 20 10 CFCDHN COc1ccc(N2CCN(C[C@@H]3C[C@H]3C)CC2)cc1F ZINC000754127163 574076395 /nfs/dbraw/zinc/07/63/95/574076395.db2.gz SOXRALRTMXFTCV-OLZOCXBDSA-N 0 3 278.371 2.612 20 10 CFCDHN C[C@@H](CC(=O)OC(C)(C)C)NCc1ccc2c(c1)CCO2 ZINC000731452534 574121515 /nfs/dbraw/zinc/12/15/15/574121515.db2.gz CAHGQZNAIGSCOL-LBPRGKRZSA-N 0 3 291.391 2.831 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)CC2CC2)c([O-])c1C ZINC000756768590 574129382 /nfs/dbraw/zinc/12/93/82/574129382.db2.gz FRDCKZIRWOFSIZ-GXTWGEPZSA-N 0 3 263.381 2.821 20 10 CFCDHN C[NH+](C)CCc1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000732284947 574149902 /nfs/dbraw/zinc/14/99/02/574149902.db2.gz JTVYVRYPAMVRBN-UHFFFAOYSA-N 0 3 290.388 2.810 20 10 CFCDHN COC(=O)[C@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C ZINC000755931934 574199331 /nfs/dbraw/zinc/19/93/31/574199331.db2.gz MJYZIKNBYDTNBK-WFASDCNBSA-N 0 3 299.370 2.786 20 10 CFCDHN COC(=O)[C@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C ZINC000755931934 574199332 /nfs/dbraw/zinc/19/93/32/574199332.db2.gz MJYZIKNBYDTNBK-WFASDCNBSA-N 0 3 299.370 2.786 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCCN(C)C)c2c1c(F)ccc2[O-] ZINC000756342539 574226909 /nfs/dbraw/zinc/22/69/09/574226909.db2.gz KOXPZVASGJFXGB-CMPLNLGQSA-N 0 3 266.360 2.621 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)c1ccco1)c1cc(F)ccc1[O-] ZINC000756382102 574231885 /nfs/dbraw/zinc/23/18/85/574231885.db2.gz QXQJZIWXDMQGSP-ZANVPECISA-N 0 3 265.284 2.509 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C2CCOCC2)c2c1c(F)ccc2[O-] ZINC000756432214 574236630 /nfs/dbraw/zinc/23/66/30/574236630.db2.gz IKFQJIBHJFOXQH-JOYOIKCWSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@@H](Cc1cnccn1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756493494 574241212 /nfs/dbraw/zinc/24/12/12/574241212.db2.gz GCTSSUVQRASSMQ-QWRGUYRKSA-N 0 3 275.327 2.603 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2CCN(C3CC3)C2)c2c1c(F)ccc2[O-] ZINC000756532806 574244515 /nfs/dbraw/zinc/24/45/15/574244515.db2.gz GJMNDPWVOWNPIS-SUNKGSAMSA-N 0 3 290.382 2.906 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCSCCCO)c2c1c(F)ccc2[O-] ZINC000756541651 574245198 /nfs/dbraw/zinc/24/51/98/574245198.db2.gz GNGKEIWYASDAKI-PWSUYJOCSA-N 0 3 299.411 2.785 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(CC3CC3)C2)c([O-])c1 ZINC000756555579 574247076 /nfs/dbraw/zinc/24/70/76/574247076.db2.gz SLFHAOJXZOSRBZ-ZFWWWQNUSA-N 0 3 274.408 2.836 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2cc(OC)ccc2O)n[nH]1 ZINC000756571578 574248662 /nfs/dbraw/zinc/24/86/62/574248662.db2.gz GIZCFJRVJYEFSO-JTQLQIEISA-N 0 3 275.352 2.537 20 10 CFCDHN CCc1cc(CN[C@@H](C)c2cc(OC)ccc2O)[nH]n1 ZINC000756571578 574248664 /nfs/dbraw/zinc/24/86/64/574248664.db2.gz GIZCFJRVJYEFSO-JTQLQIEISA-N 0 3 275.352 2.537 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(O)CCCC2)c([O-])c1C ZINC000756577066 574249903 /nfs/dbraw/zinc/24/99/03/574249903.db2.gz XWRRWPOXWTUIGU-ZDUSSCGKSA-N 0 3 263.381 2.965 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000756576760 574250029 /nfs/dbraw/zinc/25/00/29/574250029.db2.gz OHCFTDBQZZCXBS-PGUXBMHVSA-N 0 3 269.360 2.979 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756576761 574250137 /nfs/dbraw/zinc/25/01/37/574250137.db2.gz OHCFTDBQZZCXBS-RWSFTLGLSA-N 0 3 269.360 2.979 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](O)C(C)C)c([O-])c1C ZINC000756586385 574250619 /nfs/dbraw/zinc/25/06/19/574250619.db2.gz RNSYSRBTHXBLNL-GXTWGEPZSA-N 0 3 251.370 2.677 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCNc2ncccn2)c1 ZINC000756642385 574254666 /nfs/dbraw/zinc/25/46/66/574254666.db2.gz NOAXHHROOGVZQH-CYBMUJFWSA-N 0 3 286.379 2.643 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cc(F)cc(F)c1[O-] ZINC000756645501 574255009 /nfs/dbraw/zinc/25/50/09/574255009.db2.gz GJFGYQNJFTWGQX-KCJUWKMLSA-N 0 3 293.317 2.602 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000756647678 574255026 /nfs/dbraw/zinc/25/50/26/574255026.db2.gz QZPZVGLNHTZWCK-HEHGZKQESA-N 0 3 274.408 2.834 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cc(F)cc(F)c1[O-] ZINC000756645497 574255205 /nfs/dbraw/zinc/25/52/05/574255205.db2.gz GJFGYQNJFTWGQX-GZMMTYOYSA-N 0 3 293.317 2.602 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](CO)Cc2ccco2)c1 ZINC000756659729 574256380 /nfs/dbraw/zinc/25/63/80/574256380.db2.gz FNRIUEOFABUZLH-KGLIPLIRSA-N 0 3 289.375 2.795 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756734409 574259942 /nfs/dbraw/zinc/25/99/42/574259942.db2.gz WOWHCQQEGJVXCF-MDZLAQPJSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)[S@](C)=O ZINC000756761270 574261393 /nfs/dbraw/zinc/26/13/93/574261393.db2.gz MKCKFGLQQKYSSF-IGLVYNNVSA-N 0 3 299.411 2.826 20 10 CFCDHN Cc1cc(CN[C@H](C)c2ccc(C)c(C)c2O)ncn1 ZINC000756777119 574262399 /nfs/dbraw/zinc/26/23/99/574262399.db2.gz VBDCAULUSWXBEX-CYBMUJFWSA-N 0 3 271.364 2.958 20 10 CFCDHN CCC[N@H+](C/C=C(\C)C(=O)OC)Cc1ccccc1[O-] ZINC000748813500 574268338 /nfs/dbraw/zinc/26/83/38/574268338.db2.gz SPYPBMVABOKSBQ-UKTHLTGXSA-N 0 3 277.364 2.724 20 10 CFCDHN CCC[N@@H+](C/C=C(\C)C(=O)OC)Cc1ccccc1[O-] ZINC000748813500 574268342 /nfs/dbraw/zinc/26/83/42/574268342.db2.gz SPYPBMVABOKSBQ-UKTHLTGXSA-N 0 3 277.364 2.724 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H](C)Cc2ccncc2)c1 ZINC000749295170 574288518 /nfs/dbraw/zinc/28/85/18/574288518.db2.gz LAVOQVCCIYVNOJ-ZDUSSCGKSA-N 0 3 286.375 2.907 20 10 CFCDHN COc1cccc(C[NH2+]CC2CCC(OC)CC2)c1[O-] ZINC000749923218 574316099 /nfs/dbraw/zinc/31/60/99/574316099.db2.gz QUQANXZGYLPTEX-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCOC(C)(C)C)cc1C ZINC000742368627 574324468 /nfs/dbraw/zinc/32/44/68/574324468.db2.gz JZOQWRTYIBPZFQ-UHFFFAOYSA-N 0 3 251.370 2.914 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](CO)CC(C)C)cc1C ZINC000742367764 574324572 /nfs/dbraw/zinc/32/45/72/574324572.db2.gz IKPDWNABRJOIHD-AWEZNQCLSA-N 0 3 251.370 2.506 20 10 CFCDHN COC(=O)C1CCC([NH2+]Cc2cc(C)c(C)cc2[O-])CC1 ZINC000742369976 574325044 /nfs/dbraw/zinc/32/50/44/574325044.db2.gz AVPIXNKCUFHOPX-UHFFFAOYSA-N 0 3 291.391 2.830 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2cc(C)c(C)cc2[O-])o1 ZINC000742372622 574325685 /nfs/dbraw/zinc/32/56/85/574325685.db2.gz QHEBZYFUFHKHEF-HNNXBMFYSA-N 0 3 275.348 2.734 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H](O)CCc1ccccc1 ZINC000753594419 574405822 /nfs/dbraw/zinc/40/58/22/574405822.db2.gz LXWQWMUEAIZLRF-MRXNPFEDSA-N 0 3 289.350 2.615 20 10 CFCDHN CCCOc1ccc(CN[C@H]2CCCCNC2=O)cc1C ZINC000200073335 617993445 /nfs/dbraw/zinc/99/34/45/617993445.db2.gz ZAOVTPUYHWONOW-HNNXBMFYSA-N 0 3 290.407 2.542 20 10 CFCDHN CCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000045691061 618048021 /nfs/dbraw/zinc/04/80/21/618048021.db2.gz LSBLTJCQVIXVFD-OLZOCXBDSA-N 0 3 250.386 2.773 20 10 CFCDHN CCC[C@@](C)(O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000229554655 618218127 /nfs/dbraw/zinc/21/81/27/618218127.db2.gz QQVRBELDSFOZGQ-DZGCQCFKSA-N 0 3 251.370 2.984 20 10 CFCDHN COc1cc(Br)cc(CN[C@@H](C)CF)c1O ZINC000309907006 618251543 /nfs/dbraw/zinc/25/15/43/618251543.db2.gz KUTRUAQMVPOIFK-ZETCQYMHSA-N 0 3 292.148 2.611 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCCn1ccnc1)CC2 ZINC000312653605 618407764 /nfs/dbraw/zinc/40/77/64/618407764.db2.gz FXOJCHWBUNNQKQ-CQSZACIVSA-N 0 3 271.364 2.646 20 10 CFCDHN COc1ccc(CNCc2ccnn2C2CCC2)c(O)c1 ZINC000894184612 618431605 /nfs/dbraw/zinc/43/16/05/618431605.db2.gz DHWMUNLLAWFNHT-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccnn2C2CCC2)c([O-])c1 ZINC000894184612 618431608 /nfs/dbraw/zinc/43/16/08/618431608.db2.gz DHWMUNLLAWFNHT-UHFFFAOYSA-N 0 3 287.363 2.612 20 10 CFCDHN C[C@H](CC[NH2+]Cc1cc(Cl)c(F)cc1[O-])N(C)C ZINC000895294678 618514216 /nfs/dbraw/zinc/51/42/16/618514216.db2.gz ZXHZFFCPIKZVMH-SECBINFHSA-N 0 3 274.767 2.615 20 10 CFCDHN C/C=C/CNCc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000895405580 618570407 /nfs/dbraw/zinc/57/04/07/618570407.db2.gz LUMYJUBXSWWUTD-SNAWJCMRSA-N 0 3 290.338 2.770 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(OC)c1[O-])[C@@H]1CCOC1 ZINC000311443722 618712589 /nfs/dbraw/zinc/71/25/89/618712589.db2.gz HEGISRYWWAWHGS-GFCCVEGCSA-N 0 3 285.771 2.665 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(OC)c1[O-])[C@@H]1CCOC1 ZINC000311443722 618712593 /nfs/dbraw/zinc/71/25/93/618712593.db2.gz HEGISRYWWAWHGS-GFCCVEGCSA-N 0 3 285.771 2.665 20 10 CFCDHN COc1cc(Cl)cc(CNCc2ccoc2)c1O ZINC000169085560 618720943 /nfs/dbraw/zinc/72/09/43/618720943.db2.gz JAYOHBYBQAWCLO-UHFFFAOYSA-N 0 3 267.712 2.937 20 10 CFCDHN C[C@@]1(Br)C[C@H]1C[NH2+]Cc1ccccc1[O-] ZINC000892790584 618746396 /nfs/dbraw/zinc/74/63/96/618746396.db2.gz GAJYIAMXAXJLHZ-CMPLNLGQSA-N 0 3 270.170 2.655 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc(CO)cc1)CC2 ZINC000312857305 618957899 /nfs/dbraw/zinc/95/78/99/618957899.db2.gz RFKLGEYFDNPHRQ-HNNXBMFYSA-N 0 3 269.344 2.662 20 10 CFCDHN CCOC[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000313470456 618990008 /nfs/dbraw/zinc/99/00/08/618990008.db2.gz OIOFUUJDMSHGLN-CQSZACIVSA-N 0 3 267.344 2.922 20 10 CFCDHN CCOC[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000313470456 618990011 /nfs/dbraw/zinc/99/00/11/618990011.db2.gz OIOFUUJDMSHGLN-CQSZACIVSA-N 0 3 267.344 2.922 20 10 CFCDHN CCOC[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000313470455 618990118 /nfs/dbraw/zinc/99/01/18/618990118.db2.gz OIOFUUJDMSHGLN-AWEZNQCLSA-N 0 3 267.344 2.922 20 10 CFCDHN CCOC[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000313470455 618990120 /nfs/dbraw/zinc/99/01/20/618990120.db2.gz OIOFUUJDMSHGLN-AWEZNQCLSA-N 0 3 267.344 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000840958583 619149776 /nfs/dbraw/zinc/14/97/76/619149776.db2.gz QMUIQPOILWRDMA-JKSUJKDBSA-N 0 3 287.334 2.839 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000840958583 619149777 /nfs/dbraw/zinc/14/97/77/619149777.db2.gz QMUIQPOILWRDMA-JKSUJKDBSA-N 0 3 287.334 2.839 20 10 CFCDHN CC(C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccnn1C ZINC000788265370 619340481 /nfs/dbraw/zinc/34/04/81/619340481.db2.gz DXLAIQYJRIKCLH-CQSZACIVSA-N 0 3 291.370 2.794 20 10 CFCDHN COC(=O)[C@@H](C[NH2+]Cc1c(C)cccc1[O-])CC(C)C ZINC000894790272 619464413 /nfs/dbraw/zinc/46/44/13/619464413.db2.gz IEEHOLGBUVHANG-CYBMUJFWSA-N 0 3 279.380 2.626 20 10 CFCDHN C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781990 619465933 /nfs/dbraw/zinc/46/59/33/619465933.db2.gz IHHJEAPZASDMHS-XHDPSFHLSA-N 0 3 296.361 2.587 20 10 CFCDHN C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2cc(F)cc(F)c2[O-])C1 ZINC000894781990 619465936 /nfs/dbraw/zinc/46/59/36/619465936.db2.gz IHHJEAPZASDMHS-XHDPSFHLSA-N 0 3 296.361 2.587 20 10 CFCDHN COc1ccc(C[N@H+](C)C[C@H]2CC2(C)C)c([O-])c1OC ZINC000895482288 619541232 /nfs/dbraw/zinc/54/12/32/619541232.db2.gz TWGPLFBBKVRNJL-GFCCVEGCSA-N 0 3 279.380 2.887 20 10 CFCDHN COc1ccc(C[N@@H+](C)C[C@H]2CC2(C)C)c([O-])c1OC ZINC000895482288 619541233 /nfs/dbraw/zinc/54/12/33/619541233.db2.gz TWGPLFBBKVRNJL-GFCCVEGCSA-N 0 3 279.380 2.887 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCC(C)(C)CO2)c([O-])c1 ZINC000895529802 619548331 /nfs/dbraw/zinc/54/83/31/619548331.db2.gz WEJOKBXNSWOUHW-CQSZACIVSA-N 0 3 263.381 2.995 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895584491 619560373 /nfs/dbraw/zinc/56/03/73/619560373.db2.gz QSZNKYGQQYCBFL-GFCCVEGCSA-N 0 3 260.362 2.838 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895584491 619560374 /nfs/dbraw/zinc/56/03/74/619560374.db2.gz QSZNKYGQQYCBFL-GFCCVEGCSA-N 0 3 260.362 2.838 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895579713 619562842 /nfs/dbraw/zinc/56/28/42/619562842.db2.gz BBWYIWBJVWRRSN-SNVBAGLBSA-N 0 3 278.352 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895579713 619562845 /nfs/dbraw/zinc/56/28/45/619562845.db2.gz BBWYIWBJVWRRSN-SNVBAGLBSA-N 0 3 278.352 2.977 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@@]3(CO[C@@H](C)C3)O2)c([O-])c1 ZINC000895817197 619614238 /nfs/dbraw/zinc/61/42/38/619614238.db2.gz HAJZANDGEJGBPV-JLJPHGGASA-N 0 3 291.391 2.517 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC2(C[C@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852381 619622857 /nfs/dbraw/zinc/62/28/57/619622857.db2.gz UNBQSIFPHWOVEO-IACUBPJLSA-N 0 3 295.354 2.677 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC000896794025 619819914 /nfs/dbraw/zinc/81/99/14/619819914.db2.gz IGQYVPQLDHVZIE-IRXDYDNUSA-N 0 3 298.361 2.994 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC000896794025 619819918 /nfs/dbraw/zinc/81/99/18/619819918.db2.gz IGQYVPQLDHVZIE-IRXDYDNUSA-N 0 3 298.361 2.994 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCC3(CCOCC3)O2)c([O-])c1 ZINC000896919445 619888450 /nfs/dbraw/zinc/88/84/50/619888450.db2.gz XGQCEBQPRGDAIF-OAHLLOKOSA-N 0 3 291.391 2.518 20 10 CFCDHN CCc1onc(C)c1CNCc1cc(F)ccc1O ZINC000897337270 620000142 /nfs/dbraw/zinc/00/01/42/620000142.db2.gz YJHMWTNKLWHRSF-UHFFFAOYSA-N 0 3 264.300 2.680 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1C[C@@](CO)(c2ccccc2)C1 ZINC000897357784 620035259 /nfs/dbraw/zinc/03/52/59/620035259.db2.gz SKCXAKPTGKMYBL-UWUNEBHHSA-N 0 3 297.398 2.883 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CC[C@@H](C3CC3)O2)c([O-])c1 ZINC000897512352 620199747 /nfs/dbraw/zinc/19/97/47/620199747.db2.gz XZQMZYCNSCCYNC-WBVHZDCISA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CCO)C2CCCC2)c([O-])c1 ZINC000897882543 620297420 /nfs/dbraw/zinc/29/74/20/620297420.db2.gz MLQSVZKENQUVLM-OAHLLOKOSA-N 0 3 263.381 2.731 20 10 CFCDHN C[C@H]([NH2+]Cc1cc(F)ccc1[O-])c1cncs1 ZINC000897933511 620302533 /nfs/dbraw/zinc/30/25/33/620302533.db2.gz YVJMOUXXZDNIIC-QMMMGPOBSA-N 0 3 252.314 2.839 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)Cc2cccnc2)c([O-])c1 ZINC000897964934 620313944 /nfs/dbraw/zinc/31/39/44/620313944.db2.gz KYRYWQUMSUWDTC-ZDUSSCGKSA-N 0 3 256.349 2.816 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCOC12CCOCC2)c1ccccc1[O-] ZINC000898116643 620336328 /nfs/dbraw/zinc/33/63/28/620336328.db2.gz TZFGAQDNGYLZPM-GOEBONIOSA-N 0 3 291.391 2.771 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2cccnc2C)c([O-])c1 ZINC000898250583 620357044 /nfs/dbraw/zinc/35/70/44/620357044.db2.gz VBXQJNBIGFMTLO-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(C)cc1[O-] ZINC000926949804 620430319 /nfs/dbraw/zinc/43/03/19/620430319.db2.gz QISPXDMHQJBZKH-SMKXDYDZSA-N 0 3 291.391 2.545 20 10 CFCDHN C[C@@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1ccccc1[O-] ZINC000926964393 620433779 /nfs/dbraw/zinc/43/37/79/620433779.db2.gz RNESEZQWVUGPCU-MFKMUULPSA-N 0 3 290.329 2.925 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@H]1CC(=O)N(C)C1)c1ccc(C)cc1[O-] ZINC000903211009 621288684 /nfs/dbraw/zinc/28/86/84/621288684.db2.gz AGIVOSFMQJRAEH-DZGCQCFKSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]C2CC(CCO)C2)c2c1c(F)ccc2[O-] ZINC000903328732 621340024 /nfs/dbraw/zinc/34/00/24/621340024.db2.gz FCVXEVOMXFVOLH-YUVKLTJASA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H](NCc1cccc(N(C)C)n1)c1ccccc1O ZINC000183629910 625522844 /nfs/dbraw/zinc/52/28/44/625522844.db2.gz JXECYLWYRSGJBL-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@H]([NH2+]Cc1cccc(N(C)C)n1)c1ccccc1[O-] ZINC000183629910 625522849 /nfs/dbraw/zinc/52/28/49/625522849.db2.gz JXECYLWYRSGJBL-LBPRGKRZSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1cc([O-])cs1 ZINC000912651771 622754784 /nfs/dbraw/zinc/75/47/84/622754784.db2.gz ZDTFCDSGNMCWJO-RYUDHWBXSA-N 0 3 296.436 2.789 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000044685413 622940213 /nfs/dbraw/zinc/94/02/13/622940213.db2.gz RPKRBMKUHODIJN-CHWSQXEVSA-N 0 3 260.381 2.588 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1cc(F)ccc1[O-] ZINC000157652296 623044301 /nfs/dbraw/zinc/04/43/01/623044301.db2.gz VVICQYPDAIUQFK-GVXVVHGQSA-N 0 3 266.360 2.665 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1Cc2ccccc21 ZINC000226606871 623083437 /nfs/dbraw/zinc/08/34/37/623083437.db2.gz DQDAGWAYBCXTBG-GFCCVEGCSA-N 0 3 257.308 2.961 20 10 CFCDHN COCCOCCCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000168750787 623102661 /nfs/dbraw/zinc/10/26/61/623102661.db2.gz KNFNNRGHAFKHPS-GFCCVEGCSA-N 0 3 285.359 2.625 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)[S@](C)=O)c([O-])c1 ZINC000168847810 623107592 /nfs/dbraw/zinc/10/75/92/623107592.db2.gz LSNIJWBOEWEVMN-FTLABTOESA-N 0 3 269.410 2.508 20 10 CFCDHN CC[C@@](C)(C(=O)OC)N(Cc1ccccc1O)CC1CC1 ZINC000822503358 623117144 /nfs/dbraw/zinc/11/71/44/623117144.db2.gz GUITYXDWMGQXLB-KRWDZBQOSA-N 0 3 291.391 2.946 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000228408513 623142321 /nfs/dbraw/zinc/14/23/21/623142321.db2.gz YTXNHHVRVINQSN-CQSZACIVSA-N 0 3 254.333 2.954 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)C(=O)NC(C)C)cc1 ZINC000228929625 623170209 /nfs/dbraw/zinc/17/02/09/623170209.db2.gz NBXJWNBCYJHFPD-AWEZNQCLSA-N 0 3 291.439 2.536 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1CCCCS1 ZINC000230391690 623273478 /nfs/dbraw/zinc/27/34/78/623273478.db2.gz MWVOCEFVSNKMOL-LBPRGKRZSA-N 0 3 255.358 2.907 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@]2(C)CCO[C@H]2C)c1[O-] ZINC000230935805 623312485 /nfs/dbraw/zinc/31/24/85/623312485.db2.gz PFUZXHIPUJOHTG-LKFCYVNXSA-N 0 3 285.771 2.711 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](C)Cc2cnn(C)c2)c1[O-] ZINC000825045632 623615893 /nfs/dbraw/zinc/61/58/93/623615893.db2.gz IHCLVOIXOXJUFP-NSHDSACASA-N 0 3 293.798 2.808 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H]2CO)c1[O-] ZINC000825184182 623646452 /nfs/dbraw/zinc/64/64/52/623646452.db2.gz WLTQTBUQRODGOY-ZWNOBZJWSA-N 0 3 269.772 2.605 20 10 CFCDHN C[C@H]([NH2+]CCN1CCC[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000185028517 625675588 /nfs/dbraw/zinc/67/55/88/625675588.db2.gz APQSWZBLOCXNCK-STQMWFEESA-N 0 3 280.387 2.914 20 10 CFCDHN COCCC1CN(C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000826893905 623904042 /nfs/dbraw/zinc/90/40/42/623904042.db2.gz GNSVTKNTSWRCPO-SNAWJCMRSA-N 0 3 274.408 2.734 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H](CO)CC2CC2)c1[O-] ZINC000827359343 623992623 /nfs/dbraw/zinc/99/26/23/623992623.db2.gz MDOHETHAFGVLKN-GFCCVEGCSA-N 0 3 283.799 2.852 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000827751924 624086265 /nfs/dbraw/zinc/08/62/65/624086265.db2.gz YVLKULSLRWEPJZ-HOCLYGCPSA-N 0 3 295.354 2.743 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCOC[C@H]2CCOC2)c([O-])c1 ZINC000185523846 625735635 /nfs/dbraw/zinc/73/56/35/625735635.db2.gz CLQZDRKNSNQFJC-HUUCEWRRSA-N 0 3 293.407 2.794 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC1(CCO)CCC1)CC2 ZINC000834685454 625783150 /nfs/dbraw/zinc/78/31/50/625783150.db2.gz VNTSYCQIEKKSNG-ZDUSSCGKSA-N 0 3 261.365 2.522 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@@H](O)Cc1ccccc1 ZINC000834689086 625784638 /nfs/dbraw/zinc/78/46/38/625784638.db2.gz JKIGJBNQQWERDM-OWQGQXMQSA-N 0 3 297.398 2.961 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@](C)(O)COC)c1ccc(C)cc1[O-] ZINC000834844155 625900206 /nfs/dbraw/zinc/90/02/06/625900206.db2.gz NNEBYHMFTMAQQF-GOEBONIOSA-N 0 3 281.396 2.529 20 10 CFCDHN CO[C@@H]1COCC[C@H]1C[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000834880764 625907552 /nfs/dbraw/zinc/90/75/52/625907552.db2.gz QAICMBAZURGWQR-OFQRWUPVSA-N 0 3 293.407 2.711 20 10 CFCDHN CCN1C[C@H]([NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])CC1=O ZINC000834888823 625910785 /nfs/dbraw/zinc/91/07/85/625910785.db2.gz QHOZOOYIJGLPJI-CMPLNLGQSA-N 0 3 296.798 2.625 20 10 CFCDHN CCO[C@@H]1COC[C@H]1[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000834902518 625916778 /nfs/dbraw/zinc/91/67/78/625916778.db2.gz CFPYCYBRTGKIPF-LERXQTSPSA-N 0 3 299.798 2.809 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)C1CCC1)c1ccc(C)cc1[O-] ZINC000834906969 625919279 /nfs/dbraw/zinc/91/92/79/625919279.db2.gz VGJINXQFYTWBSR-HOCLYGCPSA-N 0 3 263.381 2.902 20 10 CFCDHN O[C@H]1Cc2ccccc2[C@@H]1NCc1ccc2c(c1)CCCO2 ZINC000921824827 626147917 /nfs/dbraw/zinc/14/79/17/626147917.db2.gz ISQBUXLSMCVDDB-HKUYNNGSSA-N 0 3 295.382 2.760 20 10 CFCDHN CCN(CC)c1ccc(CN[C@@H](C)C(OC)OC)cc1F ZINC000922314588 626267223 /nfs/dbraw/zinc/26/72/23/626267223.db2.gz JPLLSIKRTFOHHS-LBPRGKRZSA-N 0 3 298.402 2.769 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000922692935 626343465 /nfs/dbraw/zinc/34/34/65/626343465.db2.gz CHYUNKGYRMUEBH-YPMHNXCESA-N 0 3 289.297 2.982 20 10 CFCDHN Cc1cc(CN2CCCc3c(cnn3C)C2)ccc1N(C)C ZINC000839624203 626548677 /nfs/dbraw/zinc/54/86/77/626548677.db2.gz FLSOPBDPHJMZAC-UHFFFAOYSA-N 0 3 298.434 2.743 20 10 CFCDHN COc1ccc(CN(C)Cc2cc(C)ccc2O)cn1 ZINC000757917805 626567856 /nfs/dbraw/zinc/56/78/56/626567856.db2.gz PSTRWTQJOBRKDY-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000761500612 626840700 /nfs/dbraw/zinc/84/07/00/626840700.db2.gz XPFLLMOPJGSIJY-GOEBONIOSA-N 0 3 274.408 2.917 20 10 CFCDHN Oc1cc2c(cc1CN1CC[C@H]1c1ccccc1)[C@@H](O)CO2 ZINC000768439933 627343470 /nfs/dbraw/zinc/34/34/70/627343470.db2.gz QGEGIQKAVLKWPO-RDJZCZTQSA-N 0 3 297.354 2.765 20 10 CFCDHN CCOc1ccc(C[N@H+](CCO)CC(C)(C)C)c([O-])c1 ZINC000769338628 627426711 /nfs/dbraw/zinc/42/67/11/627426711.db2.gz RROLADNSNYLARK-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCO)CC(C)(C)C)c([O-])c1 ZINC000769338628 627426714 /nfs/dbraw/zinc/42/67/14/627426714.db2.gz RROLADNSNYLARK-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000769445394 627439522 /nfs/dbraw/zinc/43/95/22/627439522.db2.gz HOXBHFMEHRJXGD-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000769445394 627439525 /nfs/dbraw/zinc/43/95/25/627439525.db2.gz HOXBHFMEHRJXGD-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)CCCOC(C)C ZINC000769457940 627440602 /nfs/dbraw/zinc/44/06/02/627440602.db2.gz WSXTWABMUUSTNY-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)CCCOC(C)C ZINC000769457940 627440606 /nfs/dbraw/zinc/44/06/06/627440606.db2.gz WSXTWABMUUSTNY-UHFFFAOYSA-N 0 3 267.369 2.648 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000769451508 627441050 /nfs/dbraw/zinc/44/10/50/627441050.db2.gz MRKSRUGVXUZJNW-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c([O-])c1 ZINC000769451508 627441052 /nfs/dbraw/zinc/44/10/52/627441052.db2.gz MRKSRUGVXUZJNW-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN C/C=C\C[C@H](CO)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000769996221 627495365 /nfs/dbraw/zinc/49/53/65/627495365.db2.gz UGFJAYRBERVNFO-WNAVDHLQSA-N 0 3 279.355 2.996 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c([O-])c1 ZINC000771888409 627643278 /nfs/dbraw/zinc/64/32/78/627643278.db2.gz OTDLPCDHRFNKAQ-XJKSGUPXSA-N 0 3 279.380 2.694 20 10 CFCDHN CCCCNC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000774480980 627931611 /nfs/dbraw/zinc/93/16/11/627931611.db2.gz GPFZOCCNMIKKQB-KGLIPLIRSA-N 0 3 291.439 2.708 20 10 CFCDHN C[C@H](NC/C=C/Cl)c1ccc(N2CCOCC2)cc1 ZINC000775261488 628005045 /nfs/dbraw/zinc/00/50/45/628005045.db2.gz VLQQJFXIPKKPIX-VRMVNXKISA-N 0 3 280.799 2.926 20 10 CFCDHN C[C@@H](NCc1cnc2cnccn12)c1ccc(N(C)C)cc1 ZINC000775363310 628015431 /nfs/dbraw/zinc/01/54/31/628015431.db2.gz MPIUNRFVOCIGFM-CYBMUJFWSA-N 0 3 295.390 2.646 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1ccccc1[O-] ZINC000775511705 628032872 /nfs/dbraw/zinc/03/28/72/628032872.db2.gz IGYKISBJCVPDFM-ZBFHGGJFSA-N 0 3 294.464 2.870 20 10 CFCDHN CC[C@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1ccccc1[O-] ZINC000775511704 628033015 /nfs/dbraw/zinc/03/30/15/628033015.db2.gz IGYKISBJCVPDFM-HOCLYGCPSA-N 0 3 294.464 2.870 20 10 CFCDHN CCO[C@@H]1COCC[C@@H]1[NH2+][C@H](CC)c1ccccc1[O-] ZINC000775556384 628036748 /nfs/dbraw/zinc/03/67/48/628036748.db2.gz XRWZQQWRGKOPKQ-IJEWVQPXSA-N 0 3 279.380 2.627 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCN(C(C)C)CC2)c1O ZINC000775648058 628049567 /nfs/dbraw/zinc/04/95/67/628049567.db2.gz ONSCEYOIYUQTPS-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN CCOc1ccc(C[NH2+]C2(CO)CCCCC2)c([O-])c1 ZINC000776499963 628153949 /nfs/dbraw/zinc/15/39/49/628153949.db2.gz ZODWOSXAOGBOKZ-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN Cc1n[nH]cc1[C@H](C)NCc1ccc(N(C)C)cc1C ZINC000779064414 628349149 /nfs/dbraw/zinc/34/91/49/628349149.db2.gz HWEKGVVQFWXWKZ-LBPRGKRZSA-N 0 3 272.396 2.943 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1cccc(F)c1)c1ccccc1[O-] ZINC000783522200 628716188 /nfs/dbraw/zinc/71/61/88/628716188.db2.gz MLIFUAOXONTMDY-IAQYHMDHSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H](N[C@H](CO)c1cccc(F)c1)c1ccccc1O ZINC000783522200 628716189 /nfs/dbraw/zinc/71/61/89/628716189.db2.gz MLIFUAOXONTMDY-IAQYHMDHSA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cc(Cl)cc(CN2CCOCC3(CC3)C2)c1O ZINC000783600076 628725885 /nfs/dbraw/zinc/72/58/85/628725885.db2.gz VALIAHGXDKZWLH-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1C[C@H]2C[C@@]2(CO)C1 ZINC000783744081 628741168 /nfs/dbraw/zinc/74/11/68/628741168.db2.gz SJXQEIDDVUXYLL-MJGOQNOKSA-N 0 3 295.382 2.873 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@H]2C[C@@]2(CO)C1 ZINC000783744081 628741174 /nfs/dbraw/zinc/74/11/74/628741174.db2.gz SJXQEIDDVUXYLL-MJGOQNOKSA-N 0 3 295.382 2.873 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000784686723 628837090 /nfs/dbraw/zinc/83/70/90/628837090.db2.gz NNSAYDKXBKXZIO-IRXDYDNUSA-N 0 3 291.391 2.838 20 10 CFCDHN CCn1ccc(CN(C)Cc2cc3c(cc2O)OCO3)c1 ZINC000790449729 629240518 /nfs/dbraw/zinc/24/05/18/629240518.db2.gz CLKXPEJPZFEGIQ-UHFFFAOYSA-N 0 3 288.347 2.574 20 10 CFCDHN CN(C)c1ccc(/C=C\CN(C)C[C@H]2CCCO2)cc1 ZINC000835025030 629321207 /nfs/dbraw/zinc/32/12/07/629321207.db2.gz FWSXUDSUBXMWET-XQDHMALISA-N 0 3 274.408 2.877 20 10 CFCDHN COc1ccc(CNC/C=C\c2ccc(N(C)C)cc2)cn1 ZINC000835035174 629329919 /nfs/dbraw/zinc/32/99/19/629329919.db2.gz GKHFXJMEJJQONW-PLNGDYQASA-N 0 3 297.402 2.959 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CCOCC3(CC3)C2)cc1 ZINC000835047315 629345354 /nfs/dbraw/zinc/34/53/54/629345354.db2.gz GAKHXRYMQQYZJV-ARJAWSKDSA-N 0 3 286.419 2.878 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccc3c[nH]nc3c2)c([O-])c1 ZINC000793387606 629535831 /nfs/dbraw/zinc/53/58/31/629535831.db2.gz IJOPPURQKTVGGO-UHFFFAOYSA-N 0 3 283.331 2.567 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)CC2(OC)CCC2)c([O-])c1 ZINC000793391593 629536580 /nfs/dbraw/zinc/53/65/80/629536580.db2.gz ZRHHHVBVXRFTDW-LBPRGKRZSA-N 0 3 279.380 2.838 20 10 CFCDHN Cc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)n(C)n1 ZINC000793561994 629572301 /nfs/dbraw/zinc/57/23/01/629572301.db2.gz SMGJNRCRXJMTSX-NOZJJQNGSA-N 0 3 289.354 2.911 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000793567602 629572759 /nfs/dbraw/zinc/57/27/59/629572759.db2.gz ZMEYXQFUSPKYFT-PWSUYJOCSA-N 0 3 279.355 2.974 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCCCC[C@@H]1CCO ZINC000793610671 629577892 /nfs/dbraw/zinc/57/78/92/629577892.db2.gz VOSOODFXMAKCEJ-CQSZACIVSA-N 0 3 267.344 2.658 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCCCC[C@@H]1CCO ZINC000793610671 629577895 /nfs/dbraw/zinc/57/78/95/629577895.db2.gz VOSOODFXMAKCEJ-CQSZACIVSA-N 0 3 267.344 2.658 20 10 CFCDHN C[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H](C2CC2)O1 ZINC000794660719 629672064 /nfs/dbraw/zinc/67/20/64/629672064.db2.gz UGJKRMKLQAZOHO-SGTLLEGYSA-N 0 3 287.403 2.880 20 10 CFCDHN C[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H](C2CC2)O1 ZINC000794660715 629672293 /nfs/dbraw/zinc/67/22/93/629672293.db2.gz UGJKRMKLQAZOHO-KPZWWZAWSA-N 0 3 287.403 2.880 20 10 CFCDHN CC[C@H]([NH2+]CCn1cccn1)c1ccc(C)cc1[O-] ZINC000794810896 629688782 /nfs/dbraw/zinc/68/87/82/629688782.db2.gz NPEZPTKKEDDLNP-AWEZNQCLSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@@H]([NH2+]CC[S@@](=O)CC)c1ccc(C)cc1[O-] ZINC000794809170 629688817 /nfs/dbraw/zinc/68/88/17/629688817.db2.gz RBPVBSBYOWZYHA-ACJLOTCBSA-N 0 3 269.410 2.510 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CCS(C)(=O)=O)c1ccc(C)cc1[O-] ZINC000794809292 629688888 /nfs/dbraw/zinc/68/88/88/629688888.db2.gz FROOEFUELONKGI-GXTWGEPZSA-N 0 3 299.436 2.565 20 10 CFCDHN CC[C@@H]([NH2+]CCn1cccn1)c1ccc(C)cc1[O-] ZINC000794810897 629688966 /nfs/dbraw/zinc/68/89/66/629688966.db2.gz NPEZPTKKEDDLNP-CQSZACIVSA-N 0 3 259.353 2.638 20 10 CFCDHN CC[C@@H]([NH2+]CCc1cncn1C)c1ccc(C)cc1[O-] ZINC000794815876 629689407 /nfs/dbraw/zinc/68/94/07/629689407.db2.gz PVRINOGKXBACKW-OAHLLOKOSA-N 0 3 273.380 2.718 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCn2ccnc2C1)c1ccc(C)cc1[O-] ZINC000794812384 629689680 /nfs/dbraw/zinc/68/96/80/629689680.db2.gz CDUHLXBKNFFTBV-ZFWWWQNUSA-N 0 3 285.391 2.953 20 10 CFCDHN C[S@](=O)Cc1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000796526110 629930779 /nfs/dbraw/zinc/93/07/79/629930779.db2.gz JEKTYTZGWLYXDR-FQEVSTJZSA-N 0 3 289.400 2.561 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cn(C(C)C)nc2C)c([O-])c1 ZINC000798954122 630264284 /nfs/dbraw/zinc/26/42/84/630264284.db2.gz PZHRNHVSBFKUNO-UHFFFAOYSA-N 0 3 289.379 2.776 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798963815 630265448 /nfs/dbraw/zinc/26/54/48/630265448.db2.gz GAHMIVLRYYBXIK-CYBMUJFWSA-N 0 3 254.333 2.777 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798963815 630265450 /nfs/dbraw/zinc/26/54/50/630265450.db2.gz GAHMIVLRYYBXIK-CYBMUJFWSA-N 0 3 254.333 2.777 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000798965285 630265467 /nfs/dbraw/zinc/26/54/67/630265467.db2.gz QUFWZVFMGTZBNT-LBPRGKRZSA-N 0 3 272.323 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000798965285 630265469 /nfs/dbraw/zinc/26/54/69/630265469.db2.gz QUFWZVFMGTZBNT-LBPRGKRZSA-N 0 3 272.323 2.916 20 10 CFCDHN CCOc1ccc(C[NH2+]C(CC)(CC)CCO)c([O-])c1 ZINC000800894601 630415221 /nfs/dbraw/zinc/41/52/21/630415221.db2.gz BIRDJEOQWMJPMO-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cccnc1N(C)C ZINC000808388349 630985126 /nfs/dbraw/zinc/98/51/26/630985126.db2.gz FXNCVNLCNUCLIA-UHFFFAOYSA-N 0 3 298.434 2.812 20 10 CFCDHN CCCNC(=O)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672679 631026271 /nfs/dbraw/zinc/02/62/71/631026271.db2.gz RERNZLHOQDUSEK-SNVBAGLBSA-N 0 3 284.787 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@H](C)O)c1[O-] ZINC000808694545 631030051 /nfs/dbraw/zinc/03/00/51/631030051.db2.gz AEVCIQLBJKRMJX-VHSXEESVSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1noc(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])n1 ZINC000808705683 631030511 /nfs/dbraw/zinc/03/05/11/631030511.db2.gz OEPGZJZOMQXTRA-VIFPVBQESA-N 0 3 295.770 2.939 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCn2ccnn2)c1[O-] ZINC000808712148 631033095 /nfs/dbraw/zinc/03/30/95/631033095.db2.gz CDIOUDAYXBLZMY-LLVKDONJSA-N 0 3 294.786 2.686 20 10 CFCDHN CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000840768663 631221355 /nfs/dbraw/zinc/22/13/55/631221355.db2.gz XNZNAVVOSRWGTN-HZSPNIEDSA-N 0 3 261.365 2.925 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCCNC2=O)c1[O-] ZINC000840825874 631232420 /nfs/dbraw/zinc/23/24/20/631232420.db2.gz CCAFWGUMGFVEDU-QWRGUYRKSA-N 0 3 296.798 2.531 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCCC(F)(F)[C@@H]1O)CC2 ZINC000840886539 631252428 /nfs/dbraw/zinc/25/24/28/631252428.db2.gz GPCCDYSTCUBHCJ-UHIISALHSA-N 0 3 283.318 2.518 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)C(=O)NC(C)C)c1ccc(C)cc1[O-] ZINC000840891933 631254417 /nfs/dbraw/zinc/25/44/17/631254417.db2.gz WFQPTFSBYWCHMF-TZMCWYRMSA-N 0 3 278.396 2.654 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000809706396 631268190 /nfs/dbraw/zinc/26/81/90/631268190.db2.gz WZOBRPUKKZQABT-UHFFFAOYSA-N 0 3 263.234 2.963 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H](CO)C(C)C)c1[O-] ZINC000809724200 631271359 /nfs/dbraw/zinc/27/13/59/631271359.db2.gz XTPLMZQWLCGLLR-LBPRGKRZSA-N 0 3 271.788 2.708 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN1CC2(C1)CCCOC2 ZINC000840953807 631280433 /nfs/dbraw/zinc/28/04/33/631280433.db2.gz ZNCYBTKDSNYCSV-UHFFFAOYSA-N 0 3 274.408 2.673 20 10 CFCDHN C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763866 631283075 /nfs/dbraw/zinc/28/30/75/631283075.db2.gz AMYYGWSDTOFCPK-FZMZJTMJSA-N 0 3 282.815 2.818 20 10 CFCDHN C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cc(Cl)ccc1[O-] ZINC000809763866 631283078 /nfs/dbraw/zinc/28/30/78/631283078.db2.gz AMYYGWSDTOFCPK-FZMZJTMJSA-N 0 3 282.815 2.818 20 10 CFCDHN COCC[C@H](C)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000840955696 631283677 /nfs/dbraw/zinc/28/36/77/631283677.db2.gz VCHYTBVKUWJSJR-JTQLQIEISA-N 0 3 287.787 2.816 20 10 CFCDHN CCCCN(C)C[C@H](C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000809793181 631292120 /nfs/dbraw/zinc/29/21/20/631292120.db2.gz SWDUBYRZBHGKOM-LBPRGKRZSA-N 0 3 268.376 2.741 20 10 CFCDHN C[S@](=O)c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000809793618 631292467 /nfs/dbraw/zinc/29/24/67/631292467.db2.gz IMYKYUNRGGTXFR-FQEVSTJZSA-N 0 3 293.363 2.559 20 10 CFCDHN C[C@@H](NCc1c([O-])ccc(Cl)c1F)[C@@H]1CCC[NH2+]C1 ZINC000841034122 631313937 /nfs/dbraw/zinc/31/39/37/631313937.db2.gz WDPSPQCKAOFWHN-NXEZZACHSA-N 0 3 286.778 2.662 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2cc(C)cc(N)c2)c([O-])c1 ZINC000841071264 631328848 /nfs/dbraw/zinc/32/88/48/631328848.db2.gz LOPCOPAVUSCLEK-UHFFFAOYSA-N 0 3 286.375 2.971 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(Cl)cc1[O-] ZINC000841752476 631465425 /nfs/dbraw/zinc/46/54/25/631465425.db2.gz AXUXJEHSOGTPKJ-GXSJLCMTSA-N 0 3 291.782 2.977 20 10 CFCDHN CC[C@H]([NH2+]CC1(N(C)C)CC1)c1ccc(C)cc1[O-] ZINC000841764238 631468858 /nfs/dbraw/zinc/46/88/58/631468858.db2.gz UWUXIXDRBLFMMS-AWEZNQCLSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)NCc1cn(C)cn1 ZINC000842222261 631567827 /nfs/dbraw/zinc/56/78/27/631567827.db2.gz GMKQNXJILMLVMO-AWEZNQCLSA-N 0 3 286.423 2.515 20 10 CFCDHN CCCCN(C)C[C@@H](C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000811511747 631574623 /nfs/dbraw/zinc/57/46/23/631574623.db2.gz SWDUBYRZBHGKOM-GFCCVEGCSA-N 0 3 268.376 2.741 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)CO1 ZINC000842927231 631782955 /nfs/dbraw/zinc/78/29/55/631782955.db2.gz DFLTYPPMEXGFRI-MIZYBKAJSA-N 0 3 265.328 2.847 20 10 CFCDHN CN(C)Cc1cccc(C(=O)N(C)Cc2ccccc2O)c1 ZINC000155813977 650033247 /nfs/dbraw/zinc/03/32/47/650033247.db2.gz IJVLFWFTBNIANK-UHFFFAOYSA-N 0 3 298.386 2.726 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@]3(CC[NH2+]C3)C2)c(Cl)c1 ZINC000843120301 631842264 /nfs/dbraw/zinc/84/22/64/631842264.db2.gz DLZJIYDLROSUDV-HNNXBMFYSA-N 0 3 280.799 2.539 20 10 CFCDHN CC(C)[C@@H]([NH2+]Cc1ccccc1[O-])C1(CO)CC=CC1 ZINC000843432391 631957216 /nfs/dbraw/zinc/95/72/16/631957216.db2.gz CLNUCAGEEDRDQQ-MRXNPFEDSA-N 0 3 275.392 2.835 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1 ZINC000814172038 632021968 /nfs/dbraw/zinc/02/19/68/632021968.db2.gz WWAPMXLZDBALEL-PIIMJCKOSA-N 0 3 295.382 2.729 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1 ZINC000814172038 632021972 /nfs/dbraw/zinc/02/19/72/632021972.db2.gz WWAPMXLZDBALEL-PIIMJCKOSA-N 0 3 295.382 2.729 20 10 CFCDHN COc1ccc(F)c(CNCc2ccccc2O)c1 ZINC000815123020 632206554 /nfs/dbraw/zinc/20/65/54/632206554.db2.gz UBNIGDWUODUGDZ-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN Cc1cc(CN2C[C@H]3[C@@H](C2)C3(F)F)ccc1N(C)C ZINC000844463963 632221079 /nfs/dbraw/zinc/22/10/79/632221079.db2.gz UJIYSFCTGSDPHA-BETUJISGSA-N 0 3 266.335 2.758 20 10 CFCDHN CN(CC[N@H+](C)Cc1cc(Cl)c(F)cc1[O-])C1CC1 ZINC000816611471 632493992 /nfs/dbraw/zinc/49/39/92/632493992.db2.gz QUHFSVKPQYZUFR-UHFFFAOYSA-N 0 3 286.778 2.711 20 10 CFCDHN CN(CC[N@@H+](C)Cc1cc(Cl)c(F)cc1[O-])C1CC1 ZINC000816611471 632494000 /nfs/dbraw/zinc/49/40/00/632494000.db2.gz QUHFSVKPQYZUFR-UHFFFAOYSA-N 0 3 286.778 2.711 20 10 CFCDHN CCc1noc(C)c1CNCc1cc(F)ccc1O ZINC000816638594 632499572 /nfs/dbraw/zinc/49/95/72/632499572.db2.gz RZLHRXGPPLGDQI-UHFFFAOYSA-N 0 3 264.300 2.680 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C2CC2)C2CCOCC2)c1 ZINC000846043008 632622873 /nfs/dbraw/zinc/62/28/73/632622873.db2.gz RKVXGWPNHIBYRL-QGZVFWFLSA-N 0 3 275.392 2.995 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](CCO)CC2)c([O-])c1 ZINC000817419204 632628414 /nfs/dbraw/zinc/62/84/14/632628414.db2.gz QYQHPENYNJQDHN-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](CCO)CC2)c([O-])c1 ZINC000817419204 632628419 /nfs/dbraw/zinc/62/84/19/632628419.db2.gz QYQHPENYNJQDHN-AWEZNQCLSA-N 0 3 293.407 2.775 20 10 CFCDHN COc1cccc([C@H](C)NC[C@@H](OC)C(F)(F)F)c1O ZINC000846163737 632650894 /nfs/dbraw/zinc/65/08/94/632650894.db2.gz QQEFBTJBBVITER-GZMMTYOYSA-N 0 3 293.285 2.629 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1ccccc1[O-] ZINC000846180116 632655353 /nfs/dbraw/zinc/65/53/53/632655353.db2.gz SAEBMUYMDOSIIQ-IFXJQAMLSA-N 0 3 297.398 2.919 20 10 CFCDHN CON1CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2[O-])CC1 ZINC000817587265 632671124 /nfs/dbraw/zinc/67/11/24/632671124.db2.gz CXONCBVFNOMIQR-ZDUSSCGKSA-N 0 3 278.396 2.685 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])CCOCC1 ZINC000817589205 632672188 /nfs/dbraw/zinc/67/21/88/632672188.db2.gz VYSQRFFJMQKHCD-VXGBXAGGSA-N 0 3 297.370 2.766 20 10 CFCDHN COC1([C@H](C)[NH2+][C@@H](C)c2ccccc2[O-])CCOCC1 ZINC000817588027 632672216 /nfs/dbraw/zinc/67/22/16/632672216.db2.gz LGRZJWLWESVVIH-STQMWFEESA-N 0 3 279.380 2.627 20 10 CFCDHN C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cnccc1N ZINC000817900919 632724025 /nfs/dbraw/zinc/72/40/25/632724025.db2.gz RCDKNMNFMWVHPJ-LLVKDONJSA-N 0 3 288.370 2.550 20 10 CFCDHN CNCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817951613 632751689 /nfs/dbraw/zinc/75/16/89/632751689.db2.gz HJRCLYHNSZDNDQ-ZETCQYMHSA-N 0 3 263.168 2.569 20 10 CFCDHN CC(C)[NH2+]CCCN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000817952941 632752902 /nfs/dbraw/zinc/75/29/02/632752902.db2.gz JNAFWVNXVORFAD-JTQLQIEISA-N 0 3 272.339 2.709 20 10 CFCDHN C[C@H]([NH2+]C[C@H](N)c1ccccc1)c1ccccc1[O-] ZINC000817955020 632754944 /nfs/dbraw/zinc/75/49/44/632754944.db2.gz OSXWZPQYDRRXGX-WFASDCNBSA-N 0 3 256.349 2.743 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CN)C1CC1)c1ccc2ccccc2c1[O-] ZINC000817960321 632759583 /nfs/dbraw/zinc/75/95/83/632759583.db2.gz LXCKCZMGQXIPRM-BZNIZROVSA-N 0 3 270.376 2.933 20 10 CFCDHN C[C@@H](N[C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(Cl)c(Cl)c1[O-] ZINC000817977797 632775114 /nfs/dbraw/zinc/77/51/14/632775114.db2.gz PECGTYPDSXTECL-WJOUQXRDSA-N 0 3 287.190 2.567 20 10 CFCDHN C[C@@H](N[C@@H]1[C@H]2C[NH2+]C[C@H]21)c1cc(Cl)c(Cl)cc1[O-] ZINC000817977644 632775335 /nfs/dbraw/zinc/77/53/35/632775335.db2.gz MNWFNPOEZUMZNB-WRNXMPKJSA-N 0 3 287.190 2.567 20 10 CFCDHN CC[C@@H](N[C@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 ZINC000817981075 632777953 /nfs/dbraw/zinc/77/79/53/632777953.db2.gz PSRMXUNYKPQOBD-CABCVRRESA-N 0 3 297.393 2.791 20 10 CFCDHN C[C@@H]([NH2+][C@H](CN)C1CCCC1)c1ccc(F)cc1[O-] ZINC000817981452 632778194 /nfs/dbraw/zinc/77/81/94/632778194.db2.gz KBMUAKDIHLEARP-QMTHXVAHSA-N 0 3 266.360 2.699 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1cc(F)cc(F)c1[O-] ZINC000817985926 632782307 /nfs/dbraw/zinc/78/23/07/632782307.db2.gz OJHNLIHXXSNWPV-CMPLNLGQSA-N 0 3 296.361 2.996 20 10 CFCDHN c1csc(SCCCN[C@@H]2CCCn3ccnc32)n1 ZINC000848529813 633278744 /nfs/dbraw/zinc/27/87/44/633278744.db2.gz YGBLOPIWTAVJJT-LLVKDONJSA-N 0 3 294.449 2.947 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CC1)[C@@H]1CCCCO1 ZINC000848559594 633289233 /nfs/dbraw/zinc/28/92/33/633289233.db2.gz GBCKGWXRDKWKPS-JKSUJKDBSA-N 0 3 261.365 2.830 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[C@@]3([NH3+])C2)c(Cl)c1 ZINC000857226174 635952976 /nfs/dbraw/zinc/95/29/76/635952976.db2.gz GUZKWGVIFLFPLN-IAQYHMDHSA-N 0 3 280.799 2.667 20 10 CFCDHN CCc1cccc(CN(CC)Cc2cnn(C)c2)c1O ZINC000848883970 633360542 /nfs/dbraw/zinc/36/05/42/633360542.db2.gz WMXSKGVUHZJKBX-UHFFFAOYSA-N 0 3 273.380 2.710 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOCC(F)(F)F)c([O-])c1 ZINC000108942849 633745475 /nfs/dbraw/zinc/74/54/75/633745475.db2.gz IJJJRDRSPKBZJT-JTQLQIEISA-N 0 3 277.286 2.930 20 10 CFCDHN CN1CCCc2cc(CNCc3cnc4n3CCC4)ccc21 ZINC000850099823 633841220 /nfs/dbraw/zinc/84/12/20/633841220.db2.gz ZMOPCDUTWBLVDJ-UHFFFAOYSA-N 0 3 296.418 2.502 20 10 CFCDHN CCSC1(C[NH2+]Cc2c([O-])cccc2OC)CC1 ZINC000850394635 633976141 /nfs/dbraw/zinc/97/61/41/633976141.db2.gz XNYSWOLSTQYABU-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1CCCn2nccc21 ZINC000850435356 633991160 /nfs/dbraw/zinc/99/11/60/633991160.db2.gz MLOYZMKJTSEATL-INIZCTEOSA-N 0 3 284.407 2.882 20 10 CFCDHN Cc1ccncc1CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000850505197 634022440 /nfs/dbraw/zinc/02/24/40/634022440.db2.gz OVTXPCFGYHUTRV-HNNXBMFYSA-N 0 3 268.360 2.915 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C1(CO)CC1)c1ccc(C)cc1[O-] ZINC000850513817 634025701 /nfs/dbraw/zinc/02/57/01/634025701.db2.gz HAIMCQPVYDEOST-GXTWGEPZSA-N 0 3 263.381 2.902 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000850520718 634028951 /nfs/dbraw/zinc/02/89/51/634028951.db2.gz GSCGOLGKEAYBQM-WCABBAIRSA-N 0 3 253.317 2.704 20 10 CFCDHN C[C@H]([NH2+]CC1(CC(N)=O)CCCCC1)c1ccccc1[O-] ZINC000850573283 634058090 /nfs/dbraw/zinc/05/80/90/634058090.db2.gz KEFYTNVEIYIYKZ-ZDUSSCGKSA-N 0 3 290.407 2.869 20 10 CFCDHN C[NH2+]C[C@H](C)N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000854230893 635268379 /nfs/dbraw/zinc/26/83/79/635268379.db2.gz BGRVQPDQKBCJPZ-YUMQZZPRSA-N 0 3 277.195 2.958 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc2c(cc1[O-])OCO2)C(C)(C)C ZINC000112375914 635343768 /nfs/dbraw/zinc/34/37/68/635343768.db2.gz VPDFLKLEFLHQHF-SECBINFHSA-N 0 3 251.326 2.645 20 10 CFCDHN CCn1cc(CNCc2ccc(N(C)C)cc2C)cn1 ZINC000115629632 636025490 /nfs/dbraw/zinc/02/54/90/636025490.db2.gz NMBMIBDNVALITR-UHFFFAOYSA-N 0 3 272.396 2.567 20 10 CFCDHN C[C@H](CC(C)(C)O)NCc1cc(F)c(N(C)C)cc1F ZINC000858172838 636147466 /nfs/dbraw/zinc/14/74/66/636147466.db2.gz IISLLQLCDMUGDV-SNVBAGLBSA-N 0 3 286.366 2.670 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnc([C@H](C)O)s2)c1 ZINC000858238966 636160872 /nfs/dbraw/zinc/16/08/72/636160872.db2.gz GDBZGOZPLFIJQB-JTQLQIEISA-N 0 3 278.377 2.500 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2C[C@@H](O)C2)c1[O-] ZINC000858544219 636287224 /nfs/dbraw/zinc/28/72/24/636287224.db2.gz SCBSHZZXJHEYBS-JBLDHEPKSA-N 0 3 269.772 2.776 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)Nc1ccnc(CO)c1 ZINC000858572414 636297509 /nfs/dbraw/zinc/29/75/09/636297509.db2.gz SESOQAPWUWPZNI-AWEZNQCLSA-N 0 3 299.418 2.991 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)C1 ZINC000858584730 636300418 /nfs/dbraw/zinc/30/04/18/636300418.db2.gz WHBXJKXOYUPLHZ-BFLSOPEQSA-N 0 3 265.328 2.847 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)c1ccccc1[O-] ZINC000858603237 636305088 /nfs/dbraw/zinc/30/50/88/636305088.db2.gz VDDRSCWHDCUTNM-HUUCEWRRSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C2CCC2)C1=O)c1ccccc1[O-] ZINC000858603238 636306449 /nfs/dbraw/zinc/30/64/49/636306449.db2.gz VDDRSCWHDCUTNM-LSDHHAIUSA-N 0 3 288.391 2.586 20 10 CFCDHN Cc1c(F)nccc1CNCc1ccc(N(C)C)cc1 ZINC000862262584 637303310 /nfs/dbraw/zinc/30/33/10/637303310.db2.gz BQRWOMDGSMPHPA-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN CC[C@@H]1[C@@H](CO)CCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862384797 637348002 /nfs/dbraw/zinc/34/80/02/637348002.db2.gz KHJGLJFCWIWPRX-IAQYHMDHSA-N 0 3 298.377 2.624 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccc3c(n2)CCC3)c1 ZINC000862478258 637396588 /nfs/dbraw/zinc/39/65/88/637396588.db2.gz FCVUALOUGKLBQM-UHFFFAOYSA-N 0 3 268.360 2.874 20 10 CFCDHN Cc1ccc(O)c(CNC(=O)[C@@H](C)N2CCCCCC2)c1 ZINC000862760501 637483554 /nfs/dbraw/zinc/48/35/54/637483554.db2.gz SRUPWBBOCQGVRR-CQSZACIVSA-N 0 3 290.407 2.581 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(Cl)ccc1[O-] ZINC000863547644 637692530 /nfs/dbraw/zinc/69/25/30/637692530.db2.gz UDAPWDLFTDSOST-ZWKOPEQDSA-N 0 3 268.788 2.837 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC[C@H](C)NC1)c1ccc(F)cc1[O-] ZINC000863546740 637693169 /nfs/dbraw/zinc/69/31/69/637693169.db2.gz NMKFIMSOHAPQJC-SUHUHFCYSA-N 0 3 266.360 2.713 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C(=O)NC)cc1)c1ccccc1[O-] ZINC000120180508 638065922 /nfs/dbraw/zinc/06/59/22/638065922.db2.gz MNJACJAUOYHQCH-MRXNPFEDSA-N 0 3 298.386 2.993 20 10 CFCDHN COc1ccc(F)cc1CNCc1cc(F)ccc1O ZINC000189698324 650394617 /nfs/dbraw/zinc/39/46/17/650394617.db2.gz KWSWPJTYKDPQPG-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN CC[C@]1(CO)CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190233689 650421019 /nfs/dbraw/zinc/42/10/19/650421019.db2.gz AQUUJFDLNFRTMG-HNNXBMFYSA-N 0 3 267.344 2.516 20 10 CFCDHN CC[C@]1(CO)CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190233689 650421020 /nfs/dbraw/zinc/42/10/20/650421020.db2.gz AQUUJFDLNFRTMG-HNNXBMFYSA-N 0 3 267.344 2.516 20 10 CFCDHN CC(C)(F)CNCc1ccc(N2CCOCC2)c(F)c1 ZINC000865653371 638489867 /nfs/dbraw/zinc/48/98/67/638489867.db2.gz FFNQHHUNCNCXHE-UHFFFAOYSA-N 0 3 284.350 2.500 20 10 CFCDHN F[C@@H]1CCCC[C@@H]1NCc1ccc(N2CCOCC2)cc1 ZINC000865698801 638522560 /nfs/dbraw/zinc/52/25/60/638522560.db2.gz ICDOUSBETCJVOH-SJORKVTESA-N 0 3 292.398 2.894 20 10 CFCDHN CCOc1ccc(C[NH2+]CCC(C)(C)OC)c([O-])c1 ZINC000865755650 638554875 /nfs/dbraw/zinc/55/48/75/638554875.db2.gz ASVAJJZRGPJUPB-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN CN1Cc2ccccc2[C@@H]1C[NH2+]Cc1ccccc1[O-] ZINC000865807516 638584718 /nfs/dbraw/zinc/58/47/18/638584718.db2.gz SZUQXLGMNSYICR-INIZCTEOSA-N 0 3 268.360 2.669 20 10 CFCDHN C[C@H](NC/C=C/c1ccc(N(C)C)cc1)c1ccnn1C ZINC000865838235 638603901 /nfs/dbraw/zinc/60/39/01/638603901.db2.gz RXPJNXNOIDHPIM-GJBLVYBDSA-N 0 3 284.407 2.850 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCn2nccc21)c1ccccc1[O-] ZINC000866631693 638857898 /nfs/dbraw/zinc/85/78/98/638857898.db2.gz CWRKZGVLHZFARO-DGCLKSJQSA-N 0 3 257.337 2.774 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H](O)C1CCCC1)c1ccccc1[O-] ZINC000866636885 638859115 /nfs/dbraw/zinc/85/91/15/638859115.db2.gz CANQWQCDLCZMRC-IUODEOHRSA-N 0 3 263.381 2.984 20 10 CFCDHN CC1(C)[C@@H](N)c2ccccc2N1C(=O)Cc1ccc(N)cc1 ZINC000867988534 638911602 /nfs/dbraw/zinc/91/16/02/638911602.db2.gz NTSQOZVPXTXNHF-KRWDZBQOSA-N 0 3 295.386 2.637 20 10 CFCDHN CCOc1cccc(CN[C@H]2c3ccccc3C[C@@H]2O)c1O ZINC000207895555 639331920 /nfs/dbraw/zinc/33/19/20/639331920.db2.gz VWWCRDCNYWCDFV-RDJZCZTQSA-N 0 3 299.370 2.539 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1ccccc1 ZINC000873193644 642058230 /nfs/dbraw/zinc/05/82/30/642058230.db2.gz NGJWJQJIRMOPHS-NVXWUHKLSA-N 0 3 271.360 2.994 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1COc2ccccc2O1)c1ccccc1[O-] ZINC000020137834 642306255 /nfs/dbraw/zinc/30/62/55/642306255.db2.gz SDGZRMCCNWAJHV-CHWSQXEVSA-N 0 3 285.343 2.883 20 10 CFCDHN CCC[N@H+](Cc1ccc(C)cc1[O-])CC(C)(C)O ZINC000876691717 642976515 /nfs/dbraw/zinc/97/65/15/642976515.db2.gz OZBQEWPQQAZSBQ-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC[N@@H+](Cc1ccc(C)cc1[O-])CC(C)(C)O ZINC000876691717 642976518 /nfs/dbraw/zinc/97/65/18/642976518.db2.gz OZBQEWPQQAZSBQ-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc2c(c1)OCO2 ZINC000876898573 643056589 /nfs/dbraw/zinc/05/65/89/643056589.db2.gz UEXXJVZNKWSBNM-UHFFFAOYSA-N 0 3 285.343 2.762 20 10 CFCDHN Cc1ccc(C[NH2+]CCN(C)C(=O)OC(C)(C)C)c([O-])c1 ZINC000876995500 643097666 /nfs/dbraw/zinc/09/76/66/643097666.db2.gz DTCWBWVSUJASQT-UHFFFAOYSA-N 0 3 294.395 2.657 20 10 CFCDHN COCCC1(C[NH2+]Cc2c(C)cccc2[O-])CCC1 ZINC000877083801 643142594 /nfs/dbraw/zinc/14/25/94/643142594.db2.gz ANBYSHHIFRDHLE-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[NH2+][C@H]2CCOC3(CCOCC3)C2)c([O-])c1 ZINC000877096080 643150502 /nfs/dbraw/zinc/15/05/02/643150502.db2.gz XDTZOBPHUDTPTA-HNNXBMFYSA-N 0 3 291.391 2.518 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)c1ccc(F)cc1 ZINC000877127687 643165902 /nfs/dbraw/zinc/16/59/02/643165902.db2.gz MYMMJUAARURPQW-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)CCc2ccccc2)c([O-])c1 ZINC000877315585 643234071 /nfs/dbraw/zinc/23/40/71/643234071.db2.gz KIFLVUPPSAXQRB-QGZVFWFLSA-N 0 3 285.387 2.784 20 10 CFCDHN COc1ccc(CN(C)Cc2ccc(C)cc2O)cn1 ZINC000877325892 643240034 /nfs/dbraw/zinc/24/00/34/643240034.db2.gz MWJPMGRARSNEPB-UHFFFAOYSA-N 0 3 272.348 2.736 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877349500 643246560 /nfs/dbraw/zinc/24/65/60/643246560.db2.gz KQCLKELPAINSSB-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN COC[C@H]1CCCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC000877394680 643257219 /nfs/dbraw/zinc/25/72/19/643257219.db2.gz FMRUXOPSBLEBDQ-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@H]1CCCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC000877394680 643257225 /nfs/dbraw/zinc/25/72/25/643257225.db2.gz FMRUXOPSBLEBDQ-AWEZNQCLSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1ccc(CNC2(C(=O)Nc3ccccc3)CC2)c(O)c1 ZINC000877441215 643273874 /nfs/dbraw/zinc/27/38/74/643273874.db2.gz ASCRZMCAILZTNU-UHFFFAOYSA-N 0 3 296.370 2.962 20 10 CFCDHN CCOC(CC[NH2+]Cc1ccc(C)cc1[O-])OCC ZINC000877466399 643286777 /nfs/dbraw/zinc/28/67/77/643286777.db2.gz JAFIYSUVSPYILM-UHFFFAOYSA-N 0 3 267.369 2.579 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@]1(CO)C[C@@H]1c1ccccc1 ZINC000877539963 643342381 /nfs/dbraw/zinc/34/23/81/643342381.db2.gz REEYZPANRXQHEF-IEBWSBKVSA-N 0 3 297.398 2.956 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000877546005 643347975 /nfs/dbraw/zinc/34/79/75/643347975.db2.gz NPIZJWNNGUDRIA-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000877546005 643347979 /nfs/dbraw/zinc/34/79/79/643347979.db2.gz NPIZJWNNGUDRIA-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CCC(c2ccncn2)CC1 ZINC000877586323 643381734 /nfs/dbraw/zinc/38/17/34/643381734.db2.gz AJXPBSAMWQSGCC-UHFFFAOYSA-N 0 3 283.375 2.870 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](CO)c2ccc(F)cc2)c([O-])c1 ZINC000877591222 643385435 /nfs/dbraw/zinc/38/54/35/643385435.db2.gz PFEDUAAJVVWRLK-HNNXBMFYSA-N 0 3 289.350 2.705 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000877604500 643392440 /nfs/dbraw/zinc/39/24/40/643392440.db2.gz MGLHAYCJUSEYOF-IBGZPJMESA-N 0 3 297.398 2.966 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000877604500 643392445 /nfs/dbraw/zinc/39/24/45/643392445.db2.gz MGLHAYCJUSEYOF-IBGZPJMESA-N 0 3 297.398 2.966 20 10 CFCDHN CCC[C@@H](C)[C@@H](CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877610141 643396944 /nfs/dbraw/zinc/39/69/44/643396944.db2.gz GEAVWORPZVAXBJ-TZMCWYRMSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(CN2C[C@H](C)OCC23CCC3)c(O)c1 ZINC000877612887 643399998 /nfs/dbraw/zinc/39/99/98/643399998.db2.gz YPNZLYVFYWTAJU-ZDUSSCGKSA-N 0 3 261.365 2.844 20 10 CFCDHN CC[C@H](COCC1CC1)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877622841 643409383 /nfs/dbraw/zinc/40/93/83/643409383.db2.gz USEFPGDPWAOXBE-OAHLLOKOSA-N 0 3 263.381 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]23OCCC[C@H]2C3(F)F)c([O-])c1 ZINC000877630276 643415650 /nfs/dbraw/zinc/41/56/50/643415650.db2.gz GKCBSGKEIYCLCA-KGLIPLIRSA-N 0 3 283.318 2.605 20 10 CFCDHN Cc1ccc(C[NH2+]CCC2SCCS2)c([O-])c1 ZINC000877636982 643421168 /nfs/dbraw/zinc/42/11/68/643421168.db2.gz MBRJORYBWLZSFN-UHFFFAOYSA-N 0 3 269.435 2.986 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1c2ccccc2C(=O)N1C ZINC000877656238 643435684 /nfs/dbraw/zinc/43/56/84/643435684.db2.gz BGNDECSCIWKSOP-MRXNPFEDSA-N 0 3 296.370 2.617 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H](C1CCC1)[C@H]1CCCO1 ZINC000877701525 643464220 /nfs/dbraw/zinc/46/42/20/643464220.db2.gz ZEIAJFMJCODSHF-HZPDHXFCSA-N 0 3 279.355 2.969 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](C1CCC1)[C@H]1CCCO1 ZINC000877701523 643464968 /nfs/dbraw/zinc/46/49/68/643464968.db2.gz ZEIAJFMJCODSHF-CVEARBPZSA-N 0 3 279.355 2.969 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@@H](O)CC(C)(C)C2)c1O ZINC000877751629 643527050 /nfs/dbraw/zinc/52/70/50/643527050.db2.gz IFXWCWXLMVGKIM-LBPRGKRZSA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@@H](NCc1cc(C(F)(F)F)nn1C)c1ccccc1O ZINC000877755961 643535584 /nfs/dbraw/zinc/53/55/84/643535584.db2.gz UYDLVNVSUUKFKB-SECBINFHSA-N 0 3 299.296 2.995 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(C(F)(F)F)nn1C)c1ccccc1[O-] ZINC000877755961 643535589 /nfs/dbraw/zinc/53/55/89/643535589.db2.gz UYDLVNVSUUKFKB-SECBINFHSA-N 0 3 299.296 2.995 20 10 CFCDHN CCCn1nccc1C[NH2+][C@H](C)c1ccccc1[O-] ZINC000877755583 643535632 /nfs/dbraw/zinc/53/56/32/643535632.db2.gz GRLZSWISLQPWDP-GFCCVEGCSA-N 0 3 259.353 2.850 20 10 CFCDHN C[C@H](CCn1cccn1)[NH2+][C@H](C)c1ccccc1[O-] ZINC000877755555 643535644 /nfs/dbraw/zinc/53/56/44/643535644.db2.gz FOYBNSJVRGKMLQ-CHWSQXEVSA-N 0 3 259.353 2.718 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000877806170 643567926 /nfs/dbraw/zinc/56/79/26/643567926.db2.gz OAWOWLURNBTDOW-VZJVUDMVSA-N 0 3 265.328 2.579 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)N1CCC(C)CC1 ZINC000879649336 644362431 /nfs/dbraw/zinc/36/24/31/644362431.db2.gz QQILMRMDMSKPOD-ZIAGYGMSSA-N 0 3 290.407 2.690 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)C(=O)N1CCCCCC1)c1ccccc1[O-] ZINC000879650060 644363598 /nfs/dbraw/zinc/36/35/98/644363598.db2.gz ZIOKVKHBMRJOAS-KGLIPLIRSA-N 0 3 290.407 2.834 20 10 CFCDHN C[C@H]([NH2+]CC[C@@H]1COC(C)(C)O1)c1ccccc1[O-] ZINC000879650186 644365206 /nfs/dbraw/zinc/36/52/06/644365206.db2.gz NLBZVBFLRHQHIN-NWDGAFQWSA-N 0 3 265.353 2.584 20 10 CFCDHN C[C@H]([NH2+]CC(=O)NC1CCCCCC1)c1ccccc1[O-] ZINC000879653923 644366031 /nfs/dbraw/zinc/36/60/31/644366031.db2.gz YCQXQFKKXADKPI-ZDUSSCGKSA-N 0 3 290.407 2.882 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)N1CCCCCC1 ZINC000879652369 644366300 /nfs/dbraw/zinc/36/63/00/644366300.db2.gz ZIOKVKHBMRJOAS-UONOGXRCSA-N 0 3 290.407 2.834 20 10 CFCDHN CN(C)c1ccc(CN2CCc3ccccc3[C@H]2CO)cc1 ZINC000093455175 650940173 /nfs/dbraw/zinc/94/01/73/650940173.db2.gz OHNVRSPUWUULQW-LJQANCHMSA-N 0 3 296.414 2.844 20 10 CFCDHN CCOc1cccc(CN(C)Cc2cccn2C)c1O ZINC000093584537 650943689 /nfs/dbraw/zinc/94/36/89/650943689.db2.gz WAGKFFSSZVQFJB-UHFFFAOYSA-N 0 3 274.364 2.761 20 10 CFCDHN COC[C@H](C)C[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000249208343 650956490 /nfs/dbraw/zinc/95/64/90/650956490.db2.gz XCGAZIWQVPCZEY-GDBMZVCRSA-N 0 3 293.407 2.656 20 10 CFCDHN COC[C@H](C)C[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000249208343 650956492 /nfs/dbraw/zinc/95/64/92/650956492.db2.gz XCGAZIWQVPCZEY-GDBMZVCRSA-N 0 3 293.407 2.656 20 10 CFCDHN CC(C)N(C)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094618107 650960107 /nfs/dbraw/zinc/96/01/07/650960107.db2.gz VVDVDBWVJCPQOP-NSHDSACASA-N 0 3 254.349 2.522 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1cc(F)ccc1[O-] ZINC000094617963 650960319 /nfs/dbraw/zinc/96/03/19/650960319.db2.gz OHEQNRNEEQWOQC-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1[O-] ZINC000094618361 650960462 /nfs/dbraw/zinc/96/04/62/650960462.db2.gz FDEQAEWHGDNXAK-GYSYKLTISA-N 0 3 267.344 2.733 20 10 CFCDHN CCCCNC(=O)CN(CCC)Cc1ccccc1O ZINC000130728396 645560765 /nfs/dbraw/zinc/56/07/65/645560765.db2.gz JKIMHIZCDGICPU-UHFFFAOYSA-N 0 3 278.396 2.521 20 10 CFCDHN C[C@@H](NCc1ccncc1N)c1ccc(N(C)C)cc1 ZINC000883091917 645601043 /nfs/dbraw/zinc/60/10/43/645601043.db2.gz AIGCFCZXQAEGNE-GFCCVEGCSA-N 0 3 270.380 2.581 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1cc(F)ccc1[O-] ZINC000883275912 645717104 /nfs/dbraw/zinc/71/71/04/645717104.db2.gz CLFXJJPEMYTMOD-AAEUAGOBSA-N 0 3 293.338 2.626 20 10 CFCDHN Cn1nc(CNCc2ccccc2O)c2ccccc21 ZINC000134289498 646322853 /nfs/dbraw/zinc/32/28/53/646322853.db2.gz BDMMYDBBEJIYSS-UHFFFAOYSA-N 0 3 267.332 2.569 20 10 CFCDHN CC[C@](O)(C[NH2+][C@H](C)c1ccccc1[O-])C(F)(F)F ZINC000931554377 649452817 /nfs/dbraw/zinc/45/28/17/649452817.db2.gz ORBJGMMTDPZGGE-SKDRFNHKSA-N 0 3 277.286 2.746 20 10 CFCDHN COc1ccc(C[NH2+]CC2(OC)CCCCC2)c([O-])c1 ZINC000187444279 649686969 /nfs/dbraw/zinc/68/69/69/649686969.db2.gz DRLCOGZGCYBBGV-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN C[N@H+](CCNCc1ccc(F)c(F)c1[O-])C1CCCC1 ZINC000700781103 780718155 /nfs/dbraw/zinc/71/81/55/780718155.db2.gz IBOCVZFYXVPNLL-UHFFFAOYSA-N 0 3 284.350 2.634 20 10 CFCDHN C[N@@H+](CCNCc1ccc(F)c(F)c1[O-])C1CCCC1 ZINC000700781103 780718161 /nfs/dbraw/zinc/71/81/61/780718161.db2.gz IBOCVZFYXVPNLL-UHFFFAOYSA-N 0 3 284.350 2.634 20 10 CFCDHN C[N@H+](Cc1cccc2c[nH]nc21)Cc1ccccc1[O-] ZINC000091956722 769895550 /nfs/dbraw/zinc/89/55/50/769895550.db2.gz ZSYOHZOJFMRAGP-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1cccc2c[nH]nc21)Cc1ccccc1[O-] ZINC000091956722 769895564 /nfs/dbraw/zinc/89/55/64/769895564.db2.gz ZSYOHZOJFMRAGP-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1ccc3c(c1)CCO3)CC2 ZINC001204491490 770208422 /nfs/dbraw/zinc/20/84/22/770208422.db2.gz NJTQHFOAMISZOJ-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1ccc3c(c1)CCO3)CC2 ZINC001204491490 770208427 /nfs/dbraw/zinc/20/84/27/770208427.db2.gz NJTQHFOAMISZOJ-UHFFFAOYSA-N 0 3 281.355 2.885 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)CS(C)(=O)=O)c1ccccc1[O-] ZINC000723879925 770702744 /nfs/dbraw/zinc/70/27/44/770702744.db2.gz UPITXSMTDMQOQB-CYBMUJFWSA-N 0 3 299.436 2.504 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccccc1[O-] ZINC000693890352 775230573 /nfs/dbraw/zinc/23/05/73/775230573.db2.gz PQHQJAYFRKJEDB-STQMWFEESA-N 0 3 262.397 2.916 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3COC[C@H]3C2)c1[O-] ZINC000690800631 775674792 /nfs/dbraw/zinc/67/47/92/775674792.db2.gz ZWCJUEHJZBJMEY-ZYHUDNBSSA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1[O-] ZINC000690800631 775674799 /nfs/dbraw/zinc/67/47/99/775674799.db2.gz ZWCJUEHJZBJMEY-ZYHUDNBSSA-N 0 3 297.782 2.523 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001140948216 775685261 /nfs/dbraw/zinc/68/52/61/775685261.db2.gz YJDFXXXBYOXLFY-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001140948216 775685265 /nfs/dbraw/zinc/68/52/65/775685265.db2.gz YJDFXXXBYOXLFY-XJKSGUPXSA-N 0 3 263.381 2.684 20 10 CFCDHN Oc1ccc(O)c(CN2C[C@@H](CF)[C@H](C(F)(F)F)C2)c1 ZINC001141156683 775963313 /nfs/dbraw/zinc/96/33/13/775963313.db2.gz QOODTJYVSWBEGV-MWLCHTKSSA-N 0 3 293.260 2.678 20 10 CFCDHN COCCCC[N@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000397100407 775990274 /nfs/dbraw/zinc/99/02/74/775990274.db2.gz DCVLXQHESXRMKU-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN COCCCC[N@@H+](C)Cc1cc(Cl)cc(OC)c1[O-] ZINC000397100407 775990283 /nfs/dbraw/zinc/99/02/83/775990283.db2.gz DCVLXQHESXRMKU-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN [O-]c1cccc2c1C[N@H+](Cc1c[nH]c3cnccc13)CC2 ZINC001231519755 777250574 /nfs/dbraw/zinc/25/05/74/777250574.db2.gz IZHXIKJDFWGINW-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN [O-]c1cccc2c1C[N@@H+](Cc1c[nH]c3cnccc13)CC2 ZINC001231519755 777250580 /nfs/dbraw/zinc/25/05/80/777250580.db2.gz IZHXIKJDFWGINW-UHFFFAOYSA-N 0 3 279.343 2.827 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1c([O-])ccc2ccccc21 ZINC001231589339 777268075 /nfs/dbraw/zinc/26/80/75/777268075.db2.gz GSWLEIJWZJMJAF-GJZGRUSLSA-N 0 3 282.387 2.824 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1c([O-])ccc2ccccc21 ZINC001231589339 777268083 /nfs/dbraw/zinc/26/80/83/777268083.db2.gz GSWLEIJWZJMJAF-GJZGRUSLSA-N 0 3 282.387 2.824 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588539 777268324 /nfs/dbraw/zinc/26/83/24/777268324.db2.gz UACKINBDFOHZRV-DGCLKSJQSA-N 0 3 257.333 2.501 20 10 CFCDHN C[C@@H]1C[C@@H](O)C[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001231588539 777268333 /nfs/dbraw/zinc/26/83/33/777268333.db2.gz UACKINBDFOHZRV-DGCLKSJQSA-N 0 3 257.333 2.501 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@]12CCOC2 ZINC001231589636 777269309 /nfs/dbraw/zinc/26/93/09/777269309.db2.gz NWHHOAWHHUEKKF-QGZVFWFLSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@]12CCOC2 ZINC001231589636 777269316 /nfs/dbraw/zinc/26/93/16/777269316.db2.gz NWHHOAWHHUEKKF-QGZVFWFLSA-N 0 3 269.344 2.910 20 10 CFCDHN Cn1ncc2c1CN(Cc1c(O)ccc3ccccc31)CC2 ZINC001231590824 777270324 /nfs/dbraw/zinc/27/03/24/777270324.db2.gz MWXOBOFXOGASTG-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1ncc2c1C[N@H+](Cc1c([O-])ccc3ccccc31)CC2 ZINC001231590824 777270331 /nfs/dbraw/zinc/27/03/31/777270331.db2.gz MWXOBOFXOGASTG-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Cn1ncc2c1C[N@@H+](Cc1c([O-])ccc3ccccc31)CC2 ZINC001231590824 777270338 /nfs/dbraw/zinc/27/03/38/777270338.db2.gz MWXOBOFXOGASTG-UHFFFAOYSA-N 0 3 293.370 2.837 20 10 CFCDHN Oc1ccc2ccccc2c1CN1CCOCC12CC2 ZINC001231590969 777272272 /nfs/dbraw/zinc/27/22/72/777272272.db2.gz SFANJZCFVHYIBZ-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN Cc1ccc(N2CCN(Cc3cccc(C)c3O)CC2)nc1 ZINC001231593455 777272676 /nfs/dbraw/zinc/27/26/76/777272676.db2.gz ZLMRVNGQFIKTKR-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001231841864 777345163 /nfs/dbraw/zinc/34/51/63/777345163.db2.gz FFFWFGIOACZSFU-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN Cc1cc(C)c(C[N@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001231841864 777345166 /nfs/dbraw/zinc/34/51/66/777345166.db2.gz FFFWFGIOACZSFU-QGZVFWFLSA-N 0 3 277.408 2.994 20 10 CFCDHN Cc1cc(C)c(CN2CCOC[C@H]2C2CC2)c(O)c1 ZINC001231849945 777350372 /nfs/dbraw/zinc/35/03/72/777350372.db2.gz XHSVBRQGCFAHAX-HNNXBMFYSA-N 0 3 261.365 2.620 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc2ccccc2c1[O-] ZINC001231884129 777365132 /nfs/dbraw/zinc/36/51/32/777365132.db2.gz XUDUUDVATSZACC-HOTGVXAUSA-N 0 3 282.387 2.824 20 10 CFCDHN CCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc2ccccc2c1[O-] ZINC001231884129 777365141 /nfs/dbraw/zinc/36/51/41/777365141.db2.gz XUDUUDVATSZACC-HOTGVXAUSA-N 0 3 282.387 2.824 20 10 CFCDHN Cn1cc(CN2CCc3cccc(O)c3C2)c(C2CC2)n1 ZINC001232170973 777460523 /nfs/dbraw/zinc/46/05/23/777460523.db2.gz AZAIUWANAVGWSH-UHFFFAOYSA-N 0 3 283.375 2.561 20 10 CFCDHN Clc1cc(CN2CCCC2)ccc1N1CCOCC1 ZINC001232198521 777467348 /nfs/dbraw/zinc/46/73/48/777467348.db2.gz VSQFQDDGICFPDL-UHFFFAOYSA-N 0 3 280.799 2.772 20 10 CFCDHN CN(CCc1cccc(F)c1)Cc1cc(O)c(O)c(O)c1 ZINC001233015066 777764153 /nfs/dbraw/zinc/76/41/53/777764153.db2.gz GQIYZUOZJPIFLD-UHFFFAOYSA-N 0 3 291.322 2.617 20 10 CFCDHN Oc1cc(CN2CC[C@@H](Cc3ccccc3)C2)cc(O)c1O ZINC001233013223 777764869 /nfs/dbraw/zinc/76/48/69/777764869.db2.gz NQYKNDSXPJIIBW-AWEZNQCLSA-N 0 3 299.370 2.868 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](O)CC2)c1[O-] ZINC001233287765 777869800 /nfs/dbraw/zinc/86/98/00/777869800.db2.gz GWKDQEORFQYKHM-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](O)CC2)c1[O-] ZINC001233287765 777869809 /nfs/dbraw/zinc/86/98/09/777869809.db2.gz GWKDQEORFQYKHM-GWCFXTLKSA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@H]1CCC[C@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000688883314 777885915 /nfs/dbraw/zinc/88/59/15/777885915.db2.gz KSEDNQCLVXGYLH-GXFFZTMASA-N 0 3 253.317 2.579 20 10 CFCDHN CC[N@H+](Cc1ccc(C(F)(F)F)cc1[O-])C1CN(C)C1 ZINC001233455680 777959551 /nfs/dbraw/zinc/95/95/51/777959551.db2.gz UTSSUHLMHUTYMF-UHFFFAOYSA-N 0 3 288.313 2.547 20 10 CFCDHN CC[N@@H+](Cc1ccc(C(F)(F)F)cc1[O-])C1CN(C)C1 ZINC001233455680 777959556 /nfs/dbraw/zinc/95/95/56/777959556.db2.gz UTSSUHLMHUTYMF-UHFFFAOYSA-N 0 3 288.313 2.547 20 10 CFCDHN CC[N@@H+](Cc1ccccc1[O-])Cc1cc(O)c(O)cc1O ZINC001233486579 777963275 /nfs/dbraw/zinc/96/32/75/777963275.db2.gz SUGCSCWAAGKUNW-UHFFFAOYSA-N 0 3 289.331 2.531 20 10 CFCDHN CC[N@H+](Cc1ccccc1[O-])Cc1cc(O)c(O)cc1O ZINC001233486579 777963289 /nfs/dbraw/zinc/96/32/89/777963289.db2.gz SUGCSCWAAGKUNW-UHFFFAOYSA-N 0 3 289.331 2.531 20 10 CFCDHN Cc1ccc(CN(C)Cc2cc(O)c(O)cc2O)cc1 ZINC001233485181 777963972 /nfs/dbraw/zinc/96/39/72/777963972.db2.gz LZSJOFOXRSISAV-UHFFFAOYSA-N 0 3 273.332 2.744 20 10 CFCDHN COc1ccc2ccc([O-])c(C[NH+]3CC4(CC(O)C4)C3)c2c1 ZINC001234518065 778242518 /nfs/dbraw/zinc/24/25/18/778242518.db2.gz CAELTSBLNZDKHM-UHFFFAOYSA-N 0 3 299.370 2.511 20 10 CFCDHN COc1ccc2c(c1)C[C@H]([NH2+]Cc1ccccc1[O-])C2 ZINC001168232315 778262702 /nfs/dbraw/zinc/26/27/02/778262702.db2.gz UCBVWPWATQVPBP-OAHLLOKOSA-N 0 3 269.344 2.658 20 10 CFCDHN CCOC[C@H](C)Oc1ccc(N2CCN(CC)CC2)cc1 ZINC001234657751 778279962 /nfs/dbraw/zinc/27/99/62/778279962.db2.gz HIPNLIPDAOTZNX-HNNXBMFYSA-N 0 3 292.423 2.632 20 10 CFCDHN [O-]c1c(C[N@H+]2CC[C@H](CO)C2)cccc1-c1ccccc1 ZINC001234993453 778347423 /nfs/dbraw/zinc/34/74/23/778347423.db2.gz CTVNXIFXJOWAGN-AWEZNQCLSA-N 0 3 283.371 2.873 20 10 CFCDHN [O-]c1c(C[N@@H+]2CC[C@H](CO)C2)cccc1-c1ccccc1 ZINC001234993453 778347431 /nfs/dbraw/zinc/34/74/31/778347431.db2.gz CTVNXIFXJOWAGN-AWEZNQCLSA-N 0 3 283.371 2.873 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@]3(CC[NH2+]C3)C2)cc1Cl ZINC001234997362 778347929 /nfs/dbraw/zinc/34/79/29/778347929.db2.gz BQXYIIKKQXQTDC-MRXNPFEDSA-N 0 3 294.826 2.930 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2CC[NH2+][C@@H]3C[C@@H]32)cc1Cl ZINC001235291338 778445375 /nfs/dbraw/zinc/44/53/75/778445375.db2.gz HWVIZDIXJYYBLK-KGLIPLIRSA-N 0 3 294.826 2.889 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@@H](O)CC2)c([O-])c1 ZINC001235676451 778532571 /nfs/dbraw/zinc/53/25/71/778532571.db2.gz SPABQQRAOMIUKI-CABCVRRESA-N 0 3 295.398 2.985 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](F)[C@@H](O)CC2)c([O-])c1 ZINC001235676451 778532573 /nfs/dbraw/zinc/53/25/73/778532573.db2.gz SPABQQRAOMIUKI-CABCVRRESA-N 0 3 295.398 2.985 20 10 CFCDHN CC[C@H]1CNCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235772853 778556047 /nfs/dbraw/zinc/55/60/47/778556047.db2.gz LVYORINBRMPRET-AWEZNQCLSA-N 0 3 270.376 2.729 20 10 CFCDHN CC[C@H]1CNCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC001235772853 778556052 /nfs/dbraw/zinc/55/60/52/778556052.db2.gz LVYORINBRMPRET-AWEZNQCLSA-N 0 3 270.376 2.729 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@H](C)[NH2+][C@@H](C)C2)cc1Cl ZINC001235903407 778601310 /nfs/dbraw/zinc/60/13/10/778601310.db2.gz ZCJQFBOQVVKOLK-PHIMTYICSA-N 0 3 268.788 2.536 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]([NH3+])CC[C@H]2C)cc1Cl ZINC001235905573 778603744 /nfs/dbraw/zinc/60/37/44/778603744.db2.gz MQMANCKRHVVIEM-ZYHUDNBSSA-N 0 3 268.788 2.666 20 10 CFCDHN Cc1cc([O-])c(CN2CC3(C2)CCCC[NH2+]3)cc1Cl ZINC001235920293 778609130 /nfs/dbraw/zinc/60/91/30/778609130.db2.gz AOHPOZVBRYSOBZ-UHFFFAOYSA-N 0 3 280.799 2.682 20 10 CFCDHN CCN(Cc1cc(Cl)c(OC)cc1[O-])[C@H]1CCC[NH2+]C1 ZINC001236008083 778652964 /nfs/dbraw/zinc/65/29/64/778652964.db2.gz QSASDQVKZHZISE-LBPRGKRZSA-N 0 3 298.814 2.628 20 10 CFCDHN C[C@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])[C@@H](C)C[NH2+]1 ZINC001236079866 778683950 /nfs/dbraw/zinc/68/39/50/778683950.db2.gz WAKPTGHXIXOXSQ-UWVGGRQHSA-N 0 3 288.313 2.593 20 10 CFCDHN COc1cc([O-])c(CN(C)[C@@H]2CCCC[C@H]2[NH3+])c(Cl)c1 ZINC001236214613 778739259 /nfs/dbraw/zinc/73/92/59/778739259.db2.gz GNYNKRDHEZWMRU-ZIAGYGMSSA-N 0 3 298.814 2.756 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c([O-])c1 ZINC001236782677 778933817 /nfs/dbraw/zinc/93/38/17/778933817.db2.gz CUZHFSHGRYGVOM-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2CO)c([O-])c1 ZINC001236782677 778933823 /nfs/dbraw/zinc/93/38/23/778933823.db2.gz CUZHFSHGRYGVOM-WFASDCNBSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](CO)CC2)c([O-])c1 ZINC001236782541 778933971 /nfs/dbraw/zinc/93/39/71/778933971.db2.gz CBIMGCQDJJZEOW-CQSZACIVSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](CO)CC2)c([O-])c1 ZINC001236782541 778933977 /nfs/dbraw/zinc/93/39/77/778933977.db2.gz CBIMGCQDJJZEOW-CQSZACIVSA-N 0 3 263.381 2.549 20 10 CFCDHN CCc1ccc(CN2CCN(C)c3ncccc3C2)c(O)c1 ZINC001236786638 778935968 /nfs/dbraw/zinc/93/59/68/778935968.db2.gz FWUTUFAVXSSWPO-UHFFFAOYSA-N 0 3 297.402 2.802 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@]3(CCCO3)C2)c([O-])c1 ZINC001236783845 778936140 /nfs/dbraw/zinc/93/61/40/778936140.db2.gz OTIFTEUDCDDDAO-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@]3(CCCO3)C2)c([O-])c1 ZINC001236783845 778936144 /nfs/dbraw/zinc/93/61/44/778936144.db2.gz OTIFTEUDCDDDAO-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001236791744 778936890 /nfs/dbraw/zinc/93/68/90/778936890.db2.gz JQRUEHBCUZNCAT-HNNXBMFYSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001236791744 778936896 /nfs/dbraw/zinc/93/68/96/778936896.db2.gz JQRUEHBCUZNCAT-HNNXBMFYSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(n3cccn3)CC2)c([O-])c1 ZINC001236791753 778937085 /nfs/dbraw/zinc/93/70/85/778937085.db2.gz KBJRSESYTVWTQQ-UHFFFAOYSA-N 0 3 285.391 2.988 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC001236791481 778937652 /nfs/dbraw/zinc/93/76/52/778937652.db2.gz HRUWSEUAKIDKIQ-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@]23CCOC3)c([O-])c1 ZINC001236791481 778937658 /nfs/dbraw/zinc/93/76/58/778937658.db2.gz HRUWSEUAKIDKIQ-INIZCTEOSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](CC(=O)OC)C2)c([O-])c1 ZINC001236791739 778937907 /nfs/dbraw/zinc/93/79/07/778937907.db2.gz JIKDNBDCBFIKRC-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](CC(=O)OC)C2)c([O-])c1 ZINC001236791739 778937910 /nfs/dbraw/zinc/93/79/10/778937910.db2.gz JIKDNBDCBFIKRC-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(CN2CCOC[C@@H]2C2CC2)c(O)c1 ZINC001236793451 778939639 /nfs/dbraw/zinc/93/96/39/778939639.db2.gz WRXFLSVEHCMXQR-OAHLLOKOSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(CN2CCO[C@H](C(C)C)C2)c(O)c1 ZINC001236792268 778939908 /nfs/dbraw/zinc/93/99/08/778939908.db2.gz NHJSSDIZALCUAT-INIZCTEOSA-N 0 3 263.381 2.811 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CCC2(CC1)OCCO2 ZINC001236829578 778956268 /nfs/dbraw/zinc/95/62/68/778956268.db2.gz IWKBEBZUXPXSKK-UHFFFAOYSA-N 0 3 299.370 2.884 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001236832635 778957813 /nfs/dbraw/zinc/95/78/13/778957813.db2.gz JNCQYFDIZJUEHK-WMLDXEAASA-N 0 3 269.344 2.766 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001236832635 778957818 /nfs/dbraw/zinc/95/78/18/778957818.db2.gz JNCQYFDIZJUEHK-WMLDXEAASA-N 0 3 269.344 2.766 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c([O-])c1 ZINC001237049075 778999144 /nfs/dbraw/zinc/99/91/44/778999144.db2.gz CXZUMPUJRJZMNQ-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@]3(C2)CCCCO3)c([O-])c1 ZINC001237049075 778999148 /nfs/dbraw/zinc/99/91/48/778999148.db2.gz CXZUMPUJRJZMNQ-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001237049473 778999689 /nfs/dbraw/zinc/99/96/89/778999689.db2.gz GLOSNRDHGIEQOH-CXAGYDPISA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c([O-])c1 ZINC001237049473 778999695 /nfs/dbraw/zinc/99/96/95/778999695.db2.gz GLOSNRDHGIEQOH-CXAGYDPISA-N 0 3 291.391 2.792 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H]3OCC[C@H]32)c([O-])c1 ZINC001237051432 778999830 /nfs/dbraw/zinc/99/98/30/778999830.db2.gz KQVXYHPSXCPDLL-GDBMZVCRSA-N 0 3 261.365 2.879 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H]3OCC[C@H]32)c([O-])c1 ZINC001237051432 778999834 /nfs/dbraw/zinc/99/98/34/778999834.db2.gz KQVXYHPSXCPDLL-GDBMZVCRSA-N 0 3 261.365 2.879 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001237050745 779000747 /nfs/dbraw/zinc/00/07/47/779000747.db2.gz WRCRGABYOFJFJN-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC(C)(C)C[C@]2(C)CO)c([O-])c1 ZINC001237050745 779000752 /nfs/dbraw/zinc/00/07/52/779000752.db2.gz WRCRGABYOFJFJN-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN C[C@@]1(CO)CCN(Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237135666 779023179 /nfs/dbraw/zinc/02/31/79/779023179.db2.gz KLRNIOQCUGQBIB-CYBMUJFWSA-N 0 3 289.297 2.615 20 10 CFCDHN C[C@@]1(CO)CC[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237135666 779023184 /nfs/dbraw/zinc/02/31/84/779023184.db2.gz KLRNIOQCUGQBIB-CYBMUJFWSA-N 0 3 289.297 2.615 20 10 CFCDHN C[C@@]1(CO)CC[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237135666 779023193 /nfs/dbraw/zinc/02/31/93/779023193.db2.gz KLRNIOQCUGQBIB-CYBMUJFWSA-N 0 3 289.297 2.615 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@@H+]1CCC2(COC2)C1 ZINC001237135906 779023460 /nfs/dbraw/zinc/02/34/60/779023460.db2.gz NORIJUVPGIHOPZ-UHFFFAOYSA-N 0 3 287.281 2.633 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@H+]1CCC2(COC2)C1 ZINC001237135906 779023468 /nfs/dbraw/zinc/02/34/68/779023468.db2.gz NORIJUVPGIHOPZ-UHFFFAOYSA-N 0 3 287.281 2.633 20 10 CFCDHN Oc1ccc(C(F)(F)F)cc1CN1CCC2(COC2)C1 ZINC001237135906 779023477 /nfs/dbraw/zinc/02/34/77/779023477.db2.gz NORIJUVPGIHOPZ-UHFFFAOYSA-N 0 3 287.281 2.633 20 10 CFCDHN C[C@@H]1C[C@H](O)CCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237141341 779024672 /nfs/dbraw/zinc/02/46/72/779024672.db2.gz VZGVYCUYPKTLBP-BXKDBHETSA-N 0 3 289.297 2.756 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2CCCO[C@H]2C1 ZINC001237484362 779117590 /nfs/dbraw/zinc/11/75/90/779117590.db2.gz CWTLAHFADOWTMK-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2CCCO[C@H]2C1 ZINC001237484362 779117595 /nfs/dbraw/zinc/11/75/95/779117595.db2.gz CWTLAHFADOWTMK-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOC(=O)C[C@H]1CCC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237484556 779118151 /nfs/dbraw/zinc/11/81/51/779118151.db2.gz FNHHKXZBESUDNK-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN CCOC(=O)C[C@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237484556 779118153 /nfs/dbraw/zinc/11/81/53/779118153.db2.gz FNHHKXZBESUDNK-CQSZACIVSA-N 0 3 291.391 2.866 20 10 CFCDHN CCc1n[nH]cc1CN(CC)Cc1ccccc1O ZINC001237660273 779158917 /nfs/dbraw/zinc/15/89/17/779158917.db2.gz YGJSRZLTNKLKIC-UHFFFAOYSA-N 0 3 259.353 2.700 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](O)[C@@H](C)C2)c1[O-] ZINC001237681011 779160054 /nfs/dbraw/zinc/16/00/54/779160054.db2.gz KBCBRZIGVUDLGJ-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](O)[C@@H](C)C2)c1[O-] ZINC001237681011 779160056 /nfs/dbraw/zinc/16/00/56/779160056.db2.gz KBCBRZIGVUDLGJ-SMDDNHRTSA-N 0 3 283.799 2.947 20 10 CFCDHN CN1CCC([N@H+](C)Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237947986 779215254 /nfs/dbraw/zinc/21/52/54/779215254.db2.gz WGQUTHIBWIGMKT-UHFFFAOYSA-N 0 3 286.778 2.711 20 10 CFCDHN CN1CCC([N@@H+](C)Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237947986 779215257 /nfs/dbraw/zinc/21/52/57/779215257.db2.gz WGQUTHIBWIGMKT-UHFFFAOYSA-N 0 3 286.778 2.711 20 10 CFCDHN Cc1cc(F)cc(C[N@H+](C)CC2CCOCC2)c1[O-] ZINC001238056390 779241280 /nfs/dbraw/zinc/24/12/80/779241280.db2.gz HUBIKPOEFZPTHK-UHFFFAOYSA-N 0 3 267.344 2.698 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+](C)CC2CCOCC2)c1[O-] ZINC001238056390 779241283 /nfs/dbraw/zinc/24/12/83/779241283.db2.gz HUBIKPOEFZPTHK-UHFFFAOYSA-N 0 3 267.344 2.698 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c1[O-] ZINC001238068253 779243944 /nfs/dbraw/zinc/24/39/44/779243944.db2.gz XPSHRWVOQSISDF-BXUZGUMPSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c1[O-] ZINC001238068253 779243947 /nfs/dbraw/zinc/24/39/47/779243947.db2.gz XPSHRWVOQSISDF-BXUZGUMPSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c1[O-] ZINC001238068260 779244070 /nfs/dbraw/zinc/24/40/70/779244070.db2.gz XPSHRWVOQSISDF-RISCZKNCSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@@H]3C(=O)CCC[C@@H]3C2)c1[O-] ZINC001238068260 779244073 /nfs/dbraw/zinc/24/40/73/779244073.db2.gz XPSHRWVOQSISDF-RISCZKNCSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c1[O-] ZINC001238068256 779244660 /nfs/dbraw/zinc/24/46/60/779244660.db2.gz XPSHRWVOQSISDF-FZMZJTMJSA-N 0 3 277.339 2.641 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c1[O-] ZINC001238068256 779244662 /nfs/dbraw/zinc/24/46/62/779244662.db2.gz XPSHRWVOQSISDF-FZMZJTMJSA-N 0 3 277.339 2.641 20 10 CFCDHN CCN(Cc1cc(Cl)c(C)cc1[O-])[C@H]1CC[NH2+]C1 ZINC001235969348 779417898 /nfs/dbraw/zinc/41/78/98/779417898.db2.gz CASYLROOOZVEDA-LBPRGKRZSA-N 0 3 268.788 2.538 20 10 CFCDHN Oc1cccc(OC(F)(F)F)c1CN1C[C@@H]2C[C@@H]2C1 ZINC001237117383 779663438 /nfs/dbraw/zinc/66/34/38/779663438.db2.gz PCFWZBSDTLWAFP-DTORHVGOSA-N 0 3 273.254 2.743 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C2CCN(C)CC2)c1[O-] ZINC001237681831 779706277 /nfs/dbraw/zinc/70/62/77/779706277.db2.gz TYDVWJNDCYQZCK-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C2CCN(C)CC2)c1[O-] ZINC001237681831 779706281 /nfs/dbraw/zinc/70/62/81/779706281.db2.gz TYDVWJNDCYQZCK-UHFFFAOYSA-N 0 3 282.815 2.880 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC001238071071 779739558 /nfs/dbraw/zinc/73/95/58/779739558.db2.gz RKNINMANZFYJHA-MRXNPFEDSA-N 0 3 279.355 2.842 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC001238071071 779739564 /nfs/dbraw/zinc/73/95/64/779739564.db2.gz RKNINMANZFYJHA-MRXNPFEDSA-N 0 3 279.355 2.842 20 10 CFCDHN CC(C)(C)OC(=O)O[C@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC001203547792 779980019 /nfs/dbraw/zinc/98/00/19/779980019.db2.gz YSDBWOCOOCPKBA-ZDUSSCGKSA-N 0 3 293.363 2.918 20 10 CFCDHN CC(C)(C)OC(=O)O[C@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC001203547792 779980023 /nfs/dbraw/zinc/98/00/23/779980023.db2.gz YSDBWOCOOCPKBA-ZDUSSCGKSA-N 0 3 293.363 2.918 20 10 CFCDHN COC1CCC([NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000703818404 781064894 /nfs/dbraw/zinc/06/48/94/781064894.db2.gz JVKFTUIIIZCYAV-UHFFFAOYSA-N 0 3 253.317 2.579 20 10 CFCDHN CC(C)O[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000706554769 781187370 /nfs/dbraw/zinc/18/73/70/781187370.db2.gz HAJMUOPJPJSWOF-CYBMUJFWSA-N 0 3 253.317 2.531 20 10 CFCDHN CC(C)O[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000706554769 781187373 /nfs/dbraw/zinc/18/73/73/781187373.db2.gz HAJMUOPJPJSWOF-CYBMUJFWSA-N 0 3 253.317 2.531 20 10 CFCDHN CN(C)[C@H]1CCC[C@H]([NH2+]Cc2cc(F)cc(F)c2[O-])C1 ZINC000708421154 781275152 /nfs/dbraw/zinc/27/51/52/781275152.db2.gz PXBXWARZJADONC-STQMWFEESA-N 0 3 284.350 2.633 20 10 CFCDHN Nc1ccc(CCNCc2csc(C3CC3)n2)cc1 ZINC000708892526 781284799 /nfs/dbraw/zinc/28/47/99/781284799.db2.gz JTWLQDOIBZLCQQ-UHFFFAOYSA-N 0 3 273.405 2.935 20 10 CFCDHN Cc1cccc(CN2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000709000554 781287040 /nfs/dbraw/zinc/28/70/40/781287040.db2.gz OFMCHHNPSDTUAB-CQSZACIVSA-N 0 3 263.381 2.948 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1COC3(CCC3)C1)CC2 ZINC000711104171 781358185 /nfs/dbraw/zinc/35/81/85/781358185.db2.gz FOZUNGCKOCCSJM-OLZOCXBDSA-N 0 3 259.349 2.681 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC(C)(C)OC)c1[O-] ZINC000711910881 781487880 /nfs/dbraw/zinc/48/78/80/781487880.db2.gz IYBJXOCPEXIOBM-UHFFFAOYSA-N 0 3 287.787 2.959 20 10 CFCDHN Cc1ccc([C@@H](O)C[N@@H+](C)Cc2ccccc2[O-])cc1 ZINC000072629605 346933334 /nfs/dbraw/zinc/93/33/34/346933334.db2.gz JTHNPFCSWCMSJI-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc([C@@H](O)C[N@H+](C)Cc2ccccc2[O-])cc1 ZINC000072629605 346933335 /nfs/dbraw/zinc/93/33/35/346933335.db2.gz JTHNPFCSWCMSJI-KRWDZBQOSA-N 0 3 271.360 2.866 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)C(C)(C)O)c1ccccc1[O-] ZINC000295063150 199325543 /nfs/dbraw/zinc/32/55/43/199325543.db2.gz RKAJNZKSQVTYRA-OCCSQVGLSA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H](CO)c2ccccc2)c1 ZINC000295137144 199365077 /nfs/dbraw/zinc/36/50/77/199365077.db2.gz YXPHQISNLFZRRF-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H](CO)c2ccccc2)c1 ZINC000295137144 199365079 /nfs/dbraw/zinc/36/50/79/199365079.db2.gz YXPHQISNLFZRRF-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1ccc(O)c(CN(C)[C@@H](CO)c2ccccc2)c1 ZINC000295137144 199365080 /nfs/dbraw/zinc/36/50/80/199365080.db2.gz YXPHQISNLFZRRF-INIZCTEOSA-N 0 3 271.360 2.866 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H](CO)C(C)(C)C)cc1C ZINC000093821935 347685343 /nfs/dbraw/zinc/68/53/43/347685343.db2.gz WMFPBXGHHCBMLR-OAHLLOKOSA-N 0 3 265.397 2.848 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H](CO)C(C)(C)C)cc1C ZINC000093821935 347685345 /nfs/dbraw/zinc/68/53/45/347685345.db2.gz WMFPBXGHHCBMLR-OAHLLOKOSA-N 0 3 265.397 2.848 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](C)CCO)c1ccccc1[O-] ZINC000295178860 199390527 /nfs/dbraw/zinc/39/05/27/199390527.db2.gz VHZMZMCGIGEBSM-OCCSQVGLSA-N 0 3 251.370 2.842 20 10 CFCDHN C[C@H](CCO)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000297378500 200168187 /nfs/dbraw/zinc/16/81/87/200168187.db2.gz QVJJJNFCXUTIBC-QWRGUYRKSA-N 0 3 255.333 2.591 20 10 CFCDHN C[C@]1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCCC[C@@H]1O ZINC000297640479 200249177 /nfs/dbraw/zinc/24/91/77/200249177.db2.gz JSYTXFIDOGDWNE-JLJPHGGASA-N 0 3 275.392 2.910 20 10 CFCDHN C[C@H](NCC[S@@](=O)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000127303842 299301019 /nfs/dbraw/zinc/30/10/19/299301019.db2.gz HHRMCFBNKHZVPJ-RBZFPXEDSA-N 0 3 296.480 2.950 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H](CO)c1ccccc1)CC2 ZINC000297938620 200306810 /nfs/dbraw/zinc/30/68/10/200306810.db2.gz YAPIVFRMFGDQSH-JKSUJKDBSA-N 0 3 283.371 2.745 20 10 CFCDHN C[C@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccsc1 ZINC000297942115 200307928 /nfs/dbraw/zinc/30/79/28/200307928.db2.gz YFDDFEAIDVGNLO-BBRMVZONSA-N 0 3 289.400 2.938 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000263654525 383685693 /nfs/dbraw/zinc/68/56/93/383685693.db2.gz FGOUEDLFOCBZDK-UHFFFAOYSA-N 0 3 283.375 2.677 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCCCO2)c1 ZINC000042812479 372955742 /nfs/dbraw/zinc/95/57/42/372955742.db2.gz KZXZODTWLCKMKH-AAEUAGOBSA-N 0 3 265.353 2.621 20 10 CFCDHN COC(=O)CCCCC[NH2+]Cc1cc(C)ccc1[O-] ZINC000083482108 374748890 /nfs/dbraw/zinc/74/88/90/374748890.db2.gz UGEOFSZQIFKRFM-UHFFFAOYSA-N 0 3 265.353 2.524 20 10 CFCDHN CCC[N@H+](Cc1ccc(CO)o1)Cc1ccccc1[O-] ZINC000092705010 375139207 /nfs/dbraw/zinc/13/92/07/375139207.db2.gz IMXOQWVZKHBXGO-UHFFFAOYSA-N 0 3 275.348 2.890 20 10 CFCDHN CCC[N@@H+](Cc1ccc(CO)o1)Cc1ccccc1[O-] ZINC000092705010 375139214 /nfs/dbraw/zinc/13/92/14/375139214.db2.gz IMXOQWVZKHBXGO-UHFFFAOYSA-N 0 3 275.348 2.890 20 10 CFCDHN COc1cccc(C[N@H+](C)CCc2ncc(C)s2)c1[O-] ZINC000093807307 375313125 /nfs/dbraw/zinc/31/31/25/375313125.db2.gz VASNNYMWFAQELE-UHFFFAOYSA-N 0 3 292.404 2.840 20 10 CFCDHN COc1cccc(C[N@@H+](C)CCc2ncc(C)s2)c1[O-] ZINC000093807307 375313130 /nfs/dbraw/zinc/31/31/30/375313130.db2.gz VASNNYMWFAQELE-UHFFFAOYSA-N 0 3 292.404 2.840 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@@H]2CCCc3c2cnn3C)cc1 ZINC000093863641 375323859 /nfs/dbraw/zinc/32/38/59/375323859.db2.gz NDBXCBRXZBIAIT-QGZVFWFLSA-N 0 3 298.434 2.996 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000093597490 375272115 /nfs/dbraw/zinc/27/21/15/375272115.db2.gz BZDSWGFJWBMZTD-ZDUSSCGKSA-N 0 3 294.826 2.963 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCc2c1cccc2O ZINC000105486782 375789819 /nfs/dbraw/zinc/78/98/19/375789819.db2.gz YVJVQGREJGSYQK-CQSZACIVSA-N 0 3 255.317 2.875 20 10 CFCDHN COCC1CC[NH+](Cc2cc(C)c(C)cc2[O-])CC1 ZINC000112332051 375905572 /nfs/dbraw/zinc/90/55/72/375905572.db2.gz BVLGEUUHWXTVEN-UHFFFAOYSA-N 0 3 263.381 2.867 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+]Cc1cc(C)ccc1[O-] ZINC000113333617 376011427 /nfs/dbraw/zinc/01/14/27/376011427.db2.gz CUQLHDPECBAGLB-ZDUSSCGKSA-N 0 3 250.386 2.521 20 10 CFCDHN CC[C@H]([NH2+]CCn1cc(C)cn1)c1ccccc1[O-] ZINC000121098126 376761034 /nfs/dbraw/zinc/76/10/34/376761034.db2.gz YHBAUMXDRNKJTB-AWEZNQCLSA-N 0 3 259.353 2.638 20 10 CFCDHN Cc1cnn(CCN[C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000123948996 376999110 /nfs/dbraw/zinc/99/91/10/376999110.db2.gz OCAVTJXWWLZFOZ-CQSZACIVSA-N 0 3 272.396 2.608 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)CCn2cccn2)c([O-])c1 ZINC000125305574 377140732 /nfs/dbraw/zinc/14/07/32/377140732.db2.gz PWXTYTLMMISBKG-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)CCn2cccn2)c([O-])c1 ZINC000125305574 377140742 /nfs/dbraw/zinc/14/07/42/377140742.db2.gz PWXTYTLMMISBKG-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN C[C@H](CO)N[C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000129302927 377409543 /nfs/dbraw/zinc/40/95/43/377409543.db2.gz LYSNFEQSXMFSIV-CHWSQXEVSA-N 0 3 280.387 2.847 20 10 CFCDHN CN(CCOCC1CC1)Cc1ccc(N(C)C)cc1 ZINC000130204659 377520685 /nfs/dbraw/zinc/52/06/85/377520685.db2.gz JJXMSMNVXQKDNS-UHFFFAOYSA-N 0 3 262.397 2.611 20 10 CFCDHN CCOc1cc(C[NH2+]Cc2ccccc2[O-])ccc1O ZINC000134416179 378011958 /nfs/dbraw/zinc/01/19/58/378011958.db2.gz DIUAXYSMDRYFFZ-UHFFFAOYSA-N 0 3 273.332 2.786 20 10 CFCDHN CC[C@@H](NCc1cnn(C)c1)c1ccc(N(C)C)cc1 ZINC000151151244 378301888 /nfs/dbraw/zinc/30/18/88/378301888.db2.gz MLMUHIYKXIBYEG-MRXNPFEDSA-N 0 3 272.396 2.727 20 10 CFCDHN CC[N@H+](CCC(=O)OC)Cc1c([O-])ccc2ccccc21 ZINC000151975393 378378288 /nfs/dbraw/zinc/37/82/88/378378288.db2.gz OGGXYIQAANWKTQ-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN CC[N@@H+](CCC(=O)OC)Cc1c([O-])ccc2ccccc21 ZINC000151975393 378378294 /nfs/dbraw/zinc/37/82/94/378378294.db2.gz OGGXYIQAANWKTQ-UHFFFAOYSA-N 0 3 287.359 2.930 20 10 CFCDHN C[C@@](O)(CNCc1ccc2c(c1)CCO2)c1cccs1 ZINC000153021071 378466585 /nfs/dbraw/zinc/46/65/85/378466585.db2.gz KNPVUFVYRJDIHA-MRXNPFEDSA-N 0 3 289.400 2.680 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CC(Cc3ccco3)C2)c1 ZINC000529650308 383741692 /nfs/dbraw/zinc/74/16/92/383741692.db2.gz YPJWDRFWXFCCKM-UHFFFAOYSA-N 0 3 257.333 2.968 20 10 CFCDHN Cc1ccc(O)c(CN2CC(Cc3ccco3)C2)c1 ZINC000529650308 383741687 /nfs/dbraw/zinc/74/16/87/383741687.db2.gz YPJWDRFWXFCCKM-UHFFFAOYSA-N 0 3 257.333 2.968 20 10 CFCDHN CCO[C@@]1(C)C[C@H]1[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000529654501 383743082 /nfs/dbraw/zinc/74/30/82/383743082.db2.gz VRFVBEWNCDCONB-OCCSQVGLSA-N 0 3 285.771 2.711 20 10 CFCDHN CCC[N@H+](Cc1cc(OC)c(OC)cc1[O-])C1CC1 ZINC000179442357 380543921 /nfs/dbraw/zinc/54/39/21/380543921.db2.gz MXDFTYJITALJRZ-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN CCC[N@@H+](Cc1cc(OC)c(OC)cc1[O-])C1CC1 ZINC000179442357 380543922 /nfs/dbraw/zinc/54/39/22/380543922.db2.gz MXDFTYJITALJRZ-UHFFFAOYSA-N 0 3 265.353 2.784 20 10 CFCDHN C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1[O-] ZINC000179553868 380556826 /nfs/dbraw/zinc/55/68/26/380556826.db2.gz KHZWVHQPVNSCTA-UHFFFAOYSA-N 0 3 271.316 2.753 20 10 CFCDHN C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1[O-] ZINC000179553868 380556834 /nfs/dbraw/zinc/55/68/34/380556834.db2.gz KHZWVHQPVNSCTA-UHFFFAOYSA-N 0 3 271.316 2.753 20 10 CFCDHN Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000179667863 380570201 /nfs/dbraw/zinc/57/02/01/380570201.db2.gz BLYNNRYOBZFGNT-OLZOCXBDSA-N 0 3 273.380 2.884 20 10 CFCDHN COC(=O)[C@@H](C)C[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179774147 380580645 /nfs/dbraw/zinc/58/06/45/380580645.db2.gz MAILDXNBXUUGID-JTQLQIEISA-N 0 3 285.771 2.595 20 10 CFCDHN COC(=O)[C@@H](C)C[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179774147 380580650 /nfs/dbraw/zinc/58/06/50/380580650.db2.gz MAILDXNBXUUGID-JTQLQIEISA-N 0 3 285.771 2.595 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1[O-] ZINC000179780004 380580961 /nfs/dbraw/zinc/58/09/61/380580961.db2.gz ZSOYFRCODAUJGV-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1[O-] ZINC000179780004 380580967 /nfs/dbraw/zinc/58/09/67/380580967.db2.gz ZSOYFRCODAUJGV-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN C[N@H+](CCC(=O)OC(C)(C)C)Cc1cc(F)ccc1[O-] ZINC000180205248 380633614 /nfs/dbraw/zinc/63/36/14/380633614.db2.gz RXAVMWPUGIXVQT-UHFFFAOYSA-N 0 3 283.343 2.695 20 10 CFCDHN C[N@@H+](CCC(=O)OC(C)(C)C)Cc1cc(F)ccc1[O-] ZINC000180205248 380633616 /nfs/dbraw/zinc/63/36/16/380633616.db2.gz RXAVMWPUGIXVQT-UHFFFAOYSA-N 0 3 283.343 2.695 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000180182705 380629742 /nfs/dbraw/zinc/62/97/42/380629742.db2.gz GWYOQKVVHLUDJZ-MRXNPFEDSA-N 0 3 292.398 2.982 20 10 CFCDHN CC1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000180890466 380710566 /nfs/dbraw/zinc/71/05/66/380710566.db2.gz JCULEOAVADSCJQ-LBPRGKRZSA-N 0 3 253.317 2.579 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](OCC(C)C)C2)c1[O-] ZINC000180722932 380693494 /nfs/dbraw/zinc/69/34/94/380693494.db2.gz RJWXCLZZQFDWFB-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1[O-] ZINC000180722932 380693497 /nfs/dbraw/zinc/69/34/97/380693497.db2.gz RJWXCLZZQFDWFB-HNNXBMFYSA-N 0 3 263.381 2.948 20 10 CFCDHN Cc1cccc(C[N@H+](C)CCC2CCOCC2)c1[O-] ZINC000180379661 380649671 /nfs/dbraw/zinc/64/96/71/380649671.db2.gz SCSQZTSUFYAGOX-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN Cc1cccc(C[N@@H+](C)CCC2CCOCC2)c1[O-] ZINC000180379661 380649674 /nfs/dbraw/zinc/64/96/74/380649674.db2.gz SCSQZTSUFYAGOX-UHFFFAOYSA-N 0 3 263.381 2.949 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)c1[O-] ZINC000180370032 380649814 /nfs/dbraw/zinc/64/98/14/380649814.db2.gz PXPGDSNUFWJXMI-ZDUSSCGKSA-N 0 3 279.380 2.837 20 10 CFCDHN CN(C)[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccco1 ZINC000180395265 380651543 /nfs/dbraw/zinc/65/15/43/380651543.db2.gz GHSQGDZVDJVYRF-CYBMUJFWSA-N 0 3 278.327 2.517 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1ccccc1[O-] ZINC000368103618 380927697 /nfs/dbraw/zinc/92/76/97/380927697.db2.gz XLQWJUNDWLBTJM-WCQYABFASA-N 0 3 271.364 2.714 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccccc1[O-] ZINC000368103618 380927700 /nfs/dbraw/zinc/92/77/00/380927700.db2.gz XLQWJUNDWLBTJM-WCQYABFASA-N 0 3 271.364 2.714 20 10 CFCDHN CCCCN(C)C[C@H](C)[NH2+]Cc1cccc(OC)c1[O-] ZINC000288404422 381012044 /nfs/dbraw/zinc/01/20/44/381012044.db2.gz AEECMHFJSNGYCL-ZDUSSCGKSA-N 0 3 280.412 2.611 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2COc3ccccc32)c1[O-] ZINC000288488307 381013222 /nfs/dbraw/zinc/01/32/22/381013222.db2.gz HAPLRMMFNJJMHU-CYBMUJFWSA-N 0 3 285.343 2.667 20 10 CFCDHN CCCCN(C)C[C@H](C)[NH2+]Cc1ccccc1[O-] ZINC000288516695 381013944 /nfs/dbraw/zinc/01/39/44/381013944.db2.gz JGEBLKIMTSZPNQ-ZDUSSCGKSA-N 0 3 250.386 2.602 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2COc3ccccc3[C@@H]2O)cc1C ZINC000288594497 381015339 /nfs/dbraw/zinc/01/53/39/381015339.db2.gz OXLJDPZRXDLMGX-YJBOKZPZSA-N 0 3 299.370 2.593 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2COc3ccccc3[C@H]2O)cc1C ZINC000288594489 381016417 /nfs/dbraw/zinc/01/64/17/381016417.db2.gz OXLJDPZRXDLMGX-MAUKXSAKSA-N 0 3 299.370 2.593 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H](C3CC3)C1)OCO2 ZINC000288677432 381017433 /nfs/dbraw/zinc/01/74/33/381017433.db2.gz SKLAVZUBIDBUFH-LBPRGKRZSA-N 0 3 275.348 2.743 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H](C3CC3)C1)OCO2 ZINC000288677432 381017440 /nfs/dbraw/zinc/01/74/40/381017440.db2.gz SKLAVZUBIDBUFH-LBPRGKRZSA-N 0 3 275.348 2.743 20 10 CFCDHN C[C@H]1Oc2ccccc2[C@H]1NCc1cc2c(cc1O)OCO2 ZINC000288623874 381018467 /nfs/dbraw/zinc/01/84/67/381018467.db2.gz RYJMJUPBSAVYCO-QGHHPUGFSA-N 0 3 299.326 2.733 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCc3n[nH]cc32)cc1F ZINC000368607224 381081347 /nfs/dbraw/zinc/08/13/47/381081347.db2.gz GYWDZWXTOARNHJ-CQSZACIVSA-N 0 3 288.370 2.782 20 10 CFCDHN COc1ccc([C@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)cc1 ZINC000295926077 381162287 /nfs/dbraw/zinc/16/22/87/381162287.db2.gz JZRHLVJJVUQPML-DOTOQJQBSA-N 0 3 299.370 2.711 20 10 CFCDHN CC[C@@H](C[NH2+][C@@H](C)c1ccccc1[O-])N1CCCC1 ZINC000183410374 381268690 /nfs/dbraw/zinc/26/86/90/381268690.db2.gz BAHJXRKDCQAERW-KBPBESRZSA-N 0 3 262.397 2.917 20 10 CFCDHN C[C@H]([NH2+]CCCN(C)CC(F)(F)F)c1ccccc1[O-] ZINC000183419731 381269920 /nfs/dbraw/zinc/26/99/20/381269920.db2.gz DFUSMNTWRMNKRE-NSHDSACASA-N 0 3 290.329 2.927 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2ccccc2[O-])cc1O ZINC000183480733 381277046 /nfs/dbraw/zinc/27/70/46/381277046.db2.gz LKWUAVWSHFOYGT-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN C[C@H]([NH2+]Cc1cccc(CO)c1)c1ccccc1[O-] ZINC000183497672 381279227 /nfs/dbraw/zinc/27/92/27/381279227.db2.gz FIMSVEVOAAVUPX-LBPRGKRZSA-N 0 3 257.333 2.735 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183492729 381279583 /nfs/dbraw/zinc/27/95/83/381279583.db2.gz FOWIYIPRJNHEEN-QWRGUYRKSA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1ccccc1[O-] ZINC000183511659 381281425 /nfs/dbraw/zinc/28/14/25/381281425.db2.gz JXIGKJSKZSIEAB-CYBMUJFWSA-N 0 3 290.407 2.691 20 10 CFCDHN CCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183506962 381281442 /nfs/dbraw/zinc/28/14/42/381281442.db2.gz VMCPSHDNMULWNX-UONOGXRCSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)[C@@H](O)C(F)F ZINC000296561773 381450958 /nfs/dbraw/zinc/45/09/58/381450958.db2.gz SHYGNLIAYOYYDG-DDTOSNHZSA-N 0 3 286.366 2.808 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c([O-])c1 ZINC000296557221 381446184 /nfs/dbraw/zinc/44/61/84/381446184.db2.gz RYVOSJIMUPAESC-FFHGMXDLSA-N 0 3 274.408 2.976 20 10 CFCDHN C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1[O-] ZINC000296625736 381477858 /nfs/dbraw/zinc/47/78/58/381477858.db2.gz XCDDNMPJFANVFK-HLVVYCRESA-N 0 3 278.371 2.807 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C)CCCO)c1 ZINC000296662257 381497547 /nfs/dbraw/zinc/49/75/47/381497547.db2.gz ZXOVREROLOYBET-OLZOCXBDSA-N 0 3 251.370 2.760 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000185170068 381551128 /nfs/dbraw/zinc/55/11/28/381551128.db2.gz BUNPPQHQJBLYKE-HUUCEWRRSA-N 0 3 279.380 2.574 20 10 CFCDHN CCOCCCC[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185071029 381527539 /nfs/dbraw/zinc/52/75/39/381527539.db2.gz REFPTIBOFCGYJI-GFCCVEGCSA-N 0 3 267.369 2.868 20 10 CFCDHN COCCC1(C)CN(Cc2ccc(N(C)C)cc2)C1 ZINC000297345687 381558620 /nfs/dbraw/zinc/55/86/20/381558620.db2.gz GAJWWCPEHYAFEA-UHFFFAOYSA-N 0 3 262.397 2.611 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CCO)C(C)(C)C)c1 ZINC000185196544 381561008 /nfs/dbraw/zinc/56/10/08/381561008.db2.gz VKCKBGFNWTZPGJ-ABAIWWIYSA-N 0 3 281.396 2.849 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccccc1O)CC2 ZINC000297516825 381565877 /nfs/dbraw/zinc/56/58/77/381565877.db2.gz CWRIYNXVYQYTKQ-CQSZACIVSA-N 0 3 269.344 2.917 20 10 CFCDHN CCOC(=O)C[C@](C)([NH2+]Cc1ccccc1[O-])C(C)C ZINC000185234651 381572361 /nfs/dbraw/zinc/57/23/61/381572361.db2.gz JQEXDUPNEHQSGZ-INIZCTEOSA-N 0 3 279.380 2.850 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185350285 381607126 /nfs/dbraw/zinc/60/71/26/381607126.db2.gz GEBUTTTUOMYOGH-VHSXEESVSA-N 0 3 277.343 2.985 20 10 CFCDHN CCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185418101 381626111 /nfs/dbraw/zinc/62/61/11/381626111.db2.gz WBVPNPLAJXVVKD-UONOGXRCSA-N 0 3 292.423 2.926 20 10 CFCDHN CCC(CC)[C@H](O)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000185424590 381628380 /nfs/dbraw/zinc/62/83/80/381628380.db2.gz KSVNCHFEKGEDLZ-BDJLRTHQSA-N 0 3 281.396 2.849 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC[S@](=O)C(C)(C)C)c1 ZINC000185475051 381644574 /nfs/dbraw/zinc/64/45/74/381644574.db2.gz JZKICPYQGQAUOA-YBTHPKLGSA-N 0 3 299.436 2.599 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)c2ccsc2)c1 ZINC000185513161 381655149 /nfs/dbraw/zinc/65/51/49/381655149.db2.gz QCDBCZYDQOARPR-MEBBXXQBSA-N 0 3 293.388 2.847 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCC(=O)OC(C)(C)C)c1 ZINC000185540309 381661832 /nfs/dbraw/zinc/66/18/32/381661832.db2.gz BYRGBFVKWGDJBU-LLVKDONJSA-N 0 3 295.379 2.783 20 10 CFCDHN CCC[C@H](CCO)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185605563 381678561 /nfs/dbraw/zinc/67/85/61/381678561.db2.gz IDIVBPBEDWJDHW-QWHCGFSZSA-N 0 3 281.396 2.850 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CC(=O)N(C(C)(C)C)C2)c([O-])c1 ZINC000186086305 381821509 /nfs/dbraw/zinc/82/15/09/381821509.db2.gz QOKMWOYDTCQNOU-OLZOCXBDSA-N 0 3 290.407 2.751 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)Cc2cc(C)n[nH]2)c1 ZINC000186130849 381829772 /nfs/dbraw/zinc/82/97/72/381829772.db2.gz RNCSSNCAFZBBHR-JQWIXIFHSA-N 0 3 289.379 2.714 20 10 CFCDHN CCOC(C)(C)C[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000186539503 381941015 /nfs/dbraw/zinc/94/10/15/381941015.db2.gz XFNNBHJJPWSIKK-UHFFFAOYSA-N 0 3 251.370 2.914 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@]2(CCOC2)C1 ZINC000375978043 382113136 /nfs/dbraw/zinc/11/31/36/382113136.db2.gz VZGWUMOTEOHNHN-GDBMZVCRSA-N 0 3 261.365 2.956 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000375978043 382113139 /nfs/dbraw/zinc/11/31/39/382113139.db2.gz VZGWUMOTEOHNHN-GDBMZVCRSA-N 0 3 261.365 2.956 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@]3(CCOC3)C2)c1 ZINC000376301251 382128911 /nfs/dbraw/zinc/12/89/11/382128911.db2.gz HCYVQBRNIBMWMW-GRDNDAEWSA-N 0 3 291.391 2.689 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC000375303100 382079020 /nfs/dbraw/zinc/07/90/20/382079020.db2.gz NAQKWKSSQPXGEU-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1[O-] ZINC000375303100 382079027 /nfs/dbraw/zinc/07/90/27/382079027.db2.gz NAQKWKSSQPXGEU-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCC[C@H]3COC[C@H]32)cc1C ZINC000375706527 382098958 /nfs/dbraw/zinc/09/89/58/382098958.db2.gz UYZIKNUQGTURSF-DZGCQCFKSA-N 0 3 261.365 2.620 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCC[C@H]3COC[C@H]32)cc1C ZINC000375706527 382098963 /nfs/dbraw/zinc/09/89/63/382098963.db2.gz UYZIKNUQGTURSF-DZGCQCFKSA-N 0 3 261.365 2.620 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCCN2C)c([O-])c1 ZINC000293586074 382185966 /nfs/dbraw/zinc/18/59/66/382185966.db2.gz FFRAAUOYGZIPFF-KBPBESRZSA-N 0 3 262.397 2.754 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1cccc(OCC)c1[O-])OC ZINC000293615729 382197309 /nfs/dbraw/zinc/19/73/09/382197309.db2.gz HZIBADZZZNZWJD-ZDUSSCGKSA-N 0 3 267.369 2.696 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCCC(=O)N(C)C)c([O-])c1 ZINC000293716117 382247521 /nfs/dbraw/zinc/24/75/21/382247521.db2.gz MFLPBILEBAARNZ-ZDUSSCGKSA-N 0 3 278.396 2.528 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC(=O)NC(C)C)c([O-])c1 ZINC000293744389 382261211 /nfs/dbraw/zinc/26/12/11/382261211.db2.gz NSFQWWBDUUFGJU-ZDUSSCGKSA-N 0 3 278.396 2.574 20 10 CFCDHN CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000293774268 382274556 /nfs/dbraw/zinc/27/45/56/382274556.db2.gz SLKXJVCUQVTDPO-UONOGXRCSA-N 0 3 292.423 2.904 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000364637107 382345116 /nfs/dbraw/zinc/34/51/16/382345116.db2.gz NYQMFFMYEVKOPR-IHRRRGAJSA-N 0 3 291.391 2.820 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000364637107 382345123 /nfs/dbraw/zinc/34/51/23/382345123.db2.gz NYQMFFMYEVKOPR-IHRRRGAJSA-N 0 3 291.391 2.820 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@]2(CO)CC(C)C)c1[O-] ZINC000188040527 382332145 /nfs/dbraw/zinc/33/21/45/382332145.db2.gz KZNBXHLXUUMPGQ-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@]2(CO)CC(C)C)c1[O-] ZINC000188040527 382332152 /nfs/dbraw/zinc/33/21/52/382332152.db2.gz KZNBXHLXUUMPGQ-QGZVFWFLSA-N 0 3 293.407 2.774 20 10 CFCDHN CN1CC[C@@H]2CC[N@H+](Cc3cccc(Cl)c3[O-])C[C@@H]21 ZINC000378472366 382467709 /nfs/dbraw/zinc/46/77/09/382467709.db2.gz IMPCXJHQZOXQMZ-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@@H]2CC[N@@H+](Cc3cccc(Cl)c3[O-])C[C@@H]21 ZINC000378472366 382467713 /nfs/dbraw/zinc/46/77/13/382467713.db2.gz IMPCXJHQZOXQMZ-RISCZKNCSA-N 0 3 280.799 2.572 20 10 CFCDHN CN(C)c1ccc(C2=CCN(CCC(C)(C)O)C2)cc1 ZINC000378542440 382481878 /nfs/dbraw/zinc/48/18/78/382481878.db2.gz OHLCMCDIYUSUFG-UHFFFAOYSA-N 0 3 274.408 2.613 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000366545258 382526516 /nfs/dbraw/zinc/52/65/16/382526516.db2.gz PGZZYLJWCNGBMM-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000366545258 382526519 /nfs/dbraw/zinc/52/65/19/382526519.db2.gz PGZZYLJWCNGBMM-MRXNPFEDSA-N 0 3 275.392 2.949 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000378637759 382497424 /nfs/dbraw/zinc/49/74/24/382497424.db2.gz OKCSHOCWIQGADE-CQSZACIVSA-N 0 3 286.350 2.991 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000378637759 382497430 /nfs/dbraw/zinc/49/74/30/382497430.db2.gz OKCSHOCWIQGADE-CQSZACIVSA-N 0 3 286.350 2.991 20 10 CFCDHN CCn1cc([C@H](C)[NH2+]Cc2cc(F)ccc2[O-])cn1 ZINC000294792470 382527952 /nfs/dbraw/zinc/52/79/52/382527952.db2.gz HRLJMBXLYALPRL-JTQLQIEISA-N 0 3 263.316 2.599 20 10 CFCDHN CCOc1ccc(O)c(CN[C@@H](C)c2cnn(CC)c2)c1 ZINC000294929711 382544792 /nfs/dbraw/zinc/54/47/92/382544792.db2.gz UKYTXRATVKYTRU-LBPRGKRZSA-N 0 3 289.379 2.858 20 10 CFCDHN Cc1ncsc1CC[NH2+]Cc1cc(F)ccc1[O-] ZINC000294958408 382551305 /nfs/dbraw/zinc/55/13/05/382551305.db2.gz IDMUCARZOSXPPS-UHFFFAOYSA-N 0 3 266.341 2.629 20 10 CFCDHN COC[C@]1(C)CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000295024087 382564022 /nfs/dbraw/zinc/56/40/22/382564022.db2.gz CMHWQQKIXGRHPE-MRXNPFEDSA-N 0 3 263.381 2.867 20 10 CFCDHN COC[C@]1(C)CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000295024087 382564027 /nfs/dbraw/zinc/56/40/27/382564027.db2.gz CMHWQQKIXGRHPE-MRXNPFEDSA-N 0 3 263.381 2.867 20 10 CFCDHN CCN(C)C(=O)[C@@H](NCc1ccc(OC)c(C)c1)C(C)C ZINC000295057518 382569996 /nfs/dbraw/zinc/56/99/96/382569996.db2.gz OAPALUBOZAQDIV-INIZCTEOSA-N 0 3 292.423 2.596 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cc(OC)c(OC)cc1[O-])OC ZINC000294818290 382531440 /nfs/dbraw/zinc/53/14/40/382531440.db2.gz OPYIFWHFJMWJSU-ZBEGNZNMSA-N 0 3 297.395 2.560 20 10 CFCDHN CCN(Cc1cc(C)c(C)cc1O)C[C@@H](O)C(F)(F)F ZINC000189872399 382643788 /nfs/dbraw/zinc/64/37/88/382643788.db2.gz YESSYSLBESDJTK-CYBMUJFWSA-N 0 3 291.313 2.754 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 ZINC000248529062 383253459 /nfs/dbraw/zinc/25/34/59/383253459.db2.gz WNDMTYPBJJYHHM-XOPPTJLZSA-N 0 3 291.391 2.865 20 10 CFCDHN Cc1cc([O-])c(CN[C@H]2CC[NH2+]C23CCC3)c(Cl)c1 ZINC000530245505 383769169 /nfs/dbraw/zinc/76/91/69/383769169.db2.gz YNEQVZVQVWZLKU-AWEZNQCLSA-N 0 3 280.799 2.728 20 10 CFCDHN CCN(CC)c1ccc(CN(C)CCOCCOC)cc1 ZINC000267450602 384393899 /nfs/dbraw/zinc/39/38/99/384393899.db2.gz MHQCEZUUWAOYKL-UHFFFAOYSA-N 0 3 294.439 2.628 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])[C@@H]1CCCO1 ZINC000278605868 384590216 /nfs/dbraw/zinc/59/02/16/384590216.db2.gz BHVDPRZDFAOZNG-INWMFGNUSA-N 0 3 279.380 2.545 20 10 CFCDHN COc1cccc(C[NH2+][C@H]2CCOC3(CCC3)C2)c1[O-] ZINC000268970329 384704568 /nfs/dbraw/zinc/70/45/68/384704568.db2.gz MTSXPKYDRDGDKF-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@H](CC)C2)c1[O-] ZINC000281164728 385185224 /nfs/dbraw/zinc/18/52/24/385185224.db2.gz GJSDFSQDIPHJNY-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@H](CC)C2)c1[O-] ZINC000281164728 385185227 /nfs/dbraw/zinc/18/52/27/385185227.db2.gz GJSDFSQDIPHJNY-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCC[N@H+](CCO)Cc1cc(C)c(C)cc1[O-] ZINC000271017692 385303495 /nfs/dbraw/zinc/30/34/95/385303495.db2.gz RYFONVIZZIZGOI-UHFFFAOYSA-N 0 3 251.370 2.603 20 10 CFCDHN CCCC[N@@H+](CCO)Cc1cc(C)c(C)cc1[O-] ZINC000271017692 385303499 /nfs/dbraw/zinc/30/34/99/385303499.db2.gz RYFONVIZZIZGOI-UHFFFAOYSA-N 0 3 251.370 2.603 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2CCCC23CCOCC3)c1 ZINC000282274098 385267155 /nfs/dbraw/zinc/26/71/55/385267155.db2.gz RLQQSRDGZPSVRA-INIZCTEOSA-N 0 3 291.391 2.840 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CSC ZINC000282341700 385286954 /nfs/dbraw/zinc/28/69/54/385286954.db2.gz BYGFRCSACZFSKF-AWEZNQCLSA-N 0 3 283.437 2.718 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CSC ZINC000282341700 385286957 /nfs/dbraw/zinc/28/69/57/385286957.db2.gz BYGFRCSACZFSKF-AWEZNQCLSA-N 0 3 283.437 2.718 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@H](O)CC ZINC000282363450 385294260 /nfs/dbraw/zinc/29/42/60/385294260.db2.gz DMICEMDQTJTNAK-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@H](O)CC ZINC000282363450 385294266 /nfs/dbraw/zinc/29/42/66/385294266.db2.gz DMICEMDQTJTNAK-CQSZACIVSA-N 0 3 251.370 2.765 20 10 CFCDHN C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000271241821 385377785 /nfs/dbraw/zinc/37/77/85/385377785.db2.gz AKQVWJXEJFYVJF-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000271241821 385377788 /nfs/dbraw/zinc/37/77/88/385377788.db2.gz AKQVWJXEJFYVJF-UHFFFAOYSA-N 0 3 294.395 2.739 20 10 CFCDHN COc1cccc(C[NH2+]CC2([C@@H](C)CCO)CCC2)c1[O-] ZINC000271767579 385391111 /nfs/dbraw/zinc/39/11/11/385391111.db2.gz ASVSAFKZJBPILD-ZDUSSCGKSA-N 0 3 293.407 2.679 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@](C)(O)c2ccco2)c1[O-] ZINC000271871988 385395714 /nfs/dbraw/zinc/39/57/14/385395714.db2.gz XYVUKEGBIAUNRS-OAHLLOKOSA-N 0 3 295.766 2.944 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CSC2(C)C)c1 ZINC000282970455 385417899 /nfs/dbraw/zinc/41/78/99/385417899.db2.gz DCZSNCLVSLORBD-ZANVPECISA-N 0 3 267.394 2.945 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)[nH]n1 ZINC000283113307 385437554 /nfs/dbraw/zinc/43/75/54/385437554.db2.gz URCAUSLFQFRGIT-GFCCVEGCSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)[nH]n1 ZINC000283113307 385437559 /nfs/dbraw/zinc/43/75/59/385437559.db2.gz URCAUSLFQFRGIT-GFCCVEGCSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n[nH]1 ZINC000283113307 385437561 /nfs/dbraw/zinc/43/75/61/385437561.db2.gz URCAUSLFQFRGIT-GFCCVEGCSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1cc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n[nH]1 ZINC000283113307 385437565 /nfs/dbraw/zinc/43/75/65/385437565.db2.gz URCAUSLFQFRGIT-GFCCVEGCSA-N 0 3 289.354 2.942 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnc(OC(F)F)c2)c1 ZINC000284097803 385534605 /nfs/dbraw/zinc/53/46/05/385534605.db2.gz RWLCCBTVEKNDOI-UHFFFAOYSA-N 0 3 294.301 2.987 20 10 CFCDHN Cc1cc(CN[C@H](C)c2ccc(C)c(C)c2O)n(C)n1 ZINC000284137388 385539930 /nfs/dbraw/zinc/53/99/30/385539930.db2.gz DBDLYODKCZYZBM-CYBMUJFWSA-N 0 3 273.380 2.902 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000285358945 385554706 /nfs/dbraw/zinc/55/47/06/385554706.db2.gz YWCUFEMGKWTBMQ-CABCVRRESA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1[O-] ZINC000285358945 385554708 /nfs/dbraw/zinc/55/47/08/385554708.db2.gz YWCUFEMGKWTBMQ-CABCVRRESA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@H]2CCOC[C@@H]2C)c1[O-] ZINC000285577919 385556156 /nfs/dbraw/zinc/55/61/56/385556156.db2.gz TUVAFDMUVOMPMU-QWHCGFSZSA-N 0 3 279.380 2.553 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cn2ccnc2)c([O-])c1C ZINC000273375766 385678577 /nfs/dbraw/zinc/67/85/77/385678577.db2.gz HCNUGUDFFZPZDP-JSGCOSHPSA-N 0 3 273.380 2.945 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1ccccc1[O-] ZINC000273374803 385679138 /nfs/dbraw/zinc/67/91/38/385679138.db2.gz BHXASYUGJDSJGU-XJKSGUPXSA-N 0 3 277.364 2.604 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN2C)c([O-])c1C ZINC000273376976 385679276 /nfs/dbraw/zinc/67/92/76/385679276.db2.gz HJCSXUPHHCRGKK-ZIAGYGMSSA-N 0 3 262.397 2.754 20 10 CFCDHN CCN(CC)[C@H](C)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000273440187 385683382 /nfs/dbraw/zinc/68/33/82/385683382.db2.gz YGKJZEAXYJCSLD-OLZOCXBDSA-N 0 3 280.412 2.782 20 10 CFCDHN C[C@@H]([NH2+]CC1=CCN(C)CC1)c1cc(Cl)ccc1[O-] ZINC000273514749 385686104 /nfs/dbraw/zinc/68/61/04/385686104.db2.gz SHXIWEPFUUKDKI-LLVKDONJSA-N 0 3 280.799 2.958 20 10 CFCDHN Cc1ccc([C@H](C)N[C@H]2CCN(C(C)C)C2=O)c(O)c1C ZINC000273519164 385686177 /nfs/dbraw/zinc/68/61/77/385686177.db2.gz TVEKDIMYIOUGRD-ZFWWWQNUSA-N 0 3 290.407 2.669 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCO)c([O-])c1C ZINC000273579205 385689290 /nfs/dbraw/zinc/68/92/90/385689290.db2.gz MFTADGBKAJIRDQ-DGCLKSJQSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@]2(N(C)C)CCSC2)c1 ZINC000273585271 385689333 /nfs/dbraw/zinc/68/93/33/385689333.db2.gz NSLMSSMIUBFAOH-BBRMVZONSA-N 0 3 294.464 2.789 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@]2(N(C)C)CCSC2)c([O-])c1 ZINC000273570641 385689733 /nfs/dbraw/zinc/68/97/33/385689733.db2.gz KOXZBBBPXWUYEJ-CJNGLKHVSA-N 0 3 294.464 2.789 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273583660 385690089 /nfs/dbraw/zinc/69/00/89/385690089.db2.gz NFPQORPOWMJPKM-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1cc(F)ccc1[O-] ZINC000273596448 385691084 /nfs/dbraw/zinc/69/10/84/385691084.db2.gz QVEXHFBTISRPSY-ABAIWWIYSA-N 0 3 298.427 2.619 20 10 CFCDHN Cc1cccc(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000273147300 385671128 /nfs/dbraw/zinc/67/11/28/385671128.db2.gz GPBILEUSJBPPHY-CVEARBPZSA-N 0 3 261.365 2.748 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H](O)c1ccccc1 ZINC000288478213 197088911 /nfs/dbraw/zinc/08/89/11/197088911.db2.gz GGVTUFHZPFHZEQ-FZKQIMNGSA-N 0 3 283.371 2.833 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@@H](C3CC3)C1)OCO2 ZINC000288677418 285382073 /nfs/dbraw/zinc/38/20/73/285382073.db2.gz SKLAVZUBIDBUFH-GFCCVEGCSA-N 0 3 275.348 2.743 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@@H](C3CC3)C1)OCO2 ZINC000288677418 285382074 /nfs/dbraw/zinc/38/20/74/285382074.db2.gz SKLAVZUBIDBUFH-GFCCVEGCSA-N 0 3 275.348 2.743 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000180027815 285384699 /nfs/dbraw/zinc/38/46/99/285384699.db2.gz HPJDYQYLSKXRCR-INIZCTEOSA-N 0 3 292.398 2.982 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CSCCS1)CC2 ZINC000297151013 285397600 /nfs/dbraw/zinc/39/76/00/285397600.db2.gz AVLCQZCKUWZGBY-NWDGAFQWSA-N 0 3 281.446 2.818 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000289245649 285398487 /nfs/dbraw/zinc/39/84/87/285398487.db2.gz DXTAADAVKXCKOP-CYBMUJFWSA-N 0 3 289.297 2.672 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000289245649 285398489 /nfs/dbraw/zinc/39/84/89/285398489.db2.gz DXTAADAVKXCKOP-CYBMUJFWSA-N 0 3 289.297 2.672 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 ZINC000372397400 393448441 /nfs/dbraw/zinc/44/84/41/393448441.db2.gz DGHXRAJXZAKDFM-FVQBIDKESA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 ZINC000372397400 393448448 /nfs/dbraw/zinc/44/84/48/393448448.db2.gz DGHXRAJXZAKDFM-FVQBIDKESA-N 0 3 275.392 2.946 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000179941056 393471716 /nfs/dbraw/zinc/47/17/16/393471716.db2.gz GAOYCKUTYZHFCV-LLVKDONJSA-N 0 3 291.326 2.602 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)n1 ZINC000179941056 393471721 /nfs/dbraw/zinc/47/17/21/393471721.db2.gz GAOYCKUTYZHFCV-LLVKDONJSA-N 0 3 291.326 2.602 20 10 CFCDHN CC[C@@H](N[C@@H](C)C[S@](C)=O)c1ccc(N(C)C)cc1 ZINC000184297932 393526146 /nfs/dbraw/zinc/52/61/46/393526146.db2.gz XGCCFZBYUUZGNK-HGQUKEQDSA-N 0 3 282.453 2.560 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C(=O)N(C)CC)c1ccc(C)cc1[O-] ZINC000280014683 394069905 /nfs/dbraw/zinc/06/99/05/394069905.db2.gz GXBDPXCNPAWZHV-OCCSQVGLSA-N 0 3 278.396 2.608 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562593 394030507 /nfs/dbraw/zinc/03/05/07/394030507.db2.gz FAGRMVDNPDHUOR-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562593 394030509 /nfs/dbraw/zinc/03/05/09/394030509.db2.gz FAGRMVDNPDHUOR-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562593 394030514 /nfs/dbraw/zinc/03/05/14/394030514.db2.gz FAGRMVDNPDHUOR-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3c([O-])cccc3Cl)[C@H]2C1 ZINC000272562593 394030517 /nfs/dbraw/zinc/03/05/17/394030517.db2.gz FAGRMVDNPDHUOR-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)c1[O-] ZINC000527805841 394410390 /nfs/dbraw/zinc/41/03/90/394410390.db2.gz INEJZVZFFOQEAJ-HNNXBMFYSA-N 0 3 290.407 2.507 20 10 CFCDHN CC[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000006986408 170260544 /nfs/dbraw/zinc/26/05/44/170260544.db2.gz FKCTYNIBJMKNED-GFCCVEGCSA-N 0 3 263.337 2.885 20 10 CFCDHN CC[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1[O-])OCO2 ZINC000006986408 170260545 /nfs/dbraw/zinc/26/05/45/170260545.db2.gz FKCTYNIBJMKNED-GFCCVEGCSA-N 0 3 263.337 2.885 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccnc2)c1 ZINC000020140980 171028081 /nfs/dbraw/zinc/02/80/81/171028081.db2.gz SZBSKTOOSKTSTJ-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H](C)N2CCCCC2)c1[O-] ZINC000038028502 174017319 /nfs/dbraw/zinc/01/73/19/174017319.db2.gz LPHMIMGFINZULA-CQSZACIVSA-N 0 3 292.423 2.755 20 10 CFCDHN Cc1c([C@H](C)[NH2+][C@H](C)c2ccccc2[O-])cnn1C ZINC000037167844 260072588 /nfs/dbraw/zinc/07/25/88/260072588.db2.gz QACMEJCNNVVLTJ-MNOVXSKESA-N 0 3 259.353 2.846 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H](CO)C2)c1[O-] ZINC000363905093 262021563 /nfs/dbraw/zinc/02/15/63/262021563.db2.gz BPCBDJOFNUYQNC-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCC[C@@H](CO)C2)c1[O-] ZINC000363905093 262021564 /nfs/dbraw/zinc/02/15/64/262021564.db2.gz BPCBDJOFNUYQNC-LLVKDONJSA-N 0 3 299.798 2.649 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCOCC3(CCC3)C2)c1[O-] ZINC000363915900 262029655 /nfs/dbraw/zinc/02/96/55/262029655.db2.gz BNCGBQXVCQYWPU-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc(C[N@H+]2CCOCC3(CCC3)C2)c1[O-] ZINC000363915900 262029658 /nfs/dbraw/zinc/02/96/58/262029658.db2.gz BNCGBQXVCQYWPU-UHFFFAOYSA-N 0 3 261.365 2.703 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c([O-])c1 ZINC000292720283 263134368 /nfs/dbraw/zinc/13/43/68/263134368.db2.gz FEWAUZWMSVWZHG-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2C)c([O-])c1 ZINC000292720283 263134369 /nfs/dbraw/zinc/13/43/69/263134369.db2.gz FEWAUZWMSVWZHG-JSGCOSHPSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000367438176 267089398 /nfs/dbraw/zinc/08/93/98/267089398.db2.gz LEFWELAIWPFHCO-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000367438176 267089401 /nfs/dbraw/zinc/08/94/01/267089401.db2.gz LEFWELAIWPFHCO-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCOCC[C@H]2C)c1 ZINC000367700885 267110667 /nfs/dbraw/zinc/11/06/67/267110667.db2.gz DRUSUHRPFYPQFJ-NEPJUHHUSA-N 0 3 265.353 2.573 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCOCC[C@H]2C)c1 ZINC000367700885 267110669 /nfs/dbraw/zinc/11/06/69/267110669.db2.gz DRUSUHRPFYPQFJ-NEPJUHHUSA-N 0 3 265.353 2.573 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]1C(=O)NC1CC1 ZINC000368021525 267136841 /nfs/dbraw/zinc/13/68/41/267136841.db2.gz ZFAXRJIBHNAAJN-GJZGRUSLSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@H]1C(=O)NC1CC1 ZINC000368021525 267136845 /nfs/dbraw/zinc/13/68/45/267136845.db2.gz ZFAXRJIBHNAAJN-GJZGRUSLSA-N 0 3 288.391 2.586 20 10 CFCDHN C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134237 267147205 /nfs/dbraw/zinc/14/72/05/267147205.db2.gz LLPMLSGQUXHGMR-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2c([O-])cccc2Cl)C1 ZINC000368134237 267147208 /nfs/dbraw/zinc/14/72/08/267147208.db2.gz LLPMLSGQUXHGMR-WFASDCNBSA-N 0 3 294.826 2.962 20 10 CFCDHN COc1cccc(C[NH+]2CCC([C@H]3CCOC3)CC2)c1[O-] ZINC000368235840 267154568 /nfs/dbraw/zinc/15/45/68/267154568.db2.gz QWBFAKHWIPUWCT-HNNXBMFYSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C2 ZINC000368316268 267161623 /nfs/dbraw/zinc/16/16/23/267161623.db2.gz ORBUIJHMDOTLEC-DGCLKSJQSA-N 0 3 289.354 2.702 20 10 CFCDHN Cn1nccc1[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000368401954 267170157 /nfs/dbraw/zinc/17/01/57/267170157.db2.gz HRCULAAPJDQFRK-CYBMUJFWSA-N 0 3 271.364 2.505 20 10 CFCDHN Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000368401954 267170159 /nfs/dbraw/zinc/17/01/59/267170159.db2.gz HRCULAAPJDQFRK-CYBMUJFWSA-N 0 3 271.364 2.505 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC(=O)N2CCCC[C@H]12)c1ccccc1[O-] ZINC000374508097 267796826 /nfs/dbraw/zinc/79/68/26/267796826.db2.gz UFWHBEDPCIXKDO-RRFJBIMHSA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H](CO)[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184841634 287876830 /nfs/dbraw/zinc/87/68/30/287876830.db2.gz ZEQRCKWNBMNDLP-BXUZGUMPSA-N 0 3 263.381 2.693 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCNc2ccccn2)c1 ZINC000273588465 278836270 /nfs/dbraw/zinc/83/62/70/278836270.db2.gz ONEZVWKKLRTDQV-ZDUSSCGKSA-N 0 3 271.364 2.858 20 10 CFCDHN CC[C@H](c1ccccc1O)N1CCOC[C@H]1[C@@H]1CCCO1 ZINC000377703813 288167567 /nfs/dbraw/zinc/16/75/67/288167567.db2.gz RCDKORXJSAHZJG-VYDXJSESSA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297918747 280101835 /nfs/dbraw/zinc/10/18/35/280101835.db2.gz XAVPSVYWHWWDLI-TZMCWYRMSA-N 0 3 262.397 2.699 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1C[C@@H](C)O[C@]2(CCOC2)C1 ZINC000377700755 281025348 /nfs/dbraw/zinc/02/53/48/281025348.db2.gz RTZJNWJMXYTHNS-FRFSOERESA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1C[C@@H](C)O[C@]2(CCOC2)C1 ZINC000377700755 281025351 /nfs/dbraw/zinc/02/53/51/281025351.db2.gz RTZJNWJMXYTHNS-FRFSOERESA-N 0 3 291.391 2.723 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCCCC[C@H]1O)CC2 ZINC000297236274 304845789 /nfs/dbraw/zinc/84/57/89/304845789.db2.gz IEJYGKISPRQHNR-MGPQQGTHSA-N 0 3 261.365 2.663 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC000403521209 327906236 /nfs/dbraw/zinc/90/62/36/327906236.db2.gz LDGHMMRNARKHAA-FRRDWIJNSA-N 0 3 261.365 2.927 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+](Cc2cccc(C)c2[O-])C1 ZINC000375096393 329000359 /nfs/dbraw/zinc/00/03/59/329000359.db2.gz GRZBARHHYFTJPS-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COC[C@@H]1CCCC[N@H+](Cc2cccc(C)c2[O-])C1 ZINC000375096393 329000357 /nfs/dbraw/zinc/00/03/57/329000357.db2.gz GRZBARHHYFTJPS-CQSZACIVSA-N 0 3 263.381 2.949 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC000375257244 329002270 /nfs/dbraw/zinc/00/22/70/329002270.db2.gz XMPGUESRNJHAKX-CBOPYJBQSA-N 0 3 291.391 2.555 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC000375257244 329002272 /nfs/dbraw/zinc/00/22/72/329002272.db2.gz XMPGUESRNJHAKX-CBOPYJBQSA-N 0 3 291.391 2.555 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC[C@@H]2CCCOC2)c1 ZINC000527735100 330278531 /nfs/dbraw/zinc/27/85/31/330278531.db2.gz BMHSBMIDLMCRHZ-ZDUSSCGKSA-N 0 3 279.380 2.697 20 10 CFCDHN CCOCc1cc(CNCC23CC(C2)CO3)ccc1OC ZINC000527791403 330283602 /nfs/dbraw/zinc/28/36/02/330283602.db2.gz YQLAYFPPHNEFJJ-UHFFFAOYSA-N 0 3 291.391 2.500 20 10 CFCDHN COc1ccc(CC[NH2+][C@@H]2CCc3cccc([O-])c32)cn1 ZINC000527990479 330299160 /nfs/dbraw/zinc/29/91/60/330299160.db2.gz OHHUGRVRELSCTF-CQSZACIVSA-N 0 3 284.359 2.615 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCCCC[C@H]2O)c1 ZINC000252867686 334397878 /nfs/dbraw/zinc/39/78/78/334397878.db2.gz NAVFDENJVVBQIG-SGIREYDYSA-N 0 3 279.380 2.745 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)c([O-])c1 ZINC000529558894 333497695 /nfs/dbraw/zinc/49/76/95/333497695.db2.gz UPIZHNWLGGTDPW-LKTVYLICSA-N 0 3 261.365 2.925 20 10 CFCDHN [O-]c1c(F)cccc1CNc1ccc2c(c1)OCC[NH2+]C2 ZINC000530180642 333527339 /nfs/dbraw/zinc/52/73/39/333527339.db2.gz BCVLIXSPMMJQJH-UHFFFAOYSA-N 0 3 288.322 2.625 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000230661731 521295441 /nfs/dbraw/zinc/29/54/41/521295441.db2.gz YWKWTHJWNYTXFX-DOMZBBRYSA-N 0 3 251.370 2.902 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000157452494 521732886 /nfs/dbraw/zinc/73/28/86/521732886.db2.gz IHXCVEKMEQZTMV-ZDUSSCGKSA-N 0 3 278.396 2.595 20 10 CFCDHN CC(=O)Nc1ccc(CN[C@@H](C)c2cc(C)ccc2O)cn1 ZINC000278980012 519717748 /nfs/dbraw/zinc/71/77/48/519717748.db2.gz CXNXCNXUVREUGF-LBPRGKRZSA-N 0 3 299.374 2.905 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])cn1 ZINC000278980012 519717750 /nfs/dbraw/zinc/71/77/50/519717750.db2.gz CXNXCNXUVREUGF-LBPRGKRZSA-N 0 3 299.374 2.905 20 10 CFCDHN CCCC[N@H+](CCCO)Cc1cccc(C)c1[O-] ZINC000289545600 520506530 /nfs/dbraw/zinc/50/65/30/520506530.db2.gz XDDBLRUOCFBMMU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCC[N@@H+](CCCO)Cc1cccc(C)c1[O-] ZINC000289545600 520506534 /nfs/dbraw/zinc/50/65/34/520506534.db2.gz XDDBLRUOCFBMMU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCC[N@H+](CCO)Cc1ccc(OCCC)cc1[O-] ZINC000159100964 520522149 /nfs/dbraw/zinc/52/21/49/520522149.db2.gz IQGFBLAUDVUXCE-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCC[N@@H+](CCO)Cc1ccc(OCCC)cc1[O-] ZINC000159100964 520522156 /nfs/dbraw/zinc/52/21/56/520522156.db2.gz IQGFBLAUDVUXCE-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCCN1CCC([NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000226586698 520577357 /nfs/dbraw/zinc/57/73/57/520577357.db2.gz YZTNZTMPJZTTPI-UHFFFAOYSA-N 0 3 280.387 2.885 20 10 CFCDHN CCOc1ccc(O)c(CNCc2occc2C)c1 ZINC000291716964 521155022 /nfs/dbraw/zinc/15/50/22/521155022.db2.gz MBJPLJQIIJFBAV-UHFFFAOYSA-N 0 3 261.321 2.982 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(OC)c1[O-])C[C@@H](C)OC ZINC000291120781 521290435 /nfs/dbraw/zinc/29/04/35/521290435.db2.gz UVAMMIWREZIVOD-SNVBAGLBSA-N 0 3 287.787 2.911 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(OC)c1[O-])C[C@@H](C)OC ZINC000291120781 521290437 /nfs/dbraw/zinc/29/04/37/521290437.db2.gz UVAMMIWREZIVOD-SNVBAGLBSA-N 0 3 287.787 2.911 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cccc(OC)c1[O-] ZINC000278604754 521316559 /nfs/dbraw/zinc/31/65/59/521316559.db2.gz FWOUIDQGPYMYJE-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cccc(OC)c1[O-] ZINC000278604754 521316567 /nfs/dbraw/zinc/31/65/67/521316567.db2.gz FWOUIDQGPYMYJE-MRXNPFEDSA-N 0 3 279.380 2.528 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cccc(OCC)c1[O-] ZINC000278750481 521317132 /nfs/dbraw/zinc/31/71/32/521317132.db2.gz SBSHUWRQJXLAJC-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cccc(OCC)c1[O-] ZINC000278750481 521317141 /nfs/dbraw/zinc/31/71/41/521317141.db2.gz SBSHUWRQJXLAJC-QGZVFWFLSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[NH2+]CCCSC)c1[O-] ZINC000069433786 521362374 /nfs/dbraw/zinc/36/23/74/521362374.db2.gz VBAJAVVNSCLFLN-UHFFFAOYSA-N 0 3 255.383 2.634 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@](C)(OC)C2CC2)c1[O-] ZINC000291006884 521366308 /nfs/dbraw/zinc/36/63/08/521366308.db2.gz DHAMIRPIMHWCNY-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN CCOc1cccc(CNCc2cnc(C)s2)c1O ZINC000040997387 521367197 /nfs/dbraw/zinc/36/71/97/521367197.db2.gz DYVLVOPKHUPUCU-UHFFFAOYSA-N 0 3 278.377 2.846 20 10 CFCDHN CCOC1CC2(C1)CC[N@H+](Cc1cc(OC)ccc1[O-])C2 ZINC000289591482 521653867 /nfs/dbraw/zinc/65/38/67/521653867.db2.gz KMMOQUOEVKKYHT-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOC1CC2(C1)CC[N@@H+](Cc1cc(OC)ccc1[O-])C2 ZINC000289591482 521653869 /nfs/dbraw/zinc/65/38/69/521653869.db2.gz KMMOQUOEVKKYHT-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOC1CC2(C1)CC[N@H+](Cc1ccccc1[O-])C2 ZINC000289695214 521654414 /nfs/dbraw/zinc/65/44/14/521654414.db2.gz OKEDBODHVXCQSS-UHFFFAOYSA-N 0 3 261.365 2.783 20 10 CFCDHN CCOC1CC2(C1)CC[N@@H+](Cc1ccccc1[O-])C2 ZINC000289695214 521654417 /nfs/dbraw/zinc/65/44/17/521654417.db2.gz OKEDBODHVXCQSS-UHFFFAOYSA-N 0 3 261.365 2.783 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618379 521657422 /nfs/dbraw/zinc/65/74/22/521657422.db2.gz YJCKAUZELKKKRD-SNVBAGLBSA-N 0 3 255.333 2.733 20 10 CFCDHN CCN1CCC[C@H]1C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094616754 521658315 /nfs/dbraw/zinc/65/83/15/521658315.db2.gz MKSNWQUOPSUOSJ-AAEUAGOBSA-N 0 3 266.360 2.666 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000290236891 521669032 /nfs/dbraw/zinc/66/90/32/521669032.db2.gz UGDJBTANRJJKAM-UHFFFAOYSA-N 0 3 255.333 2.684 20 10 CFCDHN COC(C)(C)C[C@H](C)[NH2+]Cc1cc(F)ccc1[O-] ZINC000180805728 522514221 /nfs/dbraw/zinc/51/42/21/522514221.db2.gz JERODLOGSKYOAI-JTQLQIEISA-N 0 3 255.333 2.825 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC[C@H](C)CO)c1[O-] ZINC000230935458 522540482 /nfs/dbraw/zinc/54/04/82/522540482.db2.gz KJVIPBZEVNHYEA-JTQLQIEISA-N 0 3 287.787 2.552 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CN1CCCC1=O)c1ccc(C)cc1[O-] ZINC000279952073 522732004 /nfs/dbraw/zinc/73/20/04/522732004.db2.gz BTKCCGFFWOYCPR-HIFRSBDPSA-N 0 3 290.407 2.752 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCSC(C)C)cc1OC ZINC000289947010 522779545 /nfs/dbraw/zinc/77/95/45/522779545.db2.gz XNHXMJOBMFLNHP-UHFFFAOYSA-N 0 3 285.409 2.641 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](C)CCO)c1ccc(C)cc1[O-] ZINC000279990628 522848791 /nfs/dbraw/zinc/84/87/91/522848791.db2.gz FINSVKJARQLLBI-GXTWGEPZSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000293269744 522859555 /nfs/dbraw/zinc/85/95/55/522859555.db2.gz CIWDGTPCUYYRDA-DZGCQCFKSA-N 0 3 264.413 2.939 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649236 522865990 /nfs/dbraw/zinc/86/59/90/522865990.db2.gz JRAAACJKTCWZNW-CZUORRHYSA-N 0 3 274.408 2.917 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(C)c(C)cc1[O-])[C@H](O)C(F)F ZINC000295051589 522868304 /nfs/dbraw/zinc/86/83/04/522868304.db2.gz NKUVONNCBWHYSS-YPMHNXCESA-N 0 3 273.323 2.503 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccnn1C)c1ccc(C)cc1[O-] ZINC000280042187 522887941 /nfs/dbraw/zinc/88/79/41/522887941.db2.gz IXCSUPOVAJBUDU-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cnn(C)c1)c1ccc(C)cc1[O-] ZINC000279988731 522892103 /nfs/dbraw/zinc/89/21/03/522892103.db2.gz FEJOBGFQEXIARB-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN COCC1(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CCOCC1 ZINC000293782578 522902349 /nfs/dbraw/zinc/90/23/49/522902349.db2.gz TYAPJSVRARNZGT-AWEZNQCLSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccccc1[O-] ZINC000049553308 522908320 /nfs/dbraw/zinc/90/83/20/522908320.db2.gz MUPSZENNNWUWFW-GXTWGEPZSA-N 0 3 250.386 2.773 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)[C@@H](C)N1CCOCC1)c1ccccc1[O-] ZINC000155706441 522936139 /nfs/dbraw/zinc/93/61/39/522936139.db2.gz JHBRJQXTODFPOM-IIAWOOMASA-N 0 3 292.423 2.542 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000312704257 522951784 /nfs/dbraw/zinc/95/17/84/522951784.db2.gz OIFPIWUPZYYZIK-NVXWUHKLSA-N 0 3 274.408 2.871 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000312704257 522951791 /nfs/dbraw/zinc/95/17/91/522951791.db2.gz OIFPIWUPZYYZIK-NVXWUHKLSA-N 0 3 274.408 2.871 20 10 CFCDHN CCc1ccc(CNCc2cccc(OC)c2O)o1 ZINC000289561883 523941675 /nfs/dbraw/zinc/94/16/75/523941675.db2.gz YRIYSWHARMEWGJ-UHFFFAOYSA-N 0 3 261.321 2.846 20 10 CFCDHN CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000293607624 523952770 /nfs/dbraw/zinc/95/27/70/523952770.db2.gz DVBIABFYFUBZRY-YMTOWFKASA-N 0 3 253.317 2.607 20 10 CFCDHN CN1CCc2cc(CN[C@H]3CCCc4c3cnn4C)ccc21 ZINC000237050806 523996778 /nfs/dbraw/zinc/99/67/78/523996778.db2.gz PSYZRHNUJROEFN-INIZCTEOSA-N 0 3 296.418 2.580 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@H]1n1ccnc1 ZINC000245918305 524295522 /nfs/dbraw/zinc/29/55/22/524295522.db2.gz GRBNEPKIYCUAFB-SWLSCSKDSA-N 0 3 289.354 2.811 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@H]1n1ccnc1 ZINC000245918305 524295532 /nfs/dbraw/zinc/29/55/32/524295532.db2.gz GRBNEPKIYCUAFB-SWLSCSKDSA-N 0 3 289.354 2.811 20 10 CFCDHN C[C@H]1CC[N@H+](Cc2ccccc2[O-])C[C@H]1n1ccnc1 ZINC000245629355 524298756 /nfs/dbraw/zinc/29/87/56/524298756.db2.gz UTZHPBPQVFNEKU-DZGCQCFKSA-N 0 3 271.364 2.672 20 10 CFCDHN C[C@H]1CC[N@@H+](Cc2ccccc2[O-])C[C@H]1n1ccnc1 ZINC000245629355 524298760 /nfs/dbraw/zinc/29/87/60/524298760.db2.gz UTZHPBPQVFNEKU-DZGCQCFKSA-N 0 3 271.364 2.672 20 10 CFCDHN Cc1cccc(CN2C[C@@H](C3CC3)O[C@@H](C)C2)c1O ZINC000280307625 524410441 /nfs/dbraw/zinc/41/04/41/524410441.db2.gz BSSWBSKTNMZTSV-WFASDCNBSA-N 0 3 261.365 2.700 20 10 CFCDHN C[C@H](C[S@@](C)=O)NCc1ccc(N2CCCCC2)cc1 ZINC000168153263 524669662 /nfs/dbraw/zinc/66/96/62/524669662.db2.gz NRPFFYBTUQWBQJ-VLIAUNLRSA-N 0 3 294.464 2.534 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)[C@H]2[C@H]2CCCO2)c1 ZINC000291635066 524738852 /nfs/dbraw/zinc/73/88/52/524738852.db2.gz SQRCEOJOFCUALK-HZPDHXFCSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@](C)(O)C2CCCCC2)c1 ZINC000191654016 524751871 /nfs/dbraw/zinc/75/18/71/524751871.db2.gz ZRMNDHXTBPBJNR-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)c1 ZINC000290059462 524752993 /nfs/dbraw/zinc/75/29/93/524752993.db2.gz FDAHPQKNUTXBHD-SJCJKPOMSA-N 0 3 287.359 2.613 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c1 ZINC000292847120 524753153 /nfs/dbraw/zinc/75/31/53/524753153.db2.gz SWCUUVQKJQCRNV-INIZCTEOSA-N 0 3 293.407 2.678 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c1 ZINC000290416173 524756379 /nfs/dbraw/zinc/75/63/79/524756379.db2.gz KISOVDIGLIWPNE-CGTJXYLNSA-N 0 3 281.355 2.829 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](OC)C(C)C)c1 ZINC000273619288 524763405 /nfs/dbraw/zinc/76/34/05/524763405.db2.gz YNDVPUSGILEUFY-IAQYHMDHSA-N 0 3 267.369 2.722 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccc(O)cc2)c1 ZINC000040735187 524763613 /nfs/dbraw/zinc/76/36/13/524763613.db2.gz YFBCITDWKSTKJI-GFCCVEGCSA-N 0 3 287.359 3.000 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCO[C@H](C)C2)c1 ZINC000273523050 524774423 /nfs/dbraw/zinc/77/44/23/524774423.db2.gz UTSMTQJMBAHBGR-WOPDTQHZSA-N 0 3 265.353 2.619 20 10 CFCDHN Cc1cc(Cl)cc(CN(C)[C@@H](C)C[S@](C)=O)c1O ZINC000130949750 524861543 /nfs/dbraw/zinc/86/15/43/524861543.db2.gz FSUFVVHBEMOGCX-XTZNXHDOSA-N 0 3 289.828 2.553 20 10 CFCDHN COc1ncccc1CC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000290155684 525045178 /nfs/dbraw/zinc/04/51/78/525045178.db2.gz LNVOVVNWEXIEMI-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCSC[C@@H]2C)cc1C ZINC000172513488 525319882 /nfs/dbraw/zinc/31/98/82/525319882.db2.gz IPDTWSNVNZVEGC-LBPRGKRZSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCSC[C@@H]2C)cc1C ZINC000172513488 525319886 /nfs/dbraw/zinc/31/98/86/525319886.db2.gz IPDTWSNVNZVEGC-LBPRGKRZSA-N 0 3 251.395 2.946 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)cc1C ZINC000276027589 525320178 /nfs/dbraw/zinc/32/01/78/525320178.db2.gz RGAUBCVFXRBNRG-OAHLLOKOSA-N 0 3 263.381 2.602 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](O)C(C)(C)C2)cc1C ZINC000276027589 525320186 /nfs/dbraw/zinc/32/01/86/525320186.db2.gz RGAUBCVFXRBNRG-OAHLLOKOSA-N 0 3 263.381 2.602 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@]2(O)CCC[C@H]2C)cc1C ZINC000292903016 525322219 /nfs/dbraw/zinc/32/22/19/525322219.db2.gz DWYLGBKPDFLUNY-CZUORRHYSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1ccc(O)c(CN2CC[C@H](n3cc(Cl)cn3)C2)c1 ZINC000290879577 525344748 /nfs/dbraw/zinc/34/47/48/525344748.db2.gz KSYNHZAXYCAPOQ-AWEZNQCLSA-N 0 3 291.782 2.998 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c1 ZINC000291018914 525346640 /nfs/dbraw/zinc/34/66/40/525346640.db2.gz ABMWMAKDRLLKLX-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c1 ZINC000291018914 525346650 /nfs/dbraw/zinc/34/66/50/525346650.db2.gz ABMWMAKDRLLKLX-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](CC(C)C)N(C)C)c1 ZINC000071406829 525350640 /nfs/dbraw/zinc/35/06/40/525350640.db2.gz YJVQSIUBWUMEFE-OAHLLOKOSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1ccc(O)c([C@H](C)N[C@@H](C)c2cnn(C)c2)c1 ZINC000273554472 525364965 /nfs/dbraw/zinc/36/49/65/525364965.db2.gz GOPLWFDJIBJUIP-RYUDHWBXSA-N 0 3 259.353 2.846 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2)c1 ZINC000273554472 525364974 /nfs/dbraw/zinc/36/49/74/525364974.db2.gz GOPLWFDJIBJUIP-RYUDHWBXSA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@H]([NH2+]CCc1cccnc1)c1cc(F)ccc1[O-] ZINC000094617621 525369317 /nfs/dbraw/zinc/36/93/17/525369317.db2.gz YLVWQELVHMJSRG-NSHDSACASA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cc(F)ccc1[O-] ZINC000185370830 525409120 /nfs/dbraw/zinc/40/91/20/525409120.db2.gz WMWFEDBGFNUVNH-SWLSCSKDSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@@H]([NH2+]CCc1cccnc1)c1cc(F)ccc1[O-] ZINC000094617622 525465072 /nfs/dbraw/zinc/46/50/72/525465072.db2.gz YLVWQELVHMJSRG-LLVKDONJSA-N 0 3 260.312 2.820 20 10 CFCDHN Cc1cc([C@](C)(O)C[NH2+]Cc2cc(C)ccc2[O-])c(C)o1 ZINC000266167099 525551720 /nfs/dbraw/zinc/55/17/20/525551720.db2.gz PXICBLALBWDLTH-QGZVFWFLSA-N 0 3 289.375 2.908 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCOC[C@H]1C)c1cc(F)ccc1[O-] ZINC000278456358 525573088 /nfs/dbraw/zinc/57/30/88/525573088.db2.gz ITQWNUBWRWGFSZ-GBIKHYSHSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(F)cc1[O-] ZINC000062748264 525596338 /nfs/dbraw/zinc/59/63/38/525596338.db2.gz XNKJHDZPFZZJFF-WDEREUQCSA-N 0 3 254.349 2.522 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)C1CCCC1)c1cc(F)ccc1[O-] ZINC000290122898 525626633 /nfs/dbraw/zinc/62/66/33/525626633.db2.gz JLCDNIIWCLOAMO-YGRLFVJLSA-N 0 3 267.344 2.733 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2([S@@](C)=O)CCC2)c([O-])c1 ZINC000280896566 525722282 /nfs/dbraw/zinc/72/22/82/525722282.db2.gz BXOHULOPTSKQLW-CWTRNNRKSA-N 0 3 281.421 2.652 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOCC(F)F)c([O-])c1C ZINC000276660726 525725261 /nfs/dbraw/zinc/72/52/61/525725261.db2.gz NTUUWDZPZYRDDB-LLVKDONJSA-N 0 3 273.323 2.941 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](CO)CC2CCC2)c([O-])c1 ZINC000280886063 525742420 /nfs/dbraw/zinc/74/24/20/525742420.db2.gz DSJYHARSQGNSCO-TZMCWYRMSA-N 0 3 263.381 2.902 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)C(F)(F)F)c([O-])c1 ZINC000273502191 525925501 /nfs/dbraw/zinc/92/55/01/525925501.db2.gz QLBCYBHEQGTNRY-CABZTGNLSA-N 0 3 277.286 2.665 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2COc3c(C)cccc3C2)c1[O-] ZINC000289710172 526034793 /nfs/dbraw/zinc/03/47/93/526034793.db2.gz UHUDXXPWKNORFX-HNNXBMFYSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@H+](Cc3cc(C)ccc3[O-])C2)c1 ZINC000290908513 526267008 /nfs/dbraw/zinc/26/70/08/526267008.db2.gz MVBCVGMEXZLESI-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cnn([C@@H]2CC[N@@H+](Cc3cc(C)ccc3[O-])C2)c1 ZINC000290908513 526267010 /nfs/dbraw/zinc/26/70/10/526267010.db2.gz MVBCVGMEXZLESI-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCN(Cc2ccccc2)C1 ZINC000037047744 526374579 /nfs/dbraw/zinc/37/45/79/526374579.db2.gz GMSWYGVWFRVORO-QGZVFWFLSA-N 0 3 282.387 2.756 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCCCCO)C[C@@H]1CCCO1 ZINC000173354996 527535240 /nfs/dbraw/zinc/53/52/40/527535240.db2.gz SULSESUPRFDGOV-INIZCTEOSA-N 0 3 293.407 2.536 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCCCCO)C[C@@H]1CCCO1 ZINC000173354996 527535249 /nfs/dbraw/zinc/53/52/49/527535249.db2.gz SULSESUPRFDGOV-INIZCTEOSA-N 0 3 293.407 2.536 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000094618495 527637634 /nfs/dbraw/zinc/63/76/34/527637634.db2.gz STFYEUMORPXQQA-SECBINFHSA-N 0 3 277.343 2.732 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H]2O)c1[O-] ZINC000305794942 651078339 /nfs/dbraw/zinc/07/83/39/651078339.db2.gz VCLBHVROPRIOQW-GXFFZTMASA-N 0 3 269.772 2.605 20 10 CFCDHN c1ccc2c(CNCc3ccc4c(c3)CCO4)n[nH]c2c1 ZINC000727470916 574052229 /nfs/dbraw/zinc/05/22/29/574052229.db2.gz SPJRLCKEFKAYEC-UHFFFAOYSA-N 0 3 279.343 2.788 20 10 CFCDHN c1ccc2c(c1)n[nH]c2CNCc1ccc2c(c1)CCO2 ZINC000727470916 574052230 /nfs/dbraw/zinc/05/22/30/574052230.db2.gz SPJRLCKEFKAYEC-UHFFFAOYSA-N 0 3 279.343 2.788 20 10 CFCDHN CC(C)(C)OC(=O)CCCNCc1ccc2c(c1)CCO2 ZINC000744449653 574075170 /nfs/dbraw/zinc/07/51/70/574075170.db2.gz AGMLFGKPPBKXHB-UHFFFAOYSA-N 0 3 291.391 2.833 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCSC[C@H](C)C2)c([O-])c1 ZINC000754155571 574078363 /nfs/dbraw/zinc/07/83/63/574078363.db2.gz IVRTVXYSEWMHHU-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCSC[C@H](C)C2)c([O-])c1 ZINC000754155571 574078365 /nfs/dbraw/zinc/07/83/65/574078365.db2.gz IVRTVXYSEWMHHU-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)C(C)C)c([O-])c1C ZINC000756586412 574127201 /nfs/dbraw/zinc/12/72/01/574127201.db2.gz RNSYSRBTHXBLNL-OCCSQVGLSA-N 0 3 251.370 2.677 20 10 CFCDHN CC(C)NC(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731845475 574130476 /nfs/dbraw/zinc/13/04/76/574130476.db2.gz AGKHCOYJHVKXGJ-UHFFFAOYSA-N 0 3 290.407 2.661 20 10 CFCDHN CC(C)NC(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731845475 574130478 /nfs/dbraw/zinc/13/04/78/574130478.db2.gz AGKHCOYJHVKXGJ-UHFFFAOYSA-N 0 3 290.407 2.661 20 10 CFCDHN CC[N@@H+](Cc1cc2c(cc1[O-])CCC2)C[C@H]1CCOC1 ZINC000738081524 574157248 /nfs/dbraw/zinc/15/72/48/574157248.db2.gz LUVSKQDGMMLLQR-CYBMUJFWSA-N 0 3 275.392 2.739 20 10 CFCDHN CC[N@H+](Cc1cc2c(cc1[O-])CCC2)C[C@H]1CCOC1 ZINC000738081524 574157250 /nfs/dbraw/zinc/15/72/50/574157250.db2.gz LUVSKQDGMMLLQR-CYBMUJFWSA-N 0 3 275.392 2.739 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)CC2CCOCC2)c1[O-] ZINC000747100835 574179647 /nfs/dbraw/zinc/17/96/47/574179647.db2.gz VYZNQLAHAAEVQA-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]Cc2ccnn2C)c2c1c(F)ccc2[O-] ZINC000756401401 574234134 /nfs/dbraw/zinc/23/41/34/574234134.db2.gz OYQCEIDIQUCNBS-JOYOIKCWSA-N 0 3 275.327 2.603 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](O)COCC(C)C)c([O-])c1C ZINC000756460766 574238596 /nfs/dbraw/zinc/23/85/96/574238596.db2.gz SWBBGUKYDYBCMD-CABCVRRESA-N 0 3 295.423 2.693 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCOC2)c2c1c(F)ccc2[O-] ZINC000756455642 574238826 /nfs/dbraw/zinc/23/88/26/574238826.db2.gz ASPGGOSLODWZBE-JFGNBEQYSA-N 0 3 265.328 2.706 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2(C)COC2)c2c1c(F)ccc2[O-] ZINC000756570573 574248734 /nfs/dbraw/zinc/24/87/34/574248734.db2.gz ALLSPWMTQOTDLR-KOLCDFICSA-N 0 3 265.328 2.706 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756659233 574256617 /nfs/dbraw/zinc/25/66/17/574256617.db2.gz PVPBKRZCJKXVQP-SCVCMEIPSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)NCc2cc(C)ncn2)c(O)c1 ZINC000756775531 574261539 /nfs/dbraw/zinc/26/15/39/574261539.db2.gz INDMKLMJLMSAGN-GFCCVEGCSA-N 0 3 257.337 2.650 20 10 CFCDHN Cc1ccc([C@H](C)NCc2cc(C)ncn2)c(O)c1 ZINC000756775534 574261870 /nfs/dbraw/zinc/26/18/70/574261870.db2.gz INDMKLMJLMSAGN-LBPRGKRZSA-N 0 3 257.337 2.650 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]3COCC[C@H]31)CCC2 ZINC000756884763 574270704 /nfs/dbraw/zinc/27/07/04/574270704.db2.gz JFRGNDWXOGYQMJ-DOTOQJQBSA-N 0 3 287.403 2.882 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]3COCC[C@H]31)CCC2 ZINC000756884763 574270705 /nfs/dbraw/zinc/27/07/05/574270705.db2.gz JFRGNDWXOGYQMJ-DOTOQJQBSA-N 0 3 287.403 2.882 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCCSC2)c([O-])c1 ZINC000749111006 574280316 /nfs/dbraw/zinc/28/03/16/574280316.db2.gz XGSUWQVTIAAWFZ-GFCCVEGCSA-N 0 3 267.394 2.776 20 10 CFCDHN CCN(CC)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743396360 574362297 /nfs/dbraw/zinc/36/22/97/574362297.db2.gz ZMSKGKGOJBTVAK-OAHLLOKOSA-N 0 3 299.418 2.857 20 10 CFCDHN CCN(CC)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccncc32)C1 ZINC000743396360 574362299 /nfs/dbraw/zinc/36/22/99/574362299.db2.gz ZMSKGKGOJBTVAK-OAHLLOKOSA-N 0 3 299.418 2.857 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H](CC)C[C@H](C)CO)c1 ZINC000743499709 574367034 /nfs/dbraw/zinc/36/70/34/574367034.db2.gz PPKHCUHAMWYICU-GXTWGEPZSA-N 0 3 281.396 2.678 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@H]2C[C@H](OC)C2(C)C)c1 ZINC000753374221 574401857 /nfs/dbraw/zinc/40/18/57/574401857.db2.gz QVFHWFGPFSLMEB-CABCVRRESA-N 0 3 279.380 2.694 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H]2C[C@@H](OC)C2(C)C)c1 ZINC000753374226 574401862 /nfs/dbraw/zinc/40/18/62/574401862.db2.gz QVFHWFGPFSLMEB-LSDHHAIUSA-N 0 3 279.380 2.694 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@H](C)C2CC2)c([O-])c1OC ZINC000891643196 617694581 /nfs/dbraw/zinc/69/45/81/617694581.db2.gz IQGOISNGBGKKSL-SNVBAGLBSA-N 0 3 265.353 2.640 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@H](C)C2CC2)c([O-])c1OC ZINC000891643196 617694583 /nfs/dbraw/zinc/69/45/83/617694583.db2.gz IQGOISNGBGKKSL-SNVBAGLBSA-N 0 3 265.353 2.640 20 10 CFCDHN Cc1cc(CN2CC[C@@H]2CO)ccc1N1CCCCC1 ZINC000934017209 617866689 /nfs/dbraw/zinc/86/66/89/617866689.db2.gz FVAUOJACDYSCJT-MRXNPFEDSA-N 0 3 274.408 2.552 20 10 CFCDHN COc1ccc(CN2CCS[C@@H](C)[C@H]2C)c(O)c1OC ZINC000892066207 617934415 /nfs/dbraw/zinc/93/44/15/617934415.db2.gz BSQRTEKCLPUGQR-MNOVXSKESA-N 0 3 297.420 2.735 20 10 CFCDHN Cc1ccc(C)n1-c1ccc(C(=O)N(C)CCN(C)C)cc1 ZINC000176812353 618197267 /nfs/dbraw/zinc/19/72/67/618197267.db2.gz VCCAYXCXDVYVFB-UHFFFAOYSA-N 0 3 299.418 2.728 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](C)(OC)C2)c([O-])c1 ZINC000793218276 618250510 /nfs/dbraw/zinc/25/05/10/618250510.db2.gz QTYAMNAZJMFKMV-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](C)(OC)C2)c([O-])c1 ZINC000793218276 618250511 /nfs/dbraw/zinc/25/05/11/618250511.db2.gz QTYAMNAZJMFKMV-MRXNPFEDSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@@H](COC)NCc1cc(F)c(N(C)C)cc1F ZINC000858143638 618259581 /nfs/dbraw/zinc/25/95/81/618259581.db2.gz PUGXXWIBNUNYOU-NSHDSACASA-N 0 3 272.339 2.545 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1F ZINC000190064482 618358674 /nfs/dbraw/zinc/35/86/74/618358674.db2.gz AUFMJQIVANLKLK-CXAGYDPISA-N 0 3 294.414 2.875 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCO)CSC)c1ccc(C)cc1[O-] ZINC000794802380 618456280 /nfs/dbraw/zinc/45/62/80/618456280.db2.gz NMPVZABVRSKVQU-JSGCOSHPSA-N 0 3 283.437 2.855 20 10 CFCDHN CC1=NO[C@@H](CNCc2ccc(N3CCCCC3)cc2)C1 ZINC000895312141 618526696 /nfs/dbraw/zinc/52/66/96/618526696.db2.gz URJYJAAWZQOZAV-QGZVFWFLSA-N 0 3 287.407 2.931 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@H]2CC(C)=NO2)cc1 ZINC000895311814 618526818 /nfs/dbraw/zinc/52/68/18/618526818.db2.gz RQLHFGXFSRESGY-MRXNPFEDSA-N 0 3 275.396 2.787 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H]2CCc3cccnc32)c1 ZINC000895392956 618565160 /nfs/dbraw/zinc/56/51/60/618565160.db2.gz WYMAVSHVWNFGJV-CQSZACIVSA-N 0 3 254.333 2.873 20 10 CFCDHN CC[C@@H]([NH2+]CCc1nnc2ccccn21)c1ccccc1[O-] ZINC000314034800 618773527 /nfs/dbraw/zinc/77/35/27/618773527.db2.gz AQFJKMVUQOZSGR-CQSZACIVSA-N 0 3 296.374 2.718 20 10 CFCDHN COc1ccc(CNCCCSc2nccs2)nc1 ZINC000893044301 618813184 /nfs/dbraw/zinc/81/31/84/618813184.db2.gz FTVHJUVBVJNOEC-UHFFFAOYSA-N 0 3 295.433 2.819 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@H](C)NC(=O)OC(C)(C)C ZINC000309915872 618890336 /nfs/dbraw/zinc/89/03/36/618890336.db2.gz UHWLVPCUPLNVLB-NEPJUHHUSA-N 0 3 294.395 2.784 20 10 CFCDHN Cc1c(C[NH2+]Cc2ccccc2[O-])cccc1[N+](=O)[O-] ZINC000228414450 618906217 /nfs/dbraw/zinc/90/62/17/618906217.db2.gz VSGZWERPAGCIBJ-UHFFFAOYSA-N 0 3 272.304 2.899 20 10 CFCDHN COc1cc(F)cc(C[NH2+]Cc2ccccc2[O-])c1 ZINC000312258444 618915415 /nfs/dbraw/zinc/91/54/15/618915415.db2.gz BHBSDWJZOOYTGI-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN CC(C)[C@](C)(O)C[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185434688 625725979 /nfs/dbraw/zinc/72/59/79/625725979.db2.gz HQBVTSFQHDDIEH-IINYFYTJSA-N 0 3 255.333 2.589 20 10 CFCDHN C[C@H]([NH2+]CCOCC(F)(F)F)c1cc(F)ccc1[O-] ZINC000094618229 619133059 /nfs/dbraw/zinc/13/30/59/619133059.db2.gz IMXBQUDWWMGRCS-QMMMGPOBSA-N 0 3 281.249 2.761 20 10 CFCDHN COc1cc(C)cc(CN[C@@H]2CCCc3c[nH]nc32)c1O ZINC000894351958 619345806 /nfs/dbraw/zinc/34/58/06/619345806.db2.gz MYXKHGOOAJUUDB-CYBMUJFWSA-N 0 3 287.363 2.600 20 10 CFCDHN COc1cc(C)cc(CN2CC3(CC(F)C3)C2)c1O ZINC000894977003 619520640 /nfs/dbraw/zinc/52/06/40/619520640.db2.gz PXYBNPLWMDMNEP-UHFFFAOYSA-N 0 3 265.328 2.643 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000895677547 619580217 /nfs/dbraw/zinc/58/02/17/619580217.db2.gz NWQJWFDRRAXEDF-CYBMUJFWSA-N 0 3 261.365 2.892 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C1CCC2(COC2)CC1 ZINC000895695069 619586167 /nfs/dbraw/zinc/58/61/67/619586167.db2.gz RBMMIIAKSZXLQE-UHFFFAOYSA-N 0 3 261.365 2.749 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](O)Cc2ccccc2F)c([O-])c1 ZINC000895747510 619595739 /nfs/dbraw/zinc/59/57/39/619595739.db2.gz DEKSSGSMYICNGZ-OAHLLOKOSA-N 0 3 289.350 2.533 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC(C)(C)CC[C@@H]2CO)c([O-])c1 ZINC000895925545 619636059 /nfs/dbraw/zinc/63/60/59/619636059.db2.gz CSFVYRHUPRRVPC-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC(C)(C)CC[C@@H]2CO)c([O-])c1 ZINC000895925545 619636060 /nfs/dbraw/zinc/63/60/60/619636060.db2.gz CSFVYRHUPRRVPC-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@](C)(O)c1cccc(F)c1 ZINC000896564814 619763643 /nfs/dbraw/zinc/76/36/43/619763643.db2.gz TYXYSDPCVSYCBS-KRWDZBQOSA-N 0 3 289.350 2.837 20 10 CFCDHN C[C@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)CCO1 ZINC000896577440 619765680 /nfs/dbraw/zinc/76/56/80/619765680.db2.gz LHGJEZMNQUJCKP-XVWMLYKFSA-N 0 3 274.408 2.877 20 10 CFCDHN Cc1ccc(CNCc2cc(C(F)(F)F)nn2C)c(O)c1 ZINC000896840634 619838068 /nfs/dbraw/zinc/83/80/68/619838068.db2.gz NSXINEOQORBRMC-UHFFFAOYSA-N 0 3 299.296 2.743 20 10 CFCDHN COc1ccc(O)c(CNCc2cccc(OC)c2F)c1 ZINC000192683841 620005080 /nfs/dbraw/zinc/00/50/80/620005080.db2.gz RRVIPQZSCDMSJF-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN Cc1ccc(C[NH2+]C2([C@@H]3CCCCO3)CC2)c([O-])c1 ZINC000897387045 620089577 /nfs/dbraw/zinc/08/95/77/620089577.db2.gz BLOWBHYMSSBHCY-HNNXBMFYSA-N 0 3 261.365 2.892 20 10 CFCDHN CC(C)(C[NH2+]Cc1ccccc1[O-])C1CCOCC1 ZINC000897451106 620173897 /nfs/dbraw/zinc/17/38/97/620173897.db2.gz KMSVCZVDCCTPLI-UHFFFAOYSA-N 0 3 263.381 2.935 20 10 CFCDHN COc1cc(O)c(CN[C@@H](C)c2cncs2)cc1OC ZINC000897932563 620302849 /nfs/dbraw/zinc/30/28/49/620302849.db2.gz NDSJGQIRMLAMGP-VIFPVBQESA-N 0 3 294.376 2.717 20 10 CFCDHN CCO[C@]12CCC[C@@]1([NH2+]Cc1cc(F)ccc1[O-])CCO2 ZINC000897974900 620307398 /nfs/dbraw/zinc/30/73/98/620307398.db2.gz SDMRQEPAAQQCSV-CVEARBPZSA-N 0 3 295.354 2.697 20 10 CFCDHN COc1cccc(O)c1CN1CC(Cc2ccoc2)C1 ZINC000898160890 620341221 /nfs/dbraw/zinc/34/12/21/620341221.db2.gz YHANABRHFAHDCS-UHFFFAOYSA-N 0 3 273.332 2.668 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1COC[C@H]1C1CC1)c1ccccc1[O-] ZINC000898380756 620379114 /nfs/dbraw/zinc/37/91/14/620379114.db2.gz UUQFMIRHGWAUDK-SOUVJXGZSA-N 0 3 261.365 2.858 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H]2CNC(=O)C2)c1[O-] ZINC000926980105 620435713 /nfs/dbraw/zinc/43/57/13/620435713.db2.gz OVNXJLFIYLONEP-WDEREUQCSA-N 0 3 296.798 2.531 20 10 CFCDHN COC[C@@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)C(C)C ZINC000927096164 620452263 /nfs/dbraw/zinc/45/22/63/620452263.db2.gz JMGQFGVRSPSJHU-ZIAGYGMSSA-N 0 3 263.381 2.888 20 10 CFCDHN COc1ccc(CNC/C=C/Cl)cc1Cn1cccn1 ZINC000898424217 620461098 /nfs/dbraw/zinc/46/10/98/620461098.db2.gz CGGIFYLXVLKFJG-QHHAFSJGSA-N 0 3 291.782 2.782 20 10 CFCDHN COc1ccc(CNCc2cc(F)ccc2OC)c(O)c1 ZINC000189204787 625442366 /nfs/dbraw/zinc/44/23/66/625442366.db2.gz DTKZDXNAOZUFTK-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN C[C@H]([NH2+]CC1(N)CC1)c1ccc2ccccc2c1[O-] ZINC000902407777 621056561 /nfs/dbraw/zinc/05/65/61/621056561.db2.gz UHRHMGWVMWWYFR-NSHDSACASA-N 0 3 256.349 2.687 20 10 CFCDHN CC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1)c1ccccc1[O-] ZINC000183312239 625464351 /nfs/dbraw/zinc/46/43/51/625464351.db2.gz SAWZLENODSTGQI-OAHLLOKOSA-N 0 3 284.359 2.732 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000902961553 621214913 /nfs/dbraw/zinc/21/49/13/621214913.db2.gz ADPJSIWWFTVTLL-RGYTYGDFSA-N 0 3 269.344 2.701 20 10 CFCDHN CC[C@H](CN1CCOCC1)[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000903342499 621335201 /nfs/dbraw/zinc/33/52/01/621335201.db2.gz FRMQZNUFGNHSOA-ZBFHGGJFSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@H]([NH2+][C@H]1COC[C@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000903438631 621375365 /nfs/dbraw/zinc/37/53/65/621375365.db2.gz WEKMTAWHHJRLLM-HERUPUMHSA-N 0 3 265.328 2.607 20 10 CFCDHN CCCN(Cc1cc(Cl)ccc1[O-])[C@@H]1CC[NH2+]C1 ZINC000071314556 625496092 /nfs/dbraw/zinc/49/60/92/625496092.db2.gz IAGFDOMHOZLZCM-CYBMUJFWSA-N 0 3 268.788 2.620 20 10 CFCDHN CCCC[N@H+](Cc1ccc(N)nn1)Cc1ccccc1[O-] ZINC000904340641 621578226 /nfs/dbraw/zinc/57/82/26/621578226.db2.gz AQCJPGQLLRQDHM-UHFFFAOYSA-N 0 3 286.379 2.567 20 10 CFCDHN CCCC[N@@H+](Cc1ccc(N)nn1)Cc1ccccc1[O-] ZINC000904340641 621578231 /nfs/dbraw/zinc/57/82/31/621578231.db2.gz AQCJPGQLLRQDHM-UHFFFAOYSA-N 0 3 286.379 2.567 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccsc1)c1ccccc1[O-] ZINC000183523822 625514196 /nfs/dbraw/zinc/51/41/96/625514196.db2.gz FJHRDAFHYMLSOF-YGRLFVJLSA-N 0 3 263.362 2.838 20 10 CFCDHN C[C@@H]([NH2+]C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1[O-] ZINC000183546764 625516280 /nfs/dbraw/zinc/51/62/80/625516280.db2.gz UGUSOGPNYVJKKG-LLVKDONJSA-N 0 3 292.379 2.662 20 10 CFCDHN COc1ccc(O)c(C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000183605752 625520903 /nfs/dbraw/zinc/52/09/03/625520903.db2.gz SVGCMZKIUKBALP-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN C[C@H](c1ccncc1)N(C)Cc1cc2c(cc1O)OCO2 ZINC000183715209 625534135 /nfs/dbraw/zinc/53/41/35/625534135.db2.gz MRMGRHDOLNGMFF-LLVKDONJSA-N 0 3 286.331 2.709 20 10 CFCDHN C[N@H+](Cc1ccc2nonc2c1)Cc1ccccc1[O-] ZINC000821391410 622911903 /nfs/dbraw/zinc/91/19/03/622911903.db2.gz LFDAXVFAKSLLKI-UHFFFAOYSA-N 0 3 269.304 2.560 20 10 CFCDHN C[N@@H+](Cc1ccc2nonc2c1)Cc1ccccc1[O-] ZINC000821391410 622911904 /nfs/dbraw/zinc/91/19/04/622911904.db2.gz LFDAXVFAKSLLKI-UHFFFAOYSA-N 0 3 269.304 2.560 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]Cc1ccc2c(c1)OCO2 ZINC000226582210 623083730 /nfs/dbraw/zinc/08/37/30/623083730.db2.gz HWJXEBLYKVNDIH-UHFFFAOYSA-N 0 3 275.279 2.550 20 10 CFCDHN C[C@H]1CC[C@H](C[NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000230402269 623275069 /nfs/dbraw/zinc/27/50/69/623275069.db2.gz NXLGGULLOGFHFM-QWRGUYRKSA-N 0 3 263.337 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@@H](O)C2)c1[O-] ZINC000230934890 623310315 /nfs/dbraw/zinc/31/03/15/623310315.db2.gz DHMALYXWXRJOPD-GXFFZTMASA-N 0 3 299.798 2.695 20 10 CFCDHN CN(CC(=O)NCc1cc(Cl)ccc1O)CC(C)(C)C ZINC000824214493 623470414 /nfs/dbraw/zinc/47/04/14/623470414.db2.gz ZDRRAZYJOMDNAY-UHFFFAOYSA-N 0 3 298.814 2.640 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC2=CCOCC2)c1[O-] ZINC000824597006 623529436 /nfs/dbraw/zinc/52/94/36/623529436.db2.gz NKQWZQBJZLMUFT-UHFFFAOYSA-N 0 3 267.756 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](SC)C2)c1[O-] ZINC000824683513 623544769 /nfs/dbraw/zinc/54/47/69/623544769.db2.gz NFBLWRFPHPIQKO-LLVKDONJSA-N 0 3 287.812 2.992 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](SC)C2)c1[O-] ZINC000824683513 623544774 /nfs/dbraw/zinc/54/47/74/623544774.db2.gz NFBLWRFPHPIQKO-LLVKDONJSA-N 0 3 287.812 2.992 20 10 CFCDHN COC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000824701825 623548257 /nfs/dbraw/zinc/54/82/57/623548257.db2.gz CQNVURINTAEVKB-OLZOCXBDSA-N 0 3 297.782 2.785 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c1[O-] ZINC000824715561 623549818 /nfs/dbraw/zinc/54/98/18/623549818.db2.gz MVSQNVCPGQCMLF-RBSFLKMASA-N 0 3 291.391 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c1[O-] ZINC000824715561 623549825 /nfs/dbraw/zinc/54/98/25/623549825.db2.gz MVSQNVCPGQCMLF-RBSFLKMASA-N 0 3 291.391 2.526 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c1[O-] ZINC000824715560 623550242 /nfs/dbraw/zinc/55/02/42/623550242.db2.gz MVSQNVCPGQCMLF-KFWWJZLASA-N 0 3 291.391 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c1[O-] ZINC000824715560 623550247 /nfs/dbraw/zinc/55/02/47/623550247.db2.gz MVSQNVCPGQCMLF-KFWWJZLASA-N 0 3 291.391 2.526 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC000825133678 623638027 /nfs/dbraw/zinc/63/80/27/623638027.db2.gz KHBBWOLWHLDXCX-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)c([O-])c1 ZINC000825133678 623638029 /nfs/dbraw/zinc/63/80/29/623638029.db2.gz KHBBWOLWHLDXCX-KRWDZBQOSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)NC ZINC000825316065 623669670 /nfs/dbraw/zinc/66/96/70/623669670.db2.gz JSNLLJGECVGYAM-MRXNPFEDSA-N 0 3 298.386 2.673 20 10 CFCDHN CCOc1ccc(C[NH2+]C(C)(C)CN2CCCC2)c([O-])c1 ZINC000825325384 623672467 /nfs/dbraw/zinc/67/24/67/623672467.db2.gz BUUMKPFYOLEOJX-UHFFFAOYSA-N 0 3 292.423 2.755 20 10 CFCDHN CC(C)[N@@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[O-])C1 ZINC000825331688 623674628 /nfs/dbraw/zinc/67/46/28/623674628.db2.gz LMVPKCXDUYCICJ-CQSZACIVSA-N 0 3 282.815 2.960 20 10 CFCDHN CC(C)[N@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[O-])C1 ZINC000825331688 623674633 /nfs/dbraw/zinc/67/46/33/623674633.db2.gz LMVPKCXDUYCICJ-CQSZACIVSA-N 0 3 282.815 2.960 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H](CO)CC2CC2)c1[O-] ZINC000827359344 623992811 /nfs/dbraw/zinc/99/28/11/623992811.db2.gz MDOHETHAFGVLKN-LBPRGKRZSA-N 0 3 283.799 2.852 20 10 CFCDHN C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000827733845 624079055 /nfs/dbraw/zinc/07/90/55/624079055.db2.gz PSCHLICPJLPMSR-SJCJKPOMSA-N 0 3 289.350 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCCOCC(F)(F)F)CC2 ZINC000834508078 625699635 /nfs/dbraw/zinc/69/96/35/625699635.db2.gz HPJSGFSTUHONLZ-LLVKDONJSA-N 0 3 289.297 2.938 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1CO)c1ccccc1[O-] ZINC000154091002 624265182 /nfs/dbraw/zinc/26/51/82/624265182.db2.gz GKBASSRIHUFPCO-GFCCVEGCSA-N 0 3 257.333 2.735 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834581856 625724716 /nfs/dbraw/zinc/72/47/16/625724716.db2.gz NXCSOXBKJONUIR-RBOXIYTFSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834602775 625734475 /nfs/dbraw/zinc/73/44/75/625734475.db2.gz UVXFNWCAKMQCSC-MEDUHNTESA-N 0 3 299.418 2.951 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2c(C)noc2C)c1O ZINC000073006965 625756986 /nfs/dbraw/zinc/75/69/86/625756986.db2.gz VWSLNJXJMITFAJ-VIFPVBQESA-N 0 3 276.336 2.856 20 10 CFCDHN CO[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(F)(F)F ZINC000834722689 625801405 /nfs/dbraw/zinc/80/14/05/625801405.db2.gz XYECWFFVBQNTMP-GXSJLCMTSA-N 0 3 275.270 2.546 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F)[C@@H](C)O ZINC000834886614 625909460 /nfs/dbraw/zinc/90/94/60/625909460.db2.gz DYFUFYNSZWKIFO-BSJXLVFVSA-N 0 3 267.344 2.829 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1C[C@@H]2CCCCN2C1=O)c1ccccc1[O-] ZINC000834914268 625921611 /nfs/dbraw/zinc/92/16/11/625921611.db2.gz LSUNMRUGQPGSOA-AEGPPILISA-N 0 3 288.391 2.586 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccnn1C1CCC1 ZINC000921648835 626044357 /nfs/dbraw/zinc/04/43/57/626044357.db2.gz BJKPBBYHYNIVQP-UHFFFAOYSA-N 0 3 257.337 2.604 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)NCc1ccc2c(c1)CCCO2 ZINC000921688086 626084350 /nfs/dbraw/zinc/08/43/50/626084350.db2.gz OLTZJZVFNNCUJO-GFCCVEGCSA-N 0 3 285.391 2.904 20 10 CFCDHN c1cc2n(n1)CCC[C@H]2NCc1ccc2c(c1)CCCO2 ZINC000922319383 626269163 /nfs/dbraw/zinc/26/91/63/626269163.db2.gz BRGUKFDVNOQPBX-OAHLLOKOSA-N 0 3 283.375 2.833 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)c1ccccc1[O-] ZINC000922332324 626272290 /nfs/dbraw/zinc/27/22/90/626272290.db2.gz LVRABURMECSPIT-CNAMQQPBSA-N 0 3 273.376 2.856 20 10 CFCDHN Cc1cc(O)c(CNCc2cc(N(C)C)ccn2)cc1C ZINC000922478413 626295828 /nfs/dbraw/zinc/29/58/28/626295828.db2.gz OIRBAYWJTCKTTK-UHFFFAOYSA-N 0 3 285.391 2.760 20 10 CFCDHN C[C@H](N[C@H](CCO)c1ccco1)c1ccccc1O ZINC000186561581 626334111 /nfs/dbraw/zinc/33/41/11/626334111.db2.gz PMHOAAIBPUHQEP-WCQYABFASA-N 0 3 261.321 2.760 20 10 CFCDHN C[C@H](O)CCC[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000788605308 626483562 /nfs/dbraw/zinc/48/35/62/626483562.db2.gz OWGCVMJLOYIVEK-JFGNBEQYSA-N 0 3 267.344 2.830 20 10 CFCDHN CCOc1ccc(O)c(CN2CC3(CC(F)C3)C2)c1 ZINC000839140359 626528554 /nfs/dbraw/zinc/52/85/54/626528554.db2.gz PMYYXRRMEDRZAO-UHFFFAOYSA-N 0 3 265.328 2.725 20 10 CFCDHN C[C@H](NC1COC(C)(C)OC1)c1ccc(N(C)C)cc1 ZINC000757697775 626559120 /nfs/dbraw/zinc/55/91/20/626559120.db2.gz KZUPWCKSLIWREX-LBPRGKRZSA-N 0 3 278.396 2.555 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCC2(C)OCCO2)c2c1c(F)ccc2[O-] ZINC000760892566 626782333 /nfs/dbraw/zinc/78/23/33/626782333.db2.gz YXZNCHROIMHEDS-CMPLNLGQSA-N 0 3 295.354 2.822 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCC2(C)OCCO2)c2c1c(F)ccc2[O-] ZINC000760892578 626782381 /nfs/dbraw/zinc/78/23/81/626782381.db2.gz YXZNCHROIMHEDS-PWSUYJOCSA-N 0 3 295.354 2.822 20 10 CFCDHN Cc1cccc2c1CN(Cc1cc3c(cc1O)OCO3)CC2 ZINC000762087725 626889200 /nfs/dbraw/zinc/88/92/00/626889200.db2.gz OBAJPMUOOFFKCL-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@H](OC)[C@H]1CCOC1 ZINC000851792378 634532338 /nfs/dbraw/zinc/53/23/38/634532338.db2.gz OCCZXNSCDBQLJG-RDJZCZTQSA-N 0 3 293.407 2.656 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@H](OC)[C@H]1CCOC1 ZINC000851792378 634532341 /nfs/dbraw/zinc/53/23/41/634532341.db2.gz OCCZXNSCDBQLJG-RDJZCZTQSA-N 0 3 293.407 2.656 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCC2CC(O)C2)c2c1c(F)ccc2[O-] ZINC000762652152 626928214 /nfs/dbraw/zinc/92/82/14/626928214.db2.gz WAXZGDOKSVEAGO-YUVKLTJASA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCC2CC(O)C2)c2c1c(F)ccc2[O-] ZINC000762652151 626928325 /nfs/dbraw/zinc/92/83/25/626928325.db2.gz WAXZGDOKSVEAGO-PGHLRGPGSA-N 0 3 279.355 2.830 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCC(=O)N(CC)CC)cc1 ZINC000765331832 627131284 /nfs/dbraw/zinc/13/12/84/627131284.db2.gz GEAOGQFKYUCEAQ-AWEZNQCLSA-N 0 3 291.439 2.662 20 10 CFCDHN CCC[N@H+](CCC(=O)C1CC1)Cc1ccccc1[O-] ZINC000767411527 627248753 /nfs/dbraw/zinc/24/87/53/627248753.db2.gz LUXURMKQTLCDHI-UHFFFAOYSA-N 0 3 261.365 2.973 20 10 CFCDHN CCC[N@@H+](CCC(=O)C1CC1)Cc1ccccc1[O-] ZINC000767411527 627248755 /nfs/dbraw/zinc/24/87/55/627248755.db2.gz LUXURMKQTLCDHI-UHFFFAOYSA-N 0 3 261.365 2.973 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000767925450 627295685 /nfs/dbraw/zinc/29/56/85/627295685.db2.gz DTEUKNDKKNAGKE-ZDUSSCGKSA-N 0 3 291.391 2.982 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C2CCN(CC)CC2)c([O-])c1 ZINC000768233683 627327415 /nfs/dbraw/zinc/32/74/15/627327415.db2.gz OAYSZHNSICKAHY-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C2CCN(CC)CC2)c([O-])c1 ZINC000768233683 627327420 /nfs/dbraw/zinc/32/74/20/627327420.db2.gz OAYSZHNSICKAHY-UHFFFAOYSA-N 0 3 292.423 2.707 20 10 CFCDHN Cc1cccc(C[N@@H+](C)Cc2cc3c(cc2[O-])OC[C@H]3O)c1 ZINC000768441680 627342961 /nfs/dbraw/zinc/34/29/61/627342961.db2.gz FNWSCCDLWRFVMG-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN Cc1cccc(C[N@H+](C)Cc2cc3c(cc2[O-])OC[C@H]3O)c1 ZINC000768441680 627342964 /nfs/dbraw/zinc/34/29/64/627342964.db2.gz FNWSCCDLWRFVMG-QGZVFWFLSA-N 0 3 299.370 2.758 20 10 CFCDHN CC[C@]1(C)CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464798 627345316 /nfs/dbraw/zinc/34/53/16/627345316.db2.gz AOJPHEBIHBUFCU-DOTOQJQBSA-N 0 3 291.391 2.830 20 10 CFCDHN CC[C@]1(C)CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000768464798 627345320 /nfs/dbraw/zinc/34/53/20/627345320.db2.gz AOJPHEBIHBUFCU-DOTOQJQBSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000768519420 627349351 /nfs/dbraw/zinc/34/93/51/627349351.db2.gz PHICSTUQHPEWGR-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c1[O-] ZINC000768519420 627349355 /nfs/dbraw/zinc/34/93/55/627349355.db2.gz PHICSTUQHPEWGR-GHMZBOCLSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000768903533 627386224 /nfs/dbraw/zinc/38/62/24/627386224.db2.gz NPZJPPHLSKNFOK-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000768903533 627386226 /nfs/dbraw/zinc/38/62/26/627386226.db2.gz NPZJPPHLSKNFOK-LBPRGKRZSA-N 0 3 287.363 2.504 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000769141240 627406372 /nfs/dbraw/zinc/40/63/72/627406372.db2.gz LHKCMIBZTPTADO-GHMZBOCLSA-N 0 3 267.394 2.727 20 10 CFCDHN CCOc1ccc(CN(C)Cc2cccn2C)c(O)c1 ZINC000769468963 627444009 /nfs/dbraw/zinc/44/40/09/627444009.db2.gz QQHHWEBBMAWRNM-UHFFFAOYSA-N 0 3 274.364 2.761 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1CSC ZINC000769513492 627450111 /nfs/dbraw/zinc/45/01/11/627450111.db2.gz AHSKJTTYLRCPHE-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H]1CSC ZINC000769513492 627450113 /nfs/dbraw/zinc/45/01/13/627450113.db2.gz AHSKJTTYLRCPHE-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN Cc1ccc(O)c(CN[C@H](CO)c2ccsc2)c1 ZINC000769932616 627488962 /nfs/dbraw/zinc/48/89/62/627488962.db2.gz GJCVTHGDBMHGEQ-CYBMUJFWSA-N 0 3 263.362 2.585 20 10 CFCDHN CCOc1ccc(CN[C@@H](CO)c2ccsc2)c(O)c1 ZINC000769936872 627489617 /nfs/dbraw/zinc/48/96/17/627489617.db2.gz ZXWGFMSGLIKAJB-AWEZNQCLSA-N 0 3 293.388 2.676 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000770739816 627545207 /nfs/dbraw/zinc/54/52/07/627545207.db2.gz SKCJUIGGUWUSTD-CHWSQXEVSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@@H](NCc1cn2ccccc2n1)c1ccccc1O ZINC000775131877 627995480 /nfs/dbraw/zinc/99/54/80/627995480.db2.gz YFKLJKGHGDNVEQ-GFCCVEGCSA-N 0 3 267.332 2.891 20 10 CFCDHN Cc1ncc(CN[C@@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000775363996 628015734 /nfs/dbraw/zinc/01/57/34/628015734.db2.gz ONSZKBDHCVIYLY-LBPRGKRZSA-N 0 3 270.380 2.702 20 10 CFCDHN CC[C@H]([NH2+]CCOC[C@H]1CCCO1)c1ccccc1[O-] ZINC000775414671 628022951 /nfs/dbraw/zinc/02/29/51/628022951.db2.gz KDTAOUWPTORYHU-HIFRSBDPSA-N 0 3 279.380 2.629 20 10 CFCDHN CC[C@@H]([NH2+]CCCNc1ncccn1)c1ccccc1[O-] ZINC000775512530 628032948 /nfs/dbraw/zinc/03/29/48/628032948.db2.gz QZWQBFIEHRIFAV-CQSZACIVSA-N 0 3 286.379 2.725 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2CC(N)=O)c1[O-] ZINC000775663523 628052312 /nfs/dbraw/zinc/05/23/12/628052312.db2.gz DMBLEZJVBUQVFV-ZDUSSCGKSA-N 0 3 296.798 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2CC(N)=O)c1[O-] ZINC000775663523 628052316 /nfs/dbraw/zinc/05/23/16/628052316.db2.gz DMBLEZJVBUQVFV-ZDUSSCGKSA-N 0 3 296.798 2.584 20 10 CFCDHN COc1cc(Cl)cc(CN2CCN(C)[C@@H](C)[C@H]2C)c1O ZINC000775984039 628091421 /nfs/dbraw/zinc/09/14/21/628091421.db2.gz FBDLIGSNMWRTDS-WDEREUQCSA-N 0 3 298.814 2.579 20 10 CFCDHN COc1cc(O)c(CN[C@@H](C)c2cccnc2)cc1OC ZINC000776174676 628111982 /nfs/dbraw/zinc/11/19/82/628111982.db2.gz QUEBHMMCSKEPAA-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN CN1CC=C(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000776256183 628122585 /nfs/dbraw/zinc/12/25/85/628122585.db2.gz BWSKXYGIRKIMCE-UHFFFAOYSA-N 0 3 284.762 2.536 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c1[O-] ZINC000777440535 628226026 /nfs/dbraw/zinc/22/60/26/628226026.db2.gz ZDGISSIXEVOWCX-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2C2CCOCC2)c1[O-] ZINC000777440535 628226028 /nfs/dbraw/zinc/22/60/28/628226028.db2.gz ZDGISSIXEVOWCX-HNNXBMFYSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCN2CC[C@@H](C)C2)c1[O-] ZINC000777483250 628229836 /nfs/dbraw/zinc/22/98/36/628229836.db2.gz KGHZNHWMDIJLGX-LLVKDONJSA-N 0 3 282.815 2.785 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CCCOC2)c([O-])c1 ZINC000779987804 628425151 /nfs/dbraw/zinc/42/51/51/628425151.db2.gz HFMHFJCITCAORY-GXTWGEPZSA-N 0 3 279.380 2.696 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@H](OC(F)F)C2)cc1 ZINC000781533044 628557216 /nfs/dbraw/zinc/55/72/16/628557216.db2.gz XCHYCVVCZPUVAG-CQSZACIVSA-N 0 3 284.350 2.956 20 10 CFCDHN CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000783510496 628714748 /nfs/dbraw/zinc/71/47/48/628714748.db2.gz PFKXPCACSZSPJU-YWPYICTPSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000783515758 628715351 /nfs/dbraw/zinc/71/53/51/628715351.db2.gz AWHUELLAMLBMII-FRRDWIJNSA-N 0 3 251.370 2.840 20 10 CFCDHN CO[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])C(F)(F)F ZINC000783523326 628716183 /nfs/dbraw/zinc/71/61/83/628716183.db2.gz IEEUQVQLFNXQFQ-GZMMTYOYSA-N 0 3 263.259 2.620 20 10 CFCDHN CN(C)CCc1ccccc1NC(=O)C1=CC(=O)CS1 ZINC000783939905 628756394 /nfs/dbraw/zinc/75/63/94/628756394.db2.gz MZUFGBOHAPFVPP-UHFFFAOYSA-N 0 3 290.388 2.810 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc(F)nc2C)c1 ZINC000785469921 628885493 /nfs/dbraw/zinc/88/54/93/628885493.db2.gz XFCSIXOAHHCWAM-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CC[C@@H](O)C2)c([O-])c1 ZINC000788775639 629098864 /nfs/dbraw/zinc/09/88/64/629098864.db2.gz IWZJVOOPSJBLCJ-BFHYXJOUSA-N 0 3 263.381 2.821 20 10 CFCDHN CCc1nc([C@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835043194 629336852 /nfs/dbraw/zinc/33/68/52/629336852.db2.gz QSRAEMOFBKGGDT-FWWRYZNZSA-N 0 3 299.422 2.797 20 10 CFCDHN CCOCCN(C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835045524 629341834 /nfs/dbraw/zinc/34/18/34/629341834.db2.gz VXBXEFVODFRVLX-VOTSOKGWSA-N 0 3 262.397 2.734 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2CC[C@@H](O)C(C)(C)C2)cc1 ZINC000835046117 629345015 /nfs/dbraw/zinc/34/50/15/629345015.db2.gz STVWTBHUSALPSK-FUTAKVPZSA-N 0 3 288.435 2.859 20 10 CFCDHN CC[C@@H]1CN(C)CCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000835055953 629359075 /nfs/dbraw/zinc/35/90/75/629359075.db2.gz QIIQNGCWGKOBOY-JTGQJZMRSA-N 0 3 287.451 2.792 20 10 CFCDHN CC(C)C[N@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000835076391 629374330 /nfs/dbraw/zinc/37/43/30/629374330.db2.gz IHLIUWDOPOVOJV-UHFFFAOYSA-N 0 3 273.380 2.784 20 10 CFCDHN CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1ccccc1[O-] ZINC000835076391 629374377 /nfs/dbraw/zinc/37/43/77/629374377.db2.gz IHLIUWDOPOVOJV-UHFFFAOYSA-N 0 3 273.380 2.784 20 10 CFCDHN COc1ccc(C[NH2+]Cc2c(C)nc3ccccn32)c([O-])c1 ZINC000793386041 629535072 /nfs/dbraw/zinc/53/50/72/629535072.db2.gz HYCCJFJLSVULLZ-UHFFFAOYSA-N 0 3 297.358 2.647 20 10 CFCDHN Cc1cc([C@@H](C)NCc2ccc3c(c2)CCCN3C)n(C)n1 ZINC000793524638 629561856 /nfs/dbraw/zinc/56/18/56/629561856.db2.gz GWRLNKUXARVJAD-CQSZACIVSA-N 0 3 298.434 2.962 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C(C)(C)O)c1ccc(C)cc1[O-] ZINC000794814625 629689492 /nfs/dbraw/zinc/68/94/92/629689492.db2.gz RSOSCZDMXLDNEF-YPMHNXCESA-N 0 3 251.370 2.901 20 10 CFCDHN CC[C@@H]([NH2+]C[C@]1(OC)CCOC1)c1ccc(C)cc1[O-] ZINC000794813904 629689622 /nfs/dbraw/zinc/68/96/22/629689622.db2.gz KGIKGRSQTQPCJP-GDBMZVCRSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)CC(F)F)c1ccc(C)cc1[O-] ZINC000794817696 629690416 /nfs/dbraw/zinc/69/04/16/629690416.db2.gz UUJCCNXQDNCQDS-JQWIXIFHSA-N 0 3 273.323 2.757 20 10 CFCDHN CC[C@H]([NH2+][C@H](CO)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000794816109 629690466 /nfs/dbraw/zinc/69/04/66/629690466.db2.gz KJXOJLCRACLFGG-JKSUJKDBSA-N 0 3 293.407 2.529 20 10 CFCDHN COc1ccc(N2CCN(CCCCF)CC2)cc1 ZINC000795855323 629842536 /nfs/dbraw/zinc/84/25/36/629842536.db2.gz MRCOSMFHOBLBBK-UHFFFAOYSA-N 0 3 266.360 2.567 20 10 CFCDHN CCC[C@]1([NH2+]Cc2ccc(OCC)cc2[O-])CCOC1 ZINC000796491520 629926161 /nfs/dbraw/zinc/92/61/61/629926161.db2.gz HUMKCOMOHVNHLH-INIZCTEOSA-N 0 3 279.380 2.840 20 10 CFCDHN CCC[C@@]1([NH2+]Cc2ccc(OCC)cc2[O-])CCOC1 ZINC000796491521 629926327 /nfs/dbraw/zinc/92/63/27/629926327.db2.gz HUMKCOMOHVNHLH-MRXNPFEDSA-N 0 3 279.380 2.840 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCOC[C@H]2C)c([O-])c1 ZINC000796497682 629927206 /nfs/dbraw/zinc/92/72/06/629927206.db2.gz NXAFGZWEJFMRTJ-OLZOCXBDSA-N 0 3 279.380 2.553 20 10 CFCDHN COc1ccc(O)c(CNCc2cn(C(C)C)nc2C)c1 ZINC000798493338 630195886 /nfs/dbraw/zinc/19/58/86/630195886.db2.gz OFUWJIYVSZEAGK-UHFFFAOYSA-N 0 3 289.379 2.776 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000798504138 630197060 /nfs/dbraw/zinc/19/70/60/630197060.db2.gz WIZGZRZPJXHAJI-CQSZACIVSA-N 0 3 263.381 2.671 20 10 CFCDHN COc1ccc(N2CCN(CCSC(C)C)CC2)cc1 ZINC000801507239 630451744 /nfs/dbraw/zinc/45/17/44/630451744.db2.gz BYFVMFGOHLVHED-UHFFFAOYSA-N 0 3 294.464 2.959 20 10 CFCDHN CCNC(=O)[C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672694 631025902 /nfs/dbraw/zinc/02/59/02/631025902.db2.gz RJRPWTBUCFWICQ-NXEZZACHSA-N 0 3 284.787 2.529 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808679472 631027824 /nfs/dbraw/zinc/02/78/24/631027824.db2.gz QBJCSITZOCAYSY-LLVKDONJSA-N 0 3 298.814 2.921 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCC(=O)N(C)C)c1[O-] ZINC000808682275 631028519 /nfs/dbraw/zinc/02/85/19/631028519.db2.gz QEPHIXABHVHGDW-LLVKDONJSA-N 0 3 298.814 2.873 20 10 CFCDHN COCCOCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808680954 631028549 /nfs/dbraw/zinc/02/85/49/631028549.db2.gz RKJYGUBIYHIFBI-NSHDSACASA-N 0 3 287.787 2.668 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCN(C)C)c1[O-] ZINC000808718093 631034682 /nfs/dbraw/zinc/03/46/82/631034682.db2.gz LJXYVOZQMBNBAY-SNVBAGLBSA-N 0 3 256.777 2.566 20 10 CFCDHN Oc1cc2c(cc1CN1CCO[C@@H](C3CCC3)C1)CCC2 ZINC000840175392 631225040 /nfs/dbraw/zinc/22/50/40/631225040.db2.gz IZDDZXMREQZJMU-GOSISDBHSA-N 0 3 287.403 2.882 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCCNC2=O)c1[O-] ZINC000840825873 631232482 /nfs/dbraw/zinc/23/24/82/631232482.db2.gz CCAFWGUMGFVEDU-MNOVXSKESA-N 0 3 296.798 2.531 20 10 CFCDHN CC[C@H]([NH2+]CCC(C)(C)S(C)(=O)=O)c1ccccc1[O-] ZINC000840877619 631249144 /nfs/dbraw/zinc/24/91/44/631249144.db2.gz ZGEQHQNDCRUIFM-ZDUSSCGKSA-N 0 3 299.436 2.646 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCN(C)C(C)C)c(Cl)c1 ZINC000840889485 631252939 /nfs/dbraw/zinc/25/29/39/631252939.db2.gz IFYYCMWVJSZYEB-UHFFFAOYSA-N 0 3 270.804 2.784 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(c2ccncn2)CC1 ZINC000840953529 631280620 /nfs/dbraw/zinc/28/06/20/631280620.db2.gz SZGRJMTVCQDIIC-UHFFFAOYSA-N 0 3 299.374 2.570 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)C2(OC)CCC2)c([O-])c1 ZINC000840969508 631289155 /nfs/dbraw/zinc/28/91/55/631289155.db2.gz GNIBMULLNLMXEI-LBPRGKRZSA-N 0 3 279.380 2.838 20 10 CFCDHN CCCC[C@@H](CN)[NH2+]Cc1cc(Cl)ccc1[O-] ZINC000841028651 631309926 /nfs/dbraw/zinc/30/99/26/631309926.db2.gz GFIQVAHDYSMYTH-LBPRGKRZSA-N 0 3 256.777 2.653 20 10 CFCDHN C[C@]1(CNCc2c([O-])ccc(Cl)c2F)CCC[NH2+]C1 ZINC000841057463 631323497 /nfs/dbraw/zinc/32/34/97/631323497.db2.gz NLVLXNQIPXXUCZ-AWEZNQCLSA-N 0 3 286.778 2.664 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(CC(F)F)C1)c1cc(F)ccc1[O-] ZINC000841766053 631469907 /nfs/dbraw/zinc/46/99/07/631469907.db2.gz YKVVARSLLYNTRJ-GXSJLCMTSA-N 0 3 288.313 2.521 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC1CCC(F)CC1)OCO2 ZINC000842774482 631737206 /nfs/dbraw/zinc/73/72/06/631737206.db2.gz HKLZOTZBCXVGRM-UHFFFAOYSA-N 0 3 281.327 2.739 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@](C)(OC)C2CC2)c([O-])c1 ZINC000812772489 631771062 /nfs/dbraw/zinc/77/10/62/631771062.db2.gz NBRSCYQSGXIVHO-MRXNPFEDSA-N 0 3 279.380 2.696 20 10 CFCDHN CC[C@H](C)C[C@@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000842915945 631781600 /nfs/dbraw/zinc/78/16/00/631781600.db2.gz HZLNJWUKNIRZJT-UBHSHLNASA-N 0 3 263.381 2.766 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)CO1 ZINC000842927235 631782734 /nfs/dbraw/zinc/78/27/34/631782734.db2.gz DFLTYPPMEXGFRI-MWGHHZFTSA-N 0 3 265.328 2.847 20 10 CFCDHN [NH3+]Cc1ccc2c(c1)CCCN2Cc1cccc(F)c1[O-] ZINC000843057668 631820814 /nfs/dbraw/zinc/82/08/14/631820814.db2.gz GVQIVBJGNGCUJP-UHFFFAOYSA-N 0 3 286.350 2.943 20 10 CFCDHN CC[C@@H]([NH2+]CCCOC[C@@H]1CCOC1)c1ccccc1[O-] ZINC000155966661 650038548 /nfs/dbraw/zinc/03/85/48/650038548.db2.gz AKTPSIXFZSQHST-GOEBONIOSA-N 0 3 293.407 2.876 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843415181 631947985 /nfs/dbraw/zinc/94/79/85/631947985.db2.gz BBKGDBNUKZILTB-WFASDCNBSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000843415181 631947987 /nfs/dbraw/zinc/94/79/87/631947987.db2.gz BBKGDBNUKZILTB-WFASDCNBSA-N 0 3 279.355 2.922 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1[O-] ZINC000843417902 631949113 /nfs/dbraw/zinc/94/91/13/631949113.db2.gz WYLKTBNQDKZXFC-LSDHHAIUSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1[O-] ZINC000843417902 631949114 /nfs/dbraw/zinc/94/91/14/631949114.db2.gz WYLKTBNQDKZXFC-LSDHHAIUSA-N 0 3 291.391 2.792 20 10 CFCDHN CCCC[C@@](C)(CO)[NH2+]Cc1cc(F)ccc1[O-] ZINC000843425695 631954679 /nfs/dbraw/zinc/95/46/79/631954679.db2.gz FHNZUIWEPDWPKO-AWEZNQCLSA-N 0 3 255.333 2.562 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])[C@@H]1SC ZINC000843430016 631956099 /nfs/dbraw/zinc/95/60/99/631956099.db2.gz LRYPCHVPBAWJGP-BNOWGMLFSA-N 0 3 285.384 2.530 20 10 CFCDHN CCOc1ccc(CNCc2c(C)onc2CC)c(O)c1 ZINC000815146246 632215621 /nfs/dbraw/zinc/21/56/21/632215621.db2.gz OTOMTAGDBAWXRF-UHFFFAOYSA-N 0 3 290.363 2.940 20 10 CFCDHN CCc1noc(C)c1CNCc1cc(C)ccc1O ZINC000815147188 632217625 /nfs/dbraw/zinc/21/76/25/632217625.db2.gz ZAQAGMXNMOJTAO-UHFFFAOYSA-N 0 3 260.337 2.849 20 10 CFCDHN CC[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@H](C)CO1 ZINC000844729295 632290748 /nfs/dbraw/zinc/29/07/48/632290748.db2.gz HLUAKBQIZAIDSE-MLGOLLRUSA-N 0 3 275.392 2.880 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@]2(O)CCC[C@H]2C)c1[O-] ZINC000816661407 632507672 /nfs/dbraw/zinc/50/76/72/632507672.db2.gz MTAFAXYDJNGXIV-ABAIWWIYSA-N 0 3 283.799 2.995 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccnn1CC)c1ccccc1[O-] ZINC000845993331 632610272 /nfs/dbraw/zinc/61/02/72/632610272.db2.gz YBIPDYGLKNJQOA-AWEZNQCLSA-N 0 3 259.353 2.850 20 10 CFCDHN Cc1cccc(CN2C[C@@H](C)OCC23CCC3)c1O ZINC000846066232 632627431 /nfs/dbraw/zinc/62/74/31/632627431.db2.gz AYMFFHOKEPBBTM-CYBMUJFWSA-N 0 3 261.365 2.844 20 10 CFCDHN C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2c1c(F)ccc2[O-] ZINC000846189127 632657168 /nfs/dbraw/zinc/65/71/68/632657168.db2.gz KPERVXMKROBCRS-ACXKUBNZSA-N 0 3 277.339 2.989 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@]2(O)CCOC2)c1[O-] ZINC000846194158 632658309 /nfs/dbraw/zinc/65/83/09/632658309.db2.gz RMIBCEXMUFADGU-XHDPSFHLSA-N 0 3 299.798 2.546 20 10 CFCDHN CON1CCC([NH2+][C@H]2C[C@@H](C)c3c2c([O-])ccc3F)CC1 ZINC000817589593 632672036 /nfs/dbraw/zinc/67/20/36/632672036.db2.gz ZDEOTAZPCNXZTB-MFKMUULPSA-N 0 3 294.370 2.695 20 10 CFCDHN CC[C@H](N[C@@H]1CC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817944672 632747773 /nfs/dbraw/zinc/74/77/73/632747773.db2.gz JFMCCNANHZWHMX-PWSUYJOCSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](N)C(C)C)c1ccc(F)cc1[O-] ZINC000817957400 632755451 /nfs/dbraw/zinc/75/54/51/632755451.db2.gz BQRWFJXNCFHIBO-STQMWFEESA-N 0 3 254.349 2.555 20 10 CFCDHN Cc1nc([C@@H](C)NCCc2ccc(N)cc2)cs1 ZINC000817958184 632756364 /nfs/dbraw/zinc/75/63/64/632756364.db2.gz SSFHKQCCQNYSQM-SNVBAGLBSA-N 0 3 261.394 2.927 20 10 CFCDHN CCCC[C@H](CN)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000817961882 632762358 /nfs/dbraw/zinc/76/23/58/632762358.db2.gz FTBORAAFNRNWER-ZYHUDNBSSA-N 0 3 254.349 2.699 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](N)C1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817964517 632763091 /nfs/dbraw/zinc/76/30/91/632763091.db2.gz BEZNKIKNCCFMCY-QPUJVOFHSA-N 0 3 288.313 2.799 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1NCCc3ccccc31)CC2 ZINC000817975490 632773783 /nfs/dbraw/zinc/77/37/83/632773783.db2.gz VODOVTVJYIMDTB-SJORKVTESA-N 0 3 294.398 2.856 20 10 CFCDHN CCC(CC)C[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000106479816 632776524 /nfs/dbraw/zinc/77/65/24/632776524.db2.gz VPYMLTLGMCZKKF-UHFFFAOYSA-N 0 3 251.326 2.647 20 10 CFCDHN C[C@@H](N[C@H]1C[NH2+]CCC1(F)F)c1cc(Cl)ccc1[O-] ZINC000817981097 632777617 /nfs/dbraw/zinc/77/76/17/632777617.db2.gz PYBFFHCQPVGMLO-PELKAZGASA-N 0 3 290.741 2.693 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCCCNC1)c1ccc(F)cc1[O-] ZINC000817983576 632780334 /nfs/dbraw/zinc/78/03/34/632780334.db2.gz GSOAWVIFIADIKX-JSGCOSHPSA-N 0 3 266.360 2.714 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1cc(F)cc(F)c1[O-] ZINC000817985932 632782378 /nfs/dbraw/zinc/78/23/78/632782378.db2.gz OJHNLIHXXSNWPV-PWSUYJOCSA-N 0 3 296.361 2.996 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[C@H]2O)c1[O-] ZINC000818358326 632837588 /nfs/dbraw/zinc/83/75/88/632837588.db2.gz UZVWUTJNBHCEQB-XXILOJSOSA-N 0 3 255.745 2.528 20 10 CFCDHN CN(Cc1cc(C(C)(C)C)cc(O)c1O)[C@@H]1CCOC1 ZINC000106857599 632987195 /nfs/dbraw/zinc/98/71/95/632987195.db2.gz TTXMJOOBUQVBIF-CYBMUJFWSA-N 0 3 279.380 2.616 20 10 CFCDHN CCc1cccc(CN2CCO[C@@H](C3CC3)C2)c1O ZINC000848904302 633391001 /nfs/dbraw/zinc/39/10/01/633391001.db2.gz PSAIGUPFQPPVPS-OAHLLOKOSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1cccc(CN(CC)C[C@H](O)C(F)(F)F)c1O ZINC000848903948 633391508 /nfs/dbraw/zinc/39/15/08/633391508.db2.gz HHLJVFTVLZNIPG-LBPRGKRZSA-N 0 3 291.313 2.700 20 10 CFCDHN CCc1cccc(CN2C[C@@H](C)O[C@@H](C3CC3)C2)c1O ZINC000848907694 633394486 /nfs/dbraw/zinc/39/44/86/633394486.db2.gz HDMNDDFZBZIXRG-MLGOLLRUSA-N 0 3 275.392 2.954 20 10 CFCDHN CCc1cccc(CN2CCOC[C@H]2C2CCC2)c1O ZINC000848920129 633402988 /nfs/dbraw/zinc/40/29/88/633402988.db2.gz XXBKDWBKTNENOH-INIZCTEOSA-N 0 3 275.392 2.956 20 10 CFCDHN CC(C)OC(=O)C[C@H]([NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000848927695 633411204 /nfs/dbraw/zinc/41/12/04/633411204.db2.gz LGPCWKAJQJWTLA-AWEZNQCLSA-N 0 3 297.370 2.987 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2cccc(N)c2)c([O-])c1 ZINC000849349696 633625588 /nfs/dbraw/zinc/62/55/88/633625588.db2.gz FAJVLGDHOKEIPT-UHFFFAOYSA-N 0 3 272.348 2.663 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1ccnn1CC1CC1 ZINC000850137270 633853555 /nfs/dbraw/zinc/85/35/55/633853555.db2.gz MXNOIHDTOAEYSQ-UHFFFAOYSA-N 0 3 298.434 2.957 20 10 CFCDHN CC[C@H](COCC1CC1)[NH2+]Cc1c([O-])cccc1OC ZINC000850350885 633950990 /nfs/dbraw/zinc/95/09/90/633950990.db2.gz VZOFSXKLZNEUKU-CYBMUJFWSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cc(Br)cc(C[NH2+][C@@H]2C=CCC2)c1[O-] ZINC000850358270 633954180 /nfs/dbraw/zinc/95/41/80/633954180.db2.gz MQYMNOKEEUIUNV-LLVKDONJSA-N 0 3 298.180 2.972 20 10 CFCDHN COc1ccc(CNC[C@]23OCCC[C@H]2C3(F)F)cc1C ZINC000850377233 633964855 /nfs/dbraw/zinc/96/48/55/633964855.db2.gz CJNJMIILLIUOFN-CABCVRRESA-N 0 3 297.345 2.908 20 10 CFCDHN FC1(F)[C@@H]2CCCO[C@@]21CNCc1ccc2c(c1)CCO2 ZINC000850378602 633966598 /nfs/dbraw/zinc/96/65/98/633966598.db2.gz LBOQBOMEFLHHLZ-CABCVRRESA-N 0 3 295.329 2.525 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@]1(C)CC1(F)F ZINC000850380900 633967617 /nfs/dbraw/zinc/96/76/17/633967617.db2.gz PXTDGVXKHWNFSL-ZDUSSCGKSA-N 0 3 271.307 2.926 20 10 CFCDHN C[C@H](CN1CCC(C)CC1)[NH2+]Cc1ccccc1[O-] ZINC000850387584 633970599 /nfs/dbraw/zinc/97/05/99/633970599.db2.gz VGMKREXSISLMTK-CQSZACIVSA-N 0 3 262.397 2.602 20 10 CFCDHN C[C@H](O)[C@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000850419477 633984313 /nfs/dbraw/zinc/98/43/13/633984313.db2.gz FQACUJDAJIPAFM-LRDDRELGSA-N 0 3 257.333 2.604 20 10 CFCDHN C[C@H](O)[C@@H](NCc1ccc(N(C)C)cc1)c1ccccc1 ZINC000850421533 633985278 /nfs/dbraw/zinc/98/52/78/633985278.db2.gz YGQUETZTVPFZKI-KBXCAEBGSA-N 0 3 284.403 2.964 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCn3nccc32)cc1 ZINC000850422013 633986214 /nfs/dbraw/zinc/98/62/14/633986214.db2.gz CECKOXOFJVVJCJ-OAHLLOKOSA-N 0 3 270.380 2.574 20 10 CFCDHN CN1CCCc2cc(CN[C@H]3CCCn4nccc43)ccc21 ZINC000850431620 633989590 /nfs/dbraw/zinc/98/95/90/633989590.db2.gz ZOFBOXDVYSBLQM-INIZCTEOSA-N 0 3 296.418 2.890 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1CCCn2nccc21 ZINC000850435357 633991400 /nfs/dbraw/zinc/99/14/00/633991400.db2.gz MLOYZMKJTSEATL-MRXNPFEDSA-N 0 3 284.407 2.882 20 10 CFCDHN Cc1cc(CN[C@H]2CCCn3nccc32)ccc1N(C)C ZINC000850442388 633994596 /nfs/dbraw/zinc/99/45/96/633994596.db2.gz CQRULPHTTDLGQK-HNNXBMFYSA-N 0 3 284.407 2.882 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@@H](COC)OC)c1ccc(C)cc1[O-] ZINC000850487324 634014979 /nfs/dbraw/zinc/01/49/79/634014979.db2.gz ZCRIKYQOGSDJQH-DZGCQCFKSA-N 0 3 281.396 2.793 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CCOCC1 ZINC000850494469 634017572 /nfs/dbraw/zinc/01/75/72/634017572.db2.gz RXTYCPQIYKCITR-NHYWBVRUSA-N 0 3 297.370 2.624 20 10 CFCDHN C[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccccc1[O-] ZINC000850535033 634041326 /nfs/dbraw/zinc/04/13/26/634041326.db2.gz PWHJMVRTWCDHDL-LLVKDONJSA-N 0 3 271.364 2.854 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](O)C23CCC3)c2c1c(F)ccc2[O-] ZINC000850545411 634046485 /nfs/dbraw/zinc/04/64/85/634046485.db2.gz GVTXNIABALXGLK-OJDJGZDQSA-N 0 3 291.366 2.973 20 10 CFCDHN CO[C@@]1(C)C[C@H]1[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000850570791 634055610 /nfs/dbraw/zinc/05/56/10/634055610.db2.gz IYZUFMBPXADIMK-RAAPYIGPSA-N 0 3 265.328 2.847 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCOCCF)c2c1c(F)ccc2[O-] ZINC000853238405 634948750 /nfs/dbraw/zinc/94/87/50/634948750.db2.gz ICJCZAWDKFUBIP-ONGXEEELSA-N 0 3 271.307 2.655 20 10 CFCDHN CNC[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233078 635267824 /nfs/dbraw/zinc/26/78/24/635267824.db2.gz WQXHXQRIIPQUTE-DTWKUNHWSA-N 0 3 276.302 2.670 20 10 CFCDHN C[NH2+]C[C@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000854233078 635267829 /nfs/dbraw/zinc/26/78/29/635267829.db2.gz WQXHXQRIIPQUTE-DTWKUNHWSA-N 0 3 276.302 2.670 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2cscn2)cc1F ZINC000858141384 636138226 /nfs/dbraw/zinc/13/82/26/636138226.db2.gz OKNAOUCZQFGEHM-UHFFFAOYSA-N 0 3 297.374 2.820 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1COc2cccc(C)c2C1 ZINC000858215453 636157130 /nfs/dbraw/zinc/15/71/30/636157130.db2.gz FMHJQOLHOWELQV-ZDUSSCGKSA-N 0 3 299.370 2.803 20 10 CFCDHN COC(=O)CC1CCC([NH2+]Cc2ccccc2[O-])CC1 ZINC000858359861 636206753 /nfs/dbraw/zinc/20/67/53/636206753.db2.gz JSIAKEQYFCRAKX-UHFFFAOYSA-N 0 3 277.364 2.604 20 10 CFCDHN OCc1cc(NCCCSc2nccs2)ccn1 ZINC000858408819 636224495 /nfs/dbraw/zinc/22/44/95/636224495.db2.gz UWHSNBKSEQYUKE-UHFFFAOYSA-N 0 3 281.406 2.625 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]Cc2ccc[nH]c2=O)c2c1c(F)ccc2[O-] ZINC000858563144 636293734 /nfs/dbraw/zinc/29/37/34/636293734.db2.gz QELJSLWDGAEVON-CABZTGNLSA-N 0 3 288.322 2.970 20 10 CFCDHN C[C@@H](NCC(=O)NCC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000859258142 636524272 /nfs/dbraw/zinc/52/42/72/636524272.db2.gz KPRKNAGFURDISM-CYBMUJFWSA-N 0 3 291.439 2.566 20 10 CFCDHN CC(C)Oc1ncccc1CNCc1ccccc1O ZINC000048760401 650278261 /nfs/dbraw/zinc/27/82/61/650278261.db2.gz SMOGFJMQUVBHAH-UHFFFAOYSA-N 0 3 272.348 2.864 20 10 CFCDHN CC[C@]1(CO)CCCN1Cc1cc(F)c(N(C)C)cc1F ZINC000862336764 637323885 /nfs/dbraw/zinc/32/38/85/637323885.db2.gz KFGQIJLKWUBMCC-MRXNPFEDSA-N 0 3 298.377 2.768 20 10 CFCDHN COCCCCN(C)Cc1cc(F)c(N(C)C)cc1F ZINC000862396813 637356096 /nfs/dbraw/zinc/35/60/96/637356096.db2.gz ZVSYHHKBEJHONM-UHFFFAOYSA-N 0 3 286.366 2.889 20 10 CFCDHN COC(=O)c1cc(CNCc2cc(C)ccc2O)c(C)o1 ZINC000862478781 637396581 /nfs/dbraw/zinc/39/65/81/637396581.db2.gz QEXSGNZWEOSLNZ-UHFFFAOYSA-N 0 3 289.331 2.678 20 10 CFCDHN CC[C@@H]1[NH2+]CC[C@H]1NCc1c([O-])cc(C)cc1Cl ZINC000863646850 637723433 /nfs/dbraw/zinc/72/34/33/637723433.db2.gz QDCJPTPFAAIFSS-QWHCGFSZSA-N 0 3 268.788 2.584 20 10 CFCDHN CC[C@@]1(C)CN(Cc2cc3c(cc2O)CCC3)CCO1 ZINC000190333773 650427396 /nfs/dbraw/zinc/42/73/96/650427396.db2.gz BYSKXDDHYFEZGY-KRWDZBQOSA-N 0 3 275.392 2.882 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2[C@@H]3OC[C@H]4C[C@H]2C[C@H]34)c([O-])c1 ZINC000866444013 638822407 /nfs/dbraw/zinc/82/24/07/638822407.db2.gz BRBCKQRAPBBDFP-WEDSCMKFSA-N 0 3 273.376 2.775 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)[C@H](O)C(F)(F)F)c1ccccc1[O-] ZINC000866464901 638825534 /nfs/dbraw/zinc/82/55/34/638825534.db2.gz ZSNCOYDWBSDTKP-PEXQALLHSA-N 0 3 277.286 2.745 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CC2(CO1)CCOCC2)c1ccccc1[O-] ZINC000866530863 638836658 /nfs/dbraw/zinc/83/66/58/638836658.db2.gz BRMNMLVSOYSIHL-KBPBESRZSA-N 0 3 291.391 2.629 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](C)c2ccnn2C)c1 ZINC000866614172 638854677 /nfs/dbraw/zinc/85/46/77/638854677.db2.gz LJUSCWSJBJPGBI-MNOVXSKESA-N 0 3 275.352 2.546 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCn2nccc21)c1ccccc1[O-] ZINC000866631695 638857730 /nfs/dbraw/zinc/85/77/30/638857730.db2.gz CWRKZGVLHZFARO-YPMHNXCESA-N 0 3 257.337 2.774 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2O)c2c1c(F)ccc2[O-] ZINC000866639646 638859994 /nfs/dbraw/zinc/85/99/94/638859994.db2.gz VFLMTYAUSGJZHW-SQNXGDPESA-N 0 3 279.355 2.973 20 10 CFCDHN C[C@H](NC(=O)C[C@H]1NCc2ccccc21)c1ccccc1O ZINC000870988780 641139312 /nfs/dbraw/zinc/13/93/12/641139312.db2.gz ZJOPKCDIQXQUAC-BLLLJJGKSA-N 0 3 296.370 2.804 20 10 CFCDHN C[C@@H](NC(=O)C[C@@H]1NCc2ccccc21)c1ccccc1O ZINC000870988783 641139599 /nfs/dbraw/zinc/13/95/99/641139599.db2.gz ZJOPKCDIQXQUAC-WBMJQRKESA-N 0 3 296.370 2.804 20 10 CFCDHN CCCOc1ccc(CNC(COC)COC)cc1C ZINC000873130326 642021950 /nfs/dbraw/zinc/02/19/50/642021950.db2.gz BENMIBHJRFTADQ-UHFFFAOYSA-N 0 3 281.396 2.535 20 10 CFCDHN CCOC(=O)[C@]1(C(C)C)CC[N@H+](Cc2ccccc2[O-])C1 ZINC000195196100 650740991 /nfs/dbraw/zinc/74/09/91/650740991.db2.gz LZHXSEYRLGLMMF-QGZVFWFLSA-N 0 3 291.391 2.803 20 10 CFCDHN CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000195196100 650740993 /nfs/dbraw/zinc/74/09/93/650740993.db2.gz LZHXSEYRLGLMMF-QGZVFWFLSA-N 0 3 291.391 2.803 20 10 CFCDHN C[C@@H]([NH2+]CC1(CO)CCCCC1)c1ccccc1[O-] ZINC000125485665 642648876 /nfs/dbraw/zinc/64/88/76/642648876.db2.gz CIVZQAKIRCZDDF-CYBMUJFWSA-N 0 3 263.381 2.986 20 10 CFCDHN Cc1ccc(C[N@H+](CCO)C2CCCCC2)c([O-])c1 ZINC000876511616 642899513 /nfs/dbraw/zinc/89/95/13/642899513.db2.gz PCENQRZJLHAUOP-UHFFFAOYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@@H+](CCO)C2CCCCC2)c([O-])c1 ZINC000876511616 642899520 /nfs/dbraw/zinc/89/95/20/642899520.db2.gz PCENQRZJLHAUOP-UHFFFAOYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000876619241 642947792 /nfs/dbraw/zinc/94/77/92/642947792.db2.gz RGNFWLGHXFLXPH-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000876619241 642947796 /nfs/dbraw/zinc/94/77/96/642947796.db2.gz RGNFWLGHXFLXPH-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c([O-])c1 ZINC000876627361 642950511 /nfs/dbraw/zinc/95/05/11/642950511.db2.gz RCMGPBFDNFNOPH-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)c([O-])c1 ZINC000876627361 642950514 /nfs/dbraw/zinc/95/05/14/642950514.db2.gz RCMGPBFDNFNOPH-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[NH+]2CCC(n3ccnc3)CC2)c([O-])c1 ZINC000876650304 642958711 /nfs/dbraw/zinc/95/87/11/642958711.db2.gz ASRBKQUYZBGQRN-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](CCO)CCc1ccccc1 ZINC000876735833 642986669 /nfs/dbraw/zinc/98/66/69/642986669.db2.gz ILJLYXLBHZGDSQ-UHFFFAOYSA-N 0 3 285.387 2.738 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](CCO)CCc1ccccc1 ZINC000876735833 642986673 /nfs/dbraw/zinc/98/66/73/642986673.db2.gz ILJLYXLBHZGDSQ-UHFFFAOYSA-N 0 3 285.387 2.738 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2ccc(C)cc2[O-])CC1 ZINC000876760297 642998383 /nfs/dbraw/zinc/99/83/83/642998383.db2.gz PRZXIHUFWUJTCX-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876812228 643020022 /nfs/dbraw/zinc/02/00/22/643020022.db2.gz SJEKHVAZRNUNNE-HOCLYGCPSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c([O-])c1 ZINC000876812228 643020033 /nfs/dbraw/zinc/02/00/33/643020033.db2.gz SJEKHVAZRNUNNE-HOCLYGCPSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1ccc(C[NH2+]CCN2Cc3ccccc3C2)c([O-])c1 ZINC000876917052 643064688 /nfs/dbraw/zinc/06/46/88/643064688.db2.gz AAWYKFVCKROXOF-UHFFFAOYSA-N 0 3 282.387 2.806 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000876959677 643082518 /nfs/dbraw/zinc/08/25/18/643082518.db2.gz MZRSJIFLGDDJAO-INIZCTEOSA-N 0 3 287.359 2.532 20 10 CFCDHN CCN1CCCC[C@H]1C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877036801 643114681 /nfs/dbraw/zinc/11/46/81/643114681.db2.gz IYRPIUSKIIFCHU-HNNXBMFYSA-N 0 3 262.397 2.665 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](C)c2ccncc2)c([O-])c1 ZINC000877076337 643138237 /nfs/dbraw/zinc/13/82/37/643138237.db2.gz VVGOYJSFGGCZAW-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN CC[S@](=O)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877077315 643138427 /nfs/dbraw/zinc/13/84/27/643138427.db2.gz CJOZAKSGIOBPCL-SIFCLUCFSA-N 0 3 295.448 2.870 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(C)CCCC[C@@H]2O)c([O-])c1 ZINC000877080667 643140391 /nfs/dbraw/zinc/14/03/91/643140391.db2.gz GJGDURHHSPHXBP-HOTGVXAUSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCOC2(CCOCC2)C1 ZINC000877093704 643149820 /nfs/dbraw/zinc/14/98/20/643149820.db2.gz CGVHZUWVTJTPFK-AWEZNQCLSA-N 0 3 291.391 2.518 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2CCOC3(CCOCC3)C2)c([O-])c1 ZINC000877096081 643150676 /nfs/dbraw/zinc/15/06/76/643150676.db2.gz XDTZOBPHUDTPTA-OAHLLOKOSA-N 0 3 291.391 2.518 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](C)[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000877115421 643159029 /nfs/dbraw/zinc/15/90/29/643159029.db2.gz FIQSYOKRHWGABO-YOEHRIQHSA-N 0 3 285.387 2.782 20 10 CFCDHN Cc1ccc(CN[C@H](C)c2n[nH]c(C(C)C)n2)c(O)c1 ZINC000877126856 643164701 /nfs/dbraw/zinc/16/47/01/643164701.db2.gz UQBDXELXRKEKRT-LLVKDONJSA-N 0 3 274.368 2.793 20 10 CFCDHN COc1ccc2c(c1)OC[C@@H]([NH2+]Cc1c(C)cccc1[O-])C2 ZINC000877129103 643166519 /nfs/dbraw/zinc/16/65/19/643166519.db2.gz YFKJYHHLDAGRJX-AWEZNQCLSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](C)C[C@H](O)c1ccco1 ZINC000877128316 643167211 /nfs/dbraw/zinc/16/72/11/643167211.db2.gz GBBWBZWBNAMVOR-WFASDCNBSA-N 0 3 275.348 2.895 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1COC2(CCCCC2)O1 ZINC000877137223 643171633 /nfs/dbraw/zinc/17/16/33/643171633.db2.gz STINSZOFADZSIO-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN CCC(CC)(C[NH2+]Cc1c(C)cccc1[O-])C(=O)OC ZINC000877175881 643190706 /nfs/dbraw/zinc/19/07/06/643190706.db2.gz LZXQBSRSBABVSH-UHFFFAOYSA-N 0 3 279.380 2.770 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCSC2(CCOCC2)C1 ZINC000877401551 643260617 /nfs/dbraw/zinc/26/06/17/643260617.db2.gz HYVVQJUNBWWQRS-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCSC2(CCOCC2)C1 ZINC000877401551 643260620 /nfs/dbraw/zinc/26/06/20/643260620.db2.gz HYVVQJUNBWWQRS-UHFFFAOYSA-N 0 3 293.432 2.799 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOCC(F)(F)C(F)F ZINC000877479060 643296163 /nfs/dbraw/zinc/29/61/63/643296163.db2.gz RAQCQTAMCDHEFX-UHFFFAOYSA-N 0 3 295.276 2.707 20 10 CFCDHN Cc1ccc(CN2C[C@@H](C)O[C@H](C3CC3)C2)c(O)c1 ZINC000877486096 643301363 /nfs/dbraw/zinc/30/13/63/643301363.db2.gz DRICSJPTDKZNBS-WBMJQRKESA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000877497637 643309952 /nfs/dbraw/zinc/30/99/52/643309952.db2.gz WAKIXKILNNOQMF-OAHLLOKOSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cccc([O-])c1C[NH+]1CC(C2CCOCC2)C1 ZINC000877500266 643311414 /nfs/dbraw/zinc/31/14/14/643311414.db2.gz QVBHJCPJNCBPIB-UHFFFAOYSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCCCC[C@H]2CCO)c([O-])c1 ZINC000877507154 643316805 /nfs/dbraw/zinc/31/68/05/643316805.db2.gz LPYRDRLVDJZAGU-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@H+]2CCCCC[C@H]2CCO)c([O-])c1 ZINC000877507154 643316809 /nfs/dbraw/zinc/31/68/09/643316809.db2.gz LPYRDRLVDJZAGU-HNNXBMFYSA-N 0 3 263.381 2.828 20 10 CFCDHN CCCC[C@@](C)(CO)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877605544 643392954 /nfs/dbraw/zinc/39/29/54/643392954.db2.gz DMWDIIIZRXPCOQ-HNNXBMFYSA-N 0 3 251.370 2.731 20 10 CFCDHN Cc1ccc(CN2CCO[C@](C)(C3CC3)C2)c(O)c1 ZINC000877622136 643409541 /nfs/dbraw/zinc/40/95/41/643409541.db2.gz GKSFEIGIIIWLFH-INIZCTEOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](OCc2ccccn2)C1 ZINC000877645376 643427958 /nfs/dbraw/zinc/42/79/58/643427958.db2.gz JOAGJQTZQABIEJ-INIZCTEOSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](OCc2ccccn2)C1 ZINC000877645376 643427963 /nfs/dbraw/zinc/42/79/63/643427963.db2.gz JOAGJQTZQABIEJ-INIZCTEOSA-N 0 3 298.386 2.887 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CCCN2CC(F)F)c([O-])c1 ZINC000877651850 643432238 /nfs/dbraw/zinc/43/22/38/643432238.db2.gz MLLJDEAGUWPBCH-ZDUSSCGKSA-N 0 3 284.350 2.520 20 10 CFCDHN CC(C)(C)OC(=O)[C@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])C1 ZINC000877719546 643483313 /nfs/dbraw/zinc/48/33/13/643483313.db2.gz CSCDWXDNURKQCP-GSJFWJNXSA-N 0 3 295.354 2.741 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000877728256 643489296 /nfs/dbraw/zinc/48/92/96/643489296.db2.gz MYVDPSZUPSDGPE-CYBMUJFWSA-N 0 3 279.355 2.828 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1c2ccccc2CN1C ZINC000877733682 643494233 /nfs/dbraw/zinc/49/42/33/643494233.db2.gz WNQQIMXGRDOUDM-QGZVFWFLSA-N 0 3 282.387 2.977 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1[O-] ZINC000877756446 643537265 /nfs/dbraw/zinc/53/72/65/643537265.db2.gz JBLTZIMWXCFATR-SNVBAGLBSA-N 0 3 287.315 2.677 20 10 CFCDHN CC(=O)c1nc(CC[NH2+][C@H](C)c2ccccc2[O-])[nH]c1C ZINC000879649384 644362491 /nfs/dbraw/zinc/36/24/91/644362491.db2.gz PMQYQXQZLMQKMZ-SNVBAGLBSA-N 0 3 287.363 2.520 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)CC1CCCC1)c1ccccc1[O-] ZINC000879648902 644363143 /nfs/dbraw/zinc/36/31/43/644363143.db2.gz FLGTWYSHQPSPBM-TZMCWYRMSA-N 0 3 263.381 2.984 20 10 CFCDHN CCC(CC)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879648722 644363400 /nfs/dbraw/zinc/36/34/00/644363400.db2.gz ASEGSISQJMQECV-VXGBXAGGSA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@@H]1COCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000025480329 645421156 /nfs/dbraw/zinc/42/11/56/645421156.db2.gz LHVIHMVDANSXNO-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@@H]1COCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000025480329 645421159 /nfs/dbraw/zinc/42/11/59/645421159.db2.gz LHVIHMVDANSXNO-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN C[C@@H]1COCCN1Cc1c(O)ccc2ccccc21 ZINC000025480329 645421162 /nfs/dbraw/zinc/42/11/62/645421162.db2.gz LHVIHMVDANSXNO-GFCCVEGCSA-N 0 3 257.333 2.766 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@]1(c2ccccc2)C[C@@H](O)C1 ZINC000883234445 645683823 /nfs/dbraw/zinc/68/38/23/645683823.db2.gz FPNLVFCENXKPEZ-WOVMCDHWSA-N 0 3 269.344 2.532 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000883243405 645691174 /nfs/dbraw/zinc/69/11/74/645691174.db2.gz KAZQOHYACBJGKH-GFCCVEGCSA-N 0 3 279.380 2.696 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](CO)Cc1ccoc1)c1ccccc1[O-] ZINC000883277475 645718598 /nfs/dbraw/zinc/71/85/98/645718598.db2.gz ZZVJYPBXINKGKY-HOCLYGCPSA-N 0 3 289.375 2.877 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CCN1CC)c1ccc(C)cc1[O-] ZINC000883354770 645759025 /nfs/dbraw/zinc/75/90/25/645759025.db2.gz BTOZLGAMTWVKIV-HIFRSBDPSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1n[nH]c(CNCc2ccc3c(c2)CCCN3C)c1C ZINC000885953956 646781000 /nfs/dbraw/zinc/78/10/00/646781000.db2.gz KCUWEQFNJLDQLF-UHFFFAOYSA-N 0 3 284.407 2.699 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c([O-])c1 ZINC000136706446 646868194 /nfs/dbraw/zinc/86/81/94/646868194.db2.gz ULIWAFUVQVQKPB-CQSZACIVSA-N 0 3 291.391 2.982 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1c([O-])cccc1F ZINC000886505305 647021747 /nfs/dbraw/zinc/02/17/47/647021747.db2.gz UXRONUAFHXSIHZ-XQQFMLRXSA-N 0 3 278.371 2.809 20 10 CFCDHN C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1c([O-])cccc1F ZINC000886505305 647021749 /nfs/dbraw/zinc/02/17/49/647021749.db2.gz UXRONUAFHXSIHZ-XQQFMLRXSA-N 0 3 278.371 2.809 20 10 CFCDHN CC[C@@H](C)N(C)CC[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886520526 647026568 /nfs/dbraw/zinc/02/65/68/647026568.db2.gz GSSLYWNCMLKIHO-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@@H](C)[N@H+](C)CCN[C@H](C)c1c([O-])cccc1F ZINC000886520526 647026572 /nfs/dbraw/zinc/02/65/72/647026572.db2.gz GSSLYWNCMLKIHO-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[C@@H](C)[N@@H+](C)CCN[C@H](C)c1c([O-])cccc1F ZINC000886520526 647026576 /nfs/dbraw/zinc/02/65/76/647026576.db2.gz GSSLYWNCMLKIHO-VXGBXAGGSA-N 0 3 268.376 2.912 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@H]1CCCOC1 ZINC000886789509 647137805 /nfs/dbraw/zinc/13/78/05/647137805.db2.gz WJVNDMDMBTYNMI-XUJVJEKNSA-N 0 3 297.370 2.624 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](CO)Cc1c[nH]c2ccccc12 ZINC000221324469 647190012 /nfs/dbraw/zinc/19/00/12/647190012.db2.gz GNNRVGDNBATRRW-OAHLLOKOSA-N 0 3 296.370 2.567 20 10 CFCDHN CC1(C)CC2(CC([NH2+]Cc3ccccc3[O-])C2)CO1 ZINC000924902201 648068302 /nfs/dbraw/zinc/06/83/02/648068302.db2.gz NGFVMKYSOMBXCA-UHFFFAOYSA-N 0 3 261.365 2.830 20 10 CFCDHN CCOCCOCC[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000927087655 648705607 /nfs/dbraw/zinc/70/56/07/648705607.db2.gz PKEAAKHYMLHIND-HNNXBMFYSA-N 0 3 281.396 2.794 20 10 CFCDHN COC[C@@H](C[NH2+][C@H](C)c1ccccc1[O-])C(C)C ZINC000927096811 648710239 /nfs/dbraw/zinc/71/02/39/648710239.db2.gz HSAXZGWPNXRBIP-CHWSQXEVSA-N 0 3 251.370 2.961 20 10 CFCDHN C[C@H](C[C@H](O)c1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000305759933 651075542 /nfs/dbraw/zinc/07/55/42/651075542.db2.gz YBKLECAPRWOMJJ-RISCZKNCSA-N 0 3 261.321 2.587 20 10 CFCDHN CN1CCC[C@@H]2C[N@H+](Cc3c([O-])cccc3Cl)C[C@H]21 ZINC001140341969 770530297 /nfs/dbraw/zinc/53/02/97/770530297.db2.gz NMFIMSCVEAGYLE-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CCC[C@@H]2C[N@@H+](Cc3c([O-])cccc3Cl)C[C@H]21 ZINC001140341969 770530300 /nfs/dbraw/zinc/53/03/00/770530300.db2.gz NMFIMSCVEAGYLE-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CC[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1CCCOC1 ZINC000402710124 770554522 /nfs/dbraw/zinc/55/45/22/770554522.db2.gz RVKPZUGNRRVEEO-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CC[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1CCCOC1 ZINC000402710124 770554528 /nfs/dbraw/zinc/55/45/28/770554528.db2.gz RVKPZUGNRRVEEO-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](C1CC1)[C@H]1CCCOC1 ZINC000723977262 770730831 /nfs/dbraw/zinc/73/08/31/770730831.db2.gz KIKUWHSLYRWQQK-GOEBONIOSA-N 0 3 261.365 2.687 20 10 CFCDHN COc1ccc(C[NH2+]CCc2ccc(F)cc2)c([O-])c1 ZINC000040905658 775218405 /nfs/dbraw/zinc/21/84/05/775218405.db2.gz NRBFAOMZHIYILJ-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccccn1 ZINC000692769293 776152450 /nfs/dbraw/zinc/15/24/50/776152450.db2.gz PLRXILGASKGQGN-LLVKDONJSA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1O ZINC001231587902 777268611 /nfs/dbraw/zinc/26/86/11/777268611.db2.gz IVHCHKJDPFBLMP-SJKOYZFVSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1O ZINC001231587902 777268617 /nfs/dbraw/zinc/26/86/17/777268617.db2.gz IVHCHKJDPFBLMP-SJKOYZFVSA-N 0 3 271.360 2.748 20 10 CFCDHN C[N@@H+](Cc1c([O-])ccc2ccccc21)CC1COC1 ZINC001231590253 777268829 /nfs/dbraw/zinc/26/88/29/777268829.db2.gz OMELOFCCLBGDAC-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN C[N@H+](Cc1c([O-])ccc2ccccc21)CC1COC1 ZINC001231590253 777268836 /nfs/dbraw/zinc/26/88/36/777268836.db2.gz OMELOFCCLBGDAC-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN CC(=O)N1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C ZINC001231590875 777270644 /nfs/dbraw/zinc/27/06/44/777270644.db2.gz OYSUKVVIRRQVRS-CYBMUJFWSA-N 0 3 298.386 2.598 20 10 CFCDHN CC(=O)N1CC[N@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C ZINC001231590875 777270652 /nfs/dbraw/zinc/27/06/52/777270652.db2.gz OYSUKVVIRRQVRS-CYBMUJFWSA-N 0 3 298.386 2.598 20 10 CFCDHN Cc1cccc(CN2CCc3ccncc3C2)c1O ZINC001231593418 777272761 /nfs/dbraw/zinc/27/27/61/777272761.db2.gz XHTPQDSVYDEGHT-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN C[N@H+](Cc1cc2ccncc2[nH]1)Cc1ccccc1[O-] ZINC001232095592 777438336 /nfs/dbraw/zinc/43/83/36/777438336.db2.gz LFQKLSXREFDDRS-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1cc2ccncc2[nH]1)Cc1ccccc1[O-] ZINC001232095592 777438345 /nfs/dbraw/zinc/43/83/45/777438345.db2.gz LFQKLSXREFDDRS-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[C@H]1CCC[C@H](C)N1Cc1cc(O)c(O)c(O)c1 ZINC001233009118 777762627 /nfs/dbraw/zinc/76/26/27/777762627.db2.gz KGUPKLHDQBHOHV-UWVGGRQHSA-N 0 3 251.326 2.566 20 10 CFCDHN Oc1cc(CN2CCCC3(CC(F)C3)CC2)cc(O)c1O ZINC001233017131 777766576 /nfs/dbraw/zinc/76/65/76/777766576.db2.gz SGHTYJUBBSUTFM-UHFFFAOYSA-N 0 3 295.354 2.908 20 10 CFCDHN Cc1ccccc1CN(C)Cc1cc(O)c(O)cc1O ZINC001233484929 777963147 /nfs/dbraw/zinc/96/31/47/777963147.db2.gz CITSRVUPHSUZLI-UHFFFAOYSA-N 0 3 273.332 2.744 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@@H](C(C)=O)C3)c2c1 ZINC001234570414 778255195 /nfs/dbraw/zinc/25/51/95/778255195.db2.gz ZPTPBRNRSSTGJU-CQSZACIVSA-N 0 3 299.370 2.965 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@@H](C(C)=O)C3)c2c1 ZINC001234570414 778255202 /nfs/dbraw/zinc/25/52/02/778255202.db2.gz ZPTPBRNRSSTGJU-CQSZACIVSA-N 0 3 299.370 2.965 20 10 CFCDHN CCN1CCN(c2ccc(O[C@H]3C=CCC3)cc2)CC1 ZINC001234661936 778281664 /nfs/dbraw/zinc/28/16/64/778281664.db2.gz XQOQEAUKJKHOOD-INIZCTEOSA-N 0 3 272.392 2.926 20 10 CFCDHN CN(Cc1ccc(C(F)(F)F)cc1[O-])[C@H]1CCC[NH2+]C1 ZINC001235347151 778464221 /nfs/dbraw/zinc/46/42/21/778464221.db2.gz MYSDBEQVADSKBW-LBPRGKRZSA-N 0 3 288.313 2.595 20 10 CFCDHN CO[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676009 778532678 /nfs/dbraw/zinc/53/26/78/778532678.db2.gz NPFRNOPMQWHUDT-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN CO[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C1 ZINC001235676009 778532682 /nfs/dbraw/zinc/53/26/82/778532682.db2.gz NPFRNOPMQWHUDT-AWEZNQCLSA-N 0 3 263.381 2.910 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@H]1O ZINC001235676858 778534253 /nfs/dbraw/zinc/53/42/53/778534253.db2.gz WSYVVIUKJBXKNM-MLGOLLRUSA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@H]1O ZINC001235676858 778534257 /nfs/dbraw/zinc/53/42/57/778534257.db2.gz WSYVVIUKJBXKNM-MLGOLLRUSA-N 0 3 277.408 2.892 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2C[C@@H]3CCO[C@@H]3C2)c([O-])c1 ZINC001235681133 778535548 /nfs/dbraw/zinc/53/55/48/778535548.db2.gz YSGILBCXTGQNRY-XJKSGUPXSA-N 0 3 275.392 2.910 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2C[C@@H]3CCO[C@@H]3C2)c([O-])c1 ZINC001235681133 778535553 /nfs/dbraw/zinc/53/55/53/778535553.db2.gz YSGILBCXTGQNRY-XJKSGUPXSA-N 0 3 275.392 2.910 20 10 CFCDHN CC(C)(C)c1ccc(CN2CCCC[C@H]2C(N)=O)c(O)c1 ZINC001235686111 778536989 /nfs/dbraw/zinc/53/69/89/778536989.db2.gz YCISPQGCZURRPX-AWEZNQCLSA-N 0 3 290.407 2.530 20 10 CFCDHN CCN(Cc1cc(Cl)c(C)cc1[O-])[C@H]1CCC[NH2+]C1 ZINC001236008065 778652984 /nfs/dbraw/zinc/65/29/84/778652984.db2.gz QHNXTDIUYYTCIK-ZDUSSCGKSA-N 0 3 282.815 2.928 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@]1(C)CCC[NH2+]C1 ZINC001236205334 778733984 /nfs/dbraw/zinc/73/39/84/778733984.db2.gz DLLNYWBYIGXNHI-CQSZACIVSA-N 0 3 268.788 2.620 20 10 CFCDHN CN(Cc1cc(F)c(Cl)cc1[O-])[C@@H]1CCCC[C@H]1[NH3+] ZINC001236217009 778741336 /nfs/dbraw/zinc/74/13/36/778741336.db2.gz MQJUNJCKANWKHX-CHWSQXEVSA-N 0 3 286.778 2.886 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@H]3C[NH2+]C[C@@H]32)cc1Cl ZINC001236285658 778760958 /nfs/dbraw/zinc/76/09/58/778760958.db2.gz BDMLGWKTHZQWMQ-RISCZKNCSA-N 0 3 294.826 2.747 20 10 CFCDHN Cc1cc([O-])c(CN(C(C)C)[C@H]2CC[NH2+]C2)cc1Cl ZINC001236531151 778865076 /nfs/dbraw/zinc/86/50/76/778865076.db2.gz VNRBANLQSOORSM-ZDUSSCGKSA-N 0 3 282.815 2.926 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236782383 778933845 /nfs/dbraw/zinc/93/38/45/778933845.db2.gz ATZDCZZGTQSGJL-WBVHZDCISA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([O-])c1 ZINC001236782383 778933849 /nfs/dbraw/zinc/93/38/49/778933849.db2.gz ATZDCZZGTQSGJL-WBVHZDCISA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001236784735 778935346 /nfs/dbraw/zinc/93/53/46/778935346.db2.gz ZSAQQIFJCJAJBH-QGZVFWFLSA-N 0 3 277.408 2.939 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@](C)(CO)CC2)c([O-])c1 ZINC001236784735 778935351 /nfs/dbraw/zinc/93/53/51/778935351.db2.gz ZSAQQIFJCJAJBH-QGZVFWFLSA-N 0 3 277.408 2.939 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784018 778936030 /nfs/dbraw/zinc/93/60/30/778936030.db2.gz RDHLVZXYIPCKBT-DYVFJYSZSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](C)(O)[C@H](C)C2)c([O-])c1 ZINC001236784018 778936036 /nfs/dbraw/zinc/93/60/36/778936036.db2.gz RDHLVZXYIPCKBT-DYVFJYSZSA-N 0 3 277.408 2.938 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236786940 778937142 /nfs/dbraw/zinc/93/71/42/778937142.db2.gz SLLUFHXFEDYFBV-PBHICJAKSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c([O-])c1 ZINC001236786940 778937149 /nfs/dbraw/zinc/93/71/49/778937149.db2.gz SLLUFHXFEDYFBV-PBHICJAKSA-N 0 3 275.392 2.956 20 10 CFCDHN CCc1ccc(C[N@H+](CCCO)C(C)C)c([O-])c1 ZINC001236794812 778941650 /nfs/dbraw/zinc/94/16/50/778941650.db2.gz PEUAWLBBHHCJML-UHFFFAOYSA-N 0 3 251.370 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+](CCCO)C(C)C)c([O-])c1 ZINC001236794812 778941656 /nfs/dbraw/zinc/94/16/56/778941656.db2.gz PEUAWLBBHHCJML-UHFFFAOYSA-N 0 3 251.370 2.547 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236807227 778947282 /nfs/dbraw/zinc/94/72/82/778947282.db2.gz DTXYVWHVQBGTSC-GUYCJALGSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236807227 778947283 /nfs/dbraw/zinc/94/72/83/778947283.db2.gz DTXYVWHVQBGTSC-GUYCJALGSA-N 0 3 293.407 2.692 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c([O-])c1 ZINC001236810837 778948733 /nfs/dbraw/zinc/94/87/33/778948733.db2.gz KDBFMQODUPUAJT-AWEZNQCLSA-N 0 3 283.318 2.940 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c([O-])c1 ZINC001236810837 778948737 /nfs/dbraw/zinc/94/87/37/778948737.db2.gz KDBFMQODUPUAJT-AWEZNQCLSA-N 0 3 283.318 2.940 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236816815 778950184 /nfs/dbraw/zinc/95/01/84/778950184.db2.gz YCPCVMXCUIXIOK-QWHCGFSZSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c([O-])c1 ZINC001236816815 778950186 /nfs/dbraw/zinc/95/01/86/778950186.db2.gz YCPCVMXCUIXIOK-QWHCGFSZSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC001236816814 778950652 /nfs/dbraw/zinc/95/06/52/778950652.db2.gz YCPCVMXCUIXIOK-OLZOCXBDSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC001236816814 778950655 /nfs/dbraw/zinc/95/06/55/778950655.db2.gz YCPCVMXCUIXIOK-OLZOCXBDSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001236817084 778951877 /nfs/dbraw/zinc/95/18/77/778951877.db2.gz BOYRSCITFPSODF-ZDUSSCGKSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@H](OC(C)C)C2)c([O-])c1 ZINC001236817084 778951880 /nfs/dbraw/zinc/95/18/80/778951880.db2.gz BOYRSCITFPSODF-ZDUSSCGKSA-N 0 3 279.380 2.709 20 10 CFCDHN CC[N@H+](Cc1cc2ccccc2cc1[O-])C1CN(C)C1 ZINC001236836394 778960894 /nfs/dbraw/zinc/96/08/94/778960894.db2.gz HWIBXOHLJUIKEQ-UHFFFAOYSA-N 0 3 270.376 2.681 20 10 CFCDHN CC[N@@H+](Cc1cc2ccccc2cc1[O-])C1CN(C)C1 ZINC001236836394 778960899 /nfs/dbraw/zinc/96/08/99/778960899.db2.gz HWIBXOHLJUIKEQ-UHFFFAOYSA-N 0 3 270.376 2.681 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c([O-])c1 ZINC001237041911 778996014 /nfs/dbraw/zinc/99/60/14/778996014.db2.gz PVLJROMHKKIRAM-SGMGOOAPSA-N 0 3 265.328 2.723 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c([O-])c1 ZINC001237041911 778996017 /nfs/dbraw/zinc/99/60/17/778996017.db2.gz PVLJROMHKKIRAM-SGMGOOAPSA-N 0 3 265.328 2.723 20 10 CFCDHN COC[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044967 778997235 /nfs/dbraw/zinc/99/72/35/778997235.db2.gz GGYUULYUQVRLPZ-CYBMUJFWSA-N 0 3 263.381 2.984 20 10 CFCDHN COC[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044967 778997236 /nfs/dbraw/zinc/99/72/36/778997236.db2.gz GGYUULYUQVRLPZ-CYBMUJFWSA-N 0 3 263.381 2.984 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237045865 778997566 /nfs/dbraw/zinc/99/75/66/778997566.db2.gz MBJWOUYJEIMJBT-AWEZNQCLSA-N 0 3 277.364 2.511 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237045865 778997571 /nfs/dbraw/zinc/99/75/71/778997571.db2.gz MBJWOUYJEIMJBT-AWEZNQCLSA-N 0 3 277.364 2.511 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@](C)(CF)C2)c([O-])c1 ZINC001237046303 778999238 /nfs/dbraw/zinc/99/92/38/778999238.db2.gz ACZGBPTZJPTMRF-HNNXBMFYSA-N 0 3 267.344 2.972 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@](C)(CF)C2)c([O-])c1 ZINC001237046303 778999240 /nfs/dbraw/zinc/99/92/40/778999240.db2.gz ACZGBPTZJPTMRF-HNNXBMFYSA-N 0 3 267.344 2.972 20 10 CFCDHN CC[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237051771 779000804 /nfs/dbraw/zinc/00/08/04/779000804.db2.gz QIGQDKGUESUXHA-UHFFFAOYSA-N 0 3 263.259 2.785 20 10 CFCDHN CC[N@@H+](C)Cc1ccc(OCC(F)(F)F)cc1[O-] ZINC001237051771 779000810 /nfs/dbraw/zinc/00/08/10/779000810.db2.gz QIGQDKGUESUXHA-UHFFFAOYSA-N 0 3 263.259 2.785 20 10 CFCDHN COC(=O)[C@H]1C[N@H+](Cc2ccc(C(C)C)cc2[O-])C[C@@H]1C ZINC001237051121 779000908 /nfs/dbraw/zinc/00/09/08/779000908.db2.gz HQMHMBMJQPEUKJ-WFASDCNBSA-N 0 3 291.391 2.757 20 10 CFCDHN COC(=O)[C@H]1C[N@@H+](Cc2ccc(C(C)C)cc2[O-])C[C@@H]1C ZINC001237051121 779000913 /nfs/dbraw/zinc/00/09/13/779000913.db2.gz HQMHMBMJQPEUKJ-WFASDCNBSA-N 0 3 291.391 2.757 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCc3nccn3CC2)c([O-])c1 ZINC001237049774 779001009 /nfs/dbraw/zinc/00/10/09/779001009.db2.gz SZUCVEHNHAEOLR-UHFFFAOYSA-N 0 3 285.391 2.770 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCc3nccn3CC2)c([O-])c1 ZINC001237049774 779001016 /nfs/dbraw/zinc/00/10/16/779001016.db2.gz SZUCVEHNHAEOLR-UHFFFAOYSA-N 0 3 285.391 2.770 20 10 CFCDHN C[C@@H]1COCC[N@H+](Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122771 779012210 /nfs/dbraw/zinc/01/22/10/779012210.db2.gz YMWRVUXFRUNVPF-VIFPVBQESA-N 0 3 273.735 2.653 20 10 CFCDHN C[C@@H]1COCC[N@@H+](Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122771 779012214 /nfs/dbraw/zinc/01/22/14/779012214.db2.gz YMWRVUXFRUNVPF-VIFPVBQESA-N 0 3 273.735 2.653 20 10 CFCDHN C[C@H]1C[C@@H](O)CCN1Cc1cc(C(F)(F)F)ccc1O ZINC001237141344 779024621 /nfs/dbraw/zinc/02/46/21/779024621.db2.gz VZGVYCUYPKTLBP-CABZTGNLSA-N 0 3 289.297 2.756 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2cnccc2C1 ZINC001237484029 779117784 /nfs/dbraw/zinc/11/77/84/779117784.db2.gz ZNMVDYDYDRDFNW-UHFFFAOYSA-N 0 3 254.333 2.654 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC001237491666 779119856 /nfs/dbraw/zinc/11/98/56/779119856.db2.gz LYHRETJABMXKSX-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC001237491666 779119859 /nfs/dbraw/zinc/11/98/59/779119859.db2.gz LYHRETJABMXKSX-HNNXBMFYSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@@](F)(CO)CC2)c1[O-] ZINC001238060246 779242938 /nfs/dbraw/zinc/24/29/38/779242938.db2.gz GRWJTSKHEHRJBB-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@@](F)(CO)CC2)c1[O-] ZINC001238060246 779242941 /nfs/dbraw/zinc/24/29/41/779242941.db2.gz GRWJTSKHEHRJBB-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN COC(=O)CC1CC[NH+](Cc2cc(F)cc(C)c2[O-])CC1 ZINC001238064138 779243121 /nfs/dbraw/zinc/24/31/21/779243121.db2.gz OOFILHCWLBONCK-UHFFFAOYSA-N 0 3 295.354 2.615 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@H](C)C1 ZINC001238065840 779243934 /nfs/dbraw/zinc/24/39/34/779243934.db2.gz FQDLTDXBRXLHPR-BXUZGUMPSA-N 0 3 267.344 2.839 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@H](C)C1 ZINC001238065840 779243936 /nfs/dbraw/zinc/24/39/36/779243936.db2.gz FQDLTDXBRXLHPR-BXUZGUMPSA-N 0 3 267.344 2.839 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236213664 779501038 /nfs/dbraw/zinc/50/10/38/779501038.db2.gz AVPKNTHIBARGDD-CHWSQXEVSA-N 0 3 268.788 2.747 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC001236786666 779637885 /nfs/dbraw/zinc/63/78/85/779637885.db2.gz DPEPVJGIZOXFEB-IUODEOHRSA-N 0 3 263.381 2.954 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC001236786666 779637888 /nfs/dbraw/zinc/63/78/88/779637888.db2.gz DPEPVJGIZOXFEB-IUODEOHRSA-N 0 3 263.381 2.954 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237052281 779660726 /nfs/dbraw/zinc/66/07/26/779660726.db2.gz SVCIPQUCDWNVCS-GASCZTMLSA-N 0 3 261.365 2.594 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c([O-])c1 ZINC001237052281 779660733 /nfs/dbraw/zinc/66/07/33/779660733.db2.gz SVCIPQUCDWNVCS-GASCZTMLSA-N 0 3 261.365 2.594 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CO[C@@H](C3CC3)C1)CC2 ZINC000700989370 780745363 /nfs/dbraw/zinc/74/53/63/780745363.db2.gz DLBBCGIKTRWDRQ-UMVBOHGHSA-N 0 3 259.349 2.537 20 10 CFCDHN CN1CCC=C(c2ccn(Cc3ccccc3)c(=O)c2)C1 ZINC001241571648 780988235 /nfs/dbraw/zinc/98/82/35/780988235.db2.gz BTSSXRPAERYUDS-UHFFFAOYSA-N 0 3 280.371 2.616 20 10 CFCDHN Cc1ncccc1CNCc1ccc2c(c1)CCO2 ZINC000707832497 781264249 /nfs/dbraw/zinc/26/42/49/781264249.db2.gz IJMKCXYPIOIIRM-UHFFFAOYSA-N 0 3 254.333 2.615 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000709847487 781320751 /nfs/dbraw/zinc/32/07/51/781320751.db2.gz ADHXKCQGMFMWJV-OAHLLOKOSA-N 0 3 280.799 2.621 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1COC3(CCC3)C1)CC2 ZINC000711104173 781357819 /nfs/dbraw/zinc/35/78/19/781357819.db2.gz FOZUNGCKOCCSJM-QWHCGFSZSA-N 0 3 259.349 2.681 20 10 CFCDHN COC(C)(C)CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000711884847 781485435 /nfs/dbraw/zinc/48/54/35/781485435.db2.gz ACKHTMDBWLHHND-SNVBAGLBSA-N 0 3 255.333 2.997 20 10 CFCDHN CN(C)c1ccc(CN2CCC(c3cnccn3)CC2)cc1 ZINC000367015065 529780247 /nfs/dbraw/zinc/78/02/47/529780247.db2.gz IBFWLGAIHCSMTJ-UHFFFAOYSA-N 0 3 296.418 2.922 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](CC)c1ccccc1[O-])C(C)(C)O ZINC000295063148 199325111 /nfs/dbraw/zinc/32/51/11/199325111.db2.gz RKAJNZKSQVTYRA-GXTWGEPZSA-N 0 3 251.370 2.982 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](O)Cc2cccc(F)c2)c1[O-] ZINC000295088222 199339000 /nfs/dbraw/zinc/33/90/00/199339000.db2.gz IZSNNFPUCHVMRV-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN CCn1nc(C)c(CNCc2cccc(OC)c2O)c1C ZINC000066995398 346787853 /nfs/dbraw/zinc/78/78/53/346787853.db2.gz LWYGBPUGZVLBCP-UHFFFAOYSA-N 0 3 289.379 2.524 20 10 CFCDHN COc1cccc(C[N@H+](CCCO)CC(C)(C)C)c1[O-] ZINC000093146247 347663229 /nfs/dbraw/zinc/66/32/29/347663229.db2.gz ZIDFUUDFDUOGBV-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN COc1cccc(C[N@@H+](CCCO)CC(C)(C)C)c1[O-] ZINC000093146247 347663231 /nfs/dbraw/zinc/66/32/31/347663231.db2.gz ZIDFUUDFDUOGBV-UHFFFAOYSA-N 0 3 281.396 2.631 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c1 ZINC000093483140 347677936 /nfs/dbraw/zinc/67/79/36/347677936.db2.gz MDLLLOUGMBYASM-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c1 ZINC000093483140 347677940 /nfs/dbraw/zinc/67/79/40/347677940.db2.gz MDLLLOUGMBYASM-OCCSQVGLSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000093866176 347686268 /nfs/dbraw/zinc/68/62/68/347686268.db2.gz QXGVAPTWXQGAMD-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000093866176 347686270 /nfs/dbraw/zinc/68/62/70/347686270.db2.gz QXGVAPTWXQGAMD-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN CN(C)CCN(C(=O)/C=C/c1cccnc1)c1ccccc1 ZINC000491323314 348627302 /nfs/dbraw/zinc/62/73/02/348627302.db2.gz ZCJXWLCWFZSGGZ-ZHACJKMWSA-N 0 3 295.386 2.690 20 10 CFCDHN COCC1=CCN(Cc2ccc(N(C)C)c(C)c2)CC1 ZINC000294757087 199168893 /nfs/dbraw/zinc/16/88/93/199168893.db2.gz YCEAQSWRMDDWHZ-UHFFFAOYSA-N 0 3 274.408 2.840 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)CCCCO)c1ccccc1[O-] ZINC000294933664 199258612 /nfs/dbraw/zinc/25/86/12/199258612.db2.gz BSVVLRGNKPOVBE-TZMCWYRMSA-N 0 3 251.370 2.984 20 10 CFCDHN C[C@](O)(C[NH2+][C@@H]1CCc2cccc([O-])c21)c1cccs1 ZINC000297549152 200225329 /nfs/dbraw/zinc/22/53/29/200225329.db2.gz FLMUSOVAXVBPNI-WBMJQRKESA-N 0 3 289.400 2.938 20 10 CFCDHN COc1ccccc1N(C)C(=O)c1cccc2c1CCNC2 ZINC000317568224 541219205 /nfs/dbraw/zinc/21/92/05/541219205.db2.gz BVXUCGXHNJCWGQ-UHFFFAOYSA-N 0 3 296.370 2.618 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]Cc2ccc(C)cc2)c1 ZINC000020092207 372228678 /nfs/dbraw/zinc/22/86/78/372228678.db2.gz RWRISYMUMJUHMK-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cn2cccn2)c([O-])c1 ZINC000037154471 372657785 /nfs/dbraw/zinc/65/77/85/372657785.db2.gz FZTXLAKBRYVUIW-STQMWFEESA-N 0 3 259.353 2.636 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000038013869 372768014 /nfs/dbraw/zinc/76/80/14/372768014.db2.gz QTYUKHKMTPEAMA-CHWSQXEVSA-N 0 3 278.396 2.656 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000038013868 372769180 /nfs/dbraw/zinc/76/91/80/372769180.db2.gz QTYUKHKMTPEAMA-STQMWFEESA-N 0 3 278.396 2.656 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]C1CCCCCC1)OCO2 ZINC000042879398 372963750 /nfs/dbraw/zinc/96/37/50/372963750.db2.gz DWGYJDBJLDTESD-UHFFFAOYSA-N 0 3 263.337 2.933 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCc1cccs1)OCO2 ZINC000042879279 372964771 /nfs/dbraw/zinc/96/47/71/372964771.db2.gz YLNURUHYVBRTEG-UHFFFAOYSA-N 0 3 277.345 2.515 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2C[C@](C)(OC)C2(C)C)c1 ZINC000089726199 374942045 /nfs/dbraw/zinc/94/20/45/374942045.db2.gz AAZWRXRVWCBXMG-ZBFHGGJFSA-N 0 3 279.380 2.694 20 10 CFCDHN Cc1c(CN[C@@H](C)c2ccc(N(C)C)cc2)cnn1C ZINC000090887972 375034658 /nfs/dbraw/zinc/03/46/58/375034658.db2.gz JCNIVVVIAWNVST-LBPRGKRZSA-N 0 3 272.396 2.645 20 10 CFCDHN CCn1nc(C)c(CN(C)Cc2ccccc2O)c1C ZINC000091956728 375073724 /nfs/dbraw/zinc/07/37/24/375073724.db2.gz NRRWJMYGTHWBND-UHFFFAOYSA-N 0 3 273.380 2.857 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@H](COC)C2)c1 ZINC000093338034 375214730 /nfs/dbraw/zinc/21/47/30/375214730.db2.gz WEKRQGBYWDCJIZ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@H](COC)C2)c1 ZINC000093338034 375214734 /nfs/dbraw/zinc/21/47/34/375214734.db2.gz WEKRQGBYWDCJIZ-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000112017195 375877744 /nfs/dbraw/zinc/87/77/44/375877744.db2.gz FUTNSQFPRSRGDW-UONOGXRCSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000112017195 375877749 /nfs/dbraw/zinc/87/77/49/375877749.db2.gz FUTNSQFPRSRGDW-UONOGXRCSA-N 0 3 280.799 2.762 20 10 CFCDHN CS[C@H]1CCC[C@@H]([NH2+]Cc2cc3c(cc2[O-])OCO3)C1 ZINC000117394450 376241340 /nfs/dbraw/zinc/24/13/40/376241340.db2.gz RCACWVLSQUYYDH-NEPJUHHUSA-N 0 3 295.404 2.885 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cnn(C)c1 ZINC000122931888 376942234 /nfs/dbraw/zinc/94/22/34/376942234.db2.gz GIOYYIZLKCSYBM-CYBMUJFWSA-N 0 3 284.407 2.653 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC(=O)N2CCCCC2)c([O-])c1 ZINC000123723307 376971113 /nfs/dbraw/zinc/97/11/13/376971113.db2.gz BVZPQKYMQFCHLH-AWEZNQCLSA-N 0 3 290.407 2.754 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@@H](CC(C)C)N(C)C)c1[O-] ZINC000124693981 377078250 /nfs/dbraw/zinc/07/82/50/377078250.db2.gz GLBOWPCNSKPQMB-OAHLLOKOSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCn2cccn2)c1 ZINC000126318863 377221208 /nfs/dbraw/zinc/22/12/08/377221208.db2.gz SBCILRQRVZGMCU-ZDUSSCGKSA-N 0 3 259.353 2.638 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H]3OCCC[C@@H]3C2)cc1F ZINC000128105196 377317955 /nfs/dbraw/zinc/31/79/55/377317955.db2.gz QSCPEVSLPSRILE-PBHICJAKSA-N 0 3 292.398 2.893 20 10 CFCDHN C[C@@H](O)C[C@@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000127706588 377298359 /nfs/dbraw/zinc/29/83/59/377298359.db2.gz VFGBZKZZPXOBAN-OCCSQVGLSA-N 0 3 280.387 2.627 20 10 CFCDHN CO[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 ZINC000130263793 377530230 /nfs/dbraw/zinc/53/02/30/377530230.db2.gz OQBOGLWMBCLVKO-CYBMUJFWSA-N 0 3 266.360 2.503 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H](CO)Cc2ccccc2)cc1C ZINC000131518368 377722903 /nfs/dbraw/zinc/72/29/03/377722903.db2.gz NMPLAQFGSPOGRH-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN CCCOc1ccc(C[N@H+](C)[C@@H](C)COC)c([O-])c1 ZINC000132685041 377867285 /nfs/dbraw/zinc/86/72/85/377867285.db2.gz LZLWSDOJRRTEOK-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+](C)[C@@H](C)COC)c([O-])c1 ZINC000132685041 377867292 /nfs/dbraw/zinc/86/72/92/377867292.db2.gz LZLWSDOJRRTEOK-LBPRGKRZSA-N 0 3 267.369 2.648 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCCO[C@H](C)C2)c([O-])c1 ZINC000134162869 377989232 /nfs/dbraw/zinc/98/92/32/377989232.db2.gz WXYFDGASZJYRPV-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCCO[C@H](C)C2)c([O-])c1 ZINC000134162869 377989238 /nfs/dbraw/zinc/98/92/38/377989238.db2.gz WXYFDGASZJYRPV-CYBMUJFWSA-N 0 3 279.380 2.792 20 10 CFCDHN C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)NC(C)(C)C ZINC000135138726 378089865 /nfs/dbraw/zinc/08/98/65/378089865.db2.gz ZHDGPGLAYHYNHO-CHWSQXEVSA-N 0 3 291.439 2.706 20 10 CFCDHN CCOCCO[C@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000138482268 378232248 /nfs/dbraw/zinc/23/22/48/378232248.db2.gz NHSUJSZEMZELJB-INIZCTEOSA-N 0 3 293.407 2.636 20 10 CFCDHN CCOCCO[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000138482268 378232254 /nfs/dbraw/zinc/23/22/54/378232254.db2.gz NHSUJSZEMZELJB-INIZCTEOSA-N 0 3 293.407 2.636 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCCNC(=O)C(C)C)cc1 ZINC000178222876 380423753 /nfs/dbraw/zinc/42/37/53/380423753.db2.gz MXDUGEXMANUDKK-AWEZNQCLSA-N 0 3 291.439 2.566 20 10 CFCDHN C[C@@H](CNC(=O)OC(C)(C)C)[N@H+](C)Cc1ccccc1[O-] ZINC000179574297 380558476 /nfs/dbraw/zinc/55/84/76/380558476.db2.gz DRVODBQLUDFPOX-LBPRGKRZSA-N 0 3 294.395 2.737 20 10 CFCDHN C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1ccccc1[O-] ZINC000179574297 380558482 /nfs/dbraw/zinc/55/84/82/380558482.db2.gz DRVODBQLUDFPOX-LBPRGKRZSA-N 0 3 294.395 2.737 20 10 CFCDHN CC[C@H](NCC1(C)OCCO1)c1ccc(N(C)C)cc1 ZINC000179571647 380559064 /nfs/dbraw/zinc/55/90/64/380559064.db2.gz TXZHKFPREQSCKS-HNNXBMFYSA-N 0 3 278.396 2.556 20 10 CFCDHN CCN1CC[C@@H]([N@H+](C)Cc2ccccc2[O-])[C@H](C)C1 ZINC000179579585 380561456 /nfs/dbraw/zinc/56/14/56/380561456.db2.gz RCAHHVUDNPZOJH-UKRRQHHQSA-N 0 3 262.397 2.554 20 10 CFCDHN CCN1CC[C@@H]([N@@H+](C)Cc2ccccc2[O-])[C@H](C)C1 ZINC000179579585 380561460 /nfs/dbraw/zinc/56/14/60/380561460.db2.gz RCAHHVUDNPZOJH-UKRRQHHQSA-N 0 3 262.397 2.554 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@H+](Cc3cccc(C)c3[O-])C2)n1 ZINC000179755548 380578638 /nfs/dbraw/zinc/57/86/38/380578638.db2.gz DBAPZVAOPUJPOG-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1noc([C@@H]2CCC[N@@H+](Cc3cccc(C)c3[O-])C2)n1 ZINC000179755548 380578642 /nfs/dbraw/zinc/57/86/42/380578642.db2.gz DBAPZVAOPUJPOG-CQSZACIVSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c1[O-] ZINC000179779990 380580597 /nfs/dbraw/zinc/58/05/97/380580597.db2.gz ZSOYFRCODAUJGV-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1[O-] ZINC000179779990 380580602 /nfs/dbraw/zinc/58/06/02/380580602.db2.gz ZSOYFRCODAUJGV-ZDUSSCGKSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2)C1=O)c1ccccc1[O-] ZINC000179875083 380590310 /nfs/dbraw/zinc/59/03/10/380590310.db2.gz OOAQJIFXKZTODD-CZUORRHYSA-N 0 3 296.370 2.848 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccccc1[O-] ZINC000179882342 380592207 /nfs/dbraw/zinc/59/22/07/380592207.db2.gz FROJRWTVQNPDCY-UKRRQHHQSA-N 0 3 271.360 2.646 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCOC[C@H]1CCOC ZINC000368270296 380978305 /nfs/dbraw/zinc/97/83/05/380978305.db2.gz VESOARYNCMRQRW-UKRRQHHQSA-N 0 3 279.380 2.581 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCOC[C@H]1CCOC ZINC000368270296 380978310 /nfs/dbraw/zinc/97/83/10/380978310.db2.gz VESOARYNCMRQRW-UKRRQHHQSA-N 0 3 279.380 2.581 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1[O-])[C@H](O)c1ccccc1 ZINC000288432339 381014101 /nfs/dbraw/zinc/01/41/01/381014101.db2.gz BTQWBOUPYWEAGY-LRDDRELGSA-N 0 3 257.333 2.604 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2COc3ccccc3[C@H]2O)cc1C ZINC000288594487 381016094 /nfs/dbraw/zinc/01/60/94/381016094.db2.gz OXLJDPZRXDLMGX-CRAIPNDOSA-N 0 3 299.370 2.593 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@H](CO)C[C@@H]2C)c([O-])c1 ZINC000289245050 381027599 /nfs/dbraw/zinc/02/75/99/381027599.db2.gz APRAUBQLJDTFFW-KBPBESRZSA-N 0 3 293.407 2.774 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@H](CO)C[C@@H]2C)c([O-])c1 ZINC000289245050 381027607 /nfs/dbraw/zinc/02/76/07/381027607.db2.gz APRAUBQLJDTFFW-KBPBESRZSA-N 0 3 293.407 2.774 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2Cc1cc(C)c(C)cc1[O-] ZINC000289264603 381028941 /nfs/dbraw/zinc/02/89/41/381028941.db2.gz FWAGFLUBELVIGB-ORAAPJFESA-N 0 3 287.403 2.864 20 10 CFCDHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1cc(C)c(C)cc1[O-] ZINC000289264603 381028943 /nfs/dbraw/zinc/02/89/43/381028943.db2.gz FWAGFLUBELVIGB-ORAAPJFESA-N 0 3 287.403 2.864 20 10 CFCDHN COc1ccc(O)c(CN2CC[C@H](O)c3ccccc3C2)c1 ZINC000368815834 381140046 /nfs/dbraw/zinc/14/00/46/381140046.db2.gz HNGGGQQLXAMVAS-SFHVURJKSA-N 0 3 299.370 2.840 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)c1 ZINC000295933657 381165734 /nfs/dbraw/zinc/16/57/34/381165734.db2.gz KNGKWNYRTYMUAC-OAHLLOKOSA-N 0 3 296.370 2.529 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)c1[O-] ZINC000182635547 381125931 /nfs/dbraw/zinc/12/59/31/381125931.db2.gz YIQLIVRKBFFJDU-HOCLYGCPSA-N 0 3 293.432 2.845 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CCN3CCCC[C@@H]13)CC2 ZINC000295967138 381186180 /nfs/dbraw/zinc/18/61/80/381186180.db2.gz MKGTZVNWKUWAAO-ZNMIVQPWSA-N 0 3 272.392 2.596 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[N@H+]1CC[C@@H](O)C1 ZINC000182977601 381193434 /nfs/dbraw/zinc/19/34/34/381193434.db2.gz OOYVNMASJXRXAN-MRXNPFEDSA-N 0 3 299.370 2.538 20 10 CFCDHN [O-]c1cc(OCc2ccccc2)ccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000182977601 381193440 /nfs/dbraw/zinc/19/34/40/381193440.db2.gz OOYVNMASJXRXAN-MRXNPFEDSA-N 0 3 299.370 2.538 20 10 CFCDHN CC1([C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)OCCO1 ZINC000183242801 381241272 /nfs/dbraw/zinc/24/12/72/381241272.db2.gz LREMCXXEIRUOGB-CYBMUJFWSA-N 0 3 295.354 2.506 20 10 CFCDHN CC1([C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)OCCO1 ZINC000183242801 381241276 /nfs/dbraw/zinc/24/12/76/381241276.db2.gz LREMCXXEIRUOGB-CYBMUJFWSA-N 0 3 295.354 2.506 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCc1ccccn1)CC2 ZINC000296204720 381300511 /nfs/dbraw/zinc/30/05/11/381300511.db2.gz ZCJFADUTGKSKTB-CQSZACIVSA-N 0 3 254.333 2.607 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccccc1[O-] ZINC000183518310 381282553 /nfs/dbraw/zinc/28/25/53/381282553.db2.gz AXUYWNWIHXRKTA-NWDGAFQWSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCc3cccc([O-])c32)cc1O ZINC000296233209 381312197 /nfs/dbraw/zinc/31/21/97/381312197.db2.gz ALNKRIJEFZAJFE-CYBMUJFWSA-N 0 3 285.343 2.884 20 10 CFCDHN CC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)[C@H](O)C(F)F ZINC000296561771 381450415 /nfs/dbraw/zinc/45/04/15/381450415.db2.gz SHYGNLIAYOYYDG-BPNCWPANSA-N 0 3 286.366 2.808 20 10 CFCDHN C[C@@H]([NH2+]CCCN(C)C)c1cc(Cl)ccc1[O-] ZINC000184842763 381485291 /nfs/dbraw/zinc/48/52/91/381485291.db2.gz MJFUOVNQZGXBNT-SNVBAGLBSA-N 0 3 256.777 2.648 20 10 CFCDHN CCC(CC)(CO)[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000184707915 381465097 /nfs/dbraw/zinc/46/50/97/381465097.db2.gz MQMVUCDAZIYORC-UHFFFAOYSA-N 0 3 287.787 2.695 20 10 CFCDHN Cc1cccnc1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000296662264 381497679 /nfs/dbraw/zinc/49/76/79/381497679.db2.gz ZXVUNUXZSLHOGW-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)[nH]n1 ZINC000296979599 381548752 /nfs/dbraw/zinc/54/87/52/381548752.db2.gz RVWIEQJAGRBBEV-IINYFYTJSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@@H]2CCc3cccc([O-])c32)n[nH]1 ZINC000296979599 381548758 /nfs/dbraw/zinc/54/87/58/381548758.db2.gz RVWIEQJAGRBBEV-IINYFYTJSA-N 0 3 271.364 2.632 20 10 CFCDHN CC1(C)C[C@H]([NH2+][C@H]2CCc3cccc([O-])c32)CCO1 ZINC000296979714 381548871 /nfs/dbraw/zinc/54/88/71/381548871.db2.gz RWNZFOBKFUQUQQ-OLZOCXBDSA-N 0 3 261.365 2.927 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297504920 381562746 /nfs/dbraw/zinc/56/27/46/381562746.db2.gz CFEXUEOUYNVTGE-AWEZNQCLSA-N 0 3 271.364 2.520 20 10 CFCDHN CCC1(C)CN(Cc2cc(OC)c(OC)cc2O)C1 ZINC000297503328 381563886 /nfs/dbraw/zinc/56/38/86/381563886.db2.gz WHHCZWQDYXGQNS-UHFFFAOYSA-N 0 3 265.353 2.641 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c([O-])c1 ZINC000185369152 381615631 /nfs/dbraw/zinc/61/56/31/381615631.db2.gz KDTQMKYOAVUULN-QWHCGFSZSA-N 0 3 262.397 2.834 20 10 CFCDHN CC(=O)N1CCC(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])CC1 ZINC000185377353 381617547 /nfs/dbraw/zinc/61/75/47/381617547.db2.gz JQCUOIMGOUFGNI-ZDUSSCGKSA-N 0 3 290.407 2.610 20 10 CFCDHN CN(C)c1ccc(CN(C[C@@H]2CCCO2)C2CC2)cc1 ZINC000298691463 381713288 /nfs/dbraw/zinc/71/32/88/381713288.db2.gz DFJMWMGKOXLCMP-KRWDZBQOSA-N 0 3 274.408 2.896 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CO[C@@H]2CCOC2)c1 ZINC000185673171 381701494 /nfs/dbraw/zinc/70/14/94/381701494.db2.gz DFLXCRARZAXSIW-HZSPNIEDSA-N 0 3 279.380 2.545 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCOC2CCOCC2)c1 ZINC000186074170 381818395 /nfs/dbraw/zinc/81/83/95/381818395.db2.gz KQHWKJIXNQRYNB-AWEZNQCLSA-N 0 3 293.407 2.937 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCCCCO)c([O-])c1 ZINC000186231467 381859275 /nfs/dbraw/zinc/85/92/75/381859275.db2.gz LVGAZSWTRBETNG-ZDUSSCGKSA-N 0 3 251.370 2.904 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCOCC1)c1cc(F)ccc1[O-] ZINC000186234986 381860066 /nfs/dbraw/zinc/86/00/66/381860066.db2.gz KWQZZLRLEASNJA-CMPLNLGQSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1cnn(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)c1 ZINC000373240028 381958805 /nfs/dbraw/zinc/95/88/05/381958805.db2.gz PLXIMBPQMVRBKH-UHFFFAOYSA-N 0 3 289.354 2.873 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1[O-] ZINC000373222391 381952856 /nfs/dbraw/zinc/95/28/56/381952856.db2.gz CDODVSZUTMMBIG-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1[O-] ZINC000373222391 381952863 /nfs/dbraw/zinc/95/28/63/381952863.db2.gz CDODVSZUTMMBIG-HNNXBMFYSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000374997586 382063615 /nfs/dbraw/zinc/06/36/15/382063615.db2.gz KKWODAQLLAUVRX-HIFRSBDPSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1[O-] ZINC000374997586 382063621 /nfs/dbraw/zinc/06/36/21/382063621.db2.gz KKWODAQLLAUVRX-HIFRSBDPSA-N 0 3 261.365 2.559 20 10 CFCDHN Cc1nc(C2CC[NH+](Cc3cccc(C)c3[O-])CC2)no1 ZINC000375011724 382065424 /nfs/dbraw/zinc/06/54/24/382065424.db2.gz HWQJJNCBVCSLAN-UHFFFAOYSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nc([C@H]2CCC[N@H+](Cc3cccc(C)c3[O-])C2)no1 ZINC000375841777 382105601 /nfs/dbraw/zinc/10/56/01/382105601.db2.gz OSVJATXLIPXOBU-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1nc([C@H]2CCC[N@@H+](Cc3cccc(C)c3[O-])C2)no1 ZINC000375841777 382105609 /nfs/dbraw/zinc/10/56/09/382105609.db2.gz OSVJATXLIPXOBU-AWEZNQCLSA-N 0 3 287.363 2.772 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@]3(CCOC3)C2)c1 ZINC000376301252 382129119 /nfs/dbraw/zinc/12/91/19/382129119.db2.gz HCYVQBRNIBMWMW-JJRVBVJISA-N 0 3 291.391 2.689 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CC2(OC)CCCCC2)c1 ZINC000187464096 382188001 /nfs/dbraw/zinc/18/80/01/382188001.db2.gz NMZNCDUFIWFKKH-UHFFFAOYSA-N 0 3 279.380 2.840 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](O)C23CCCC3)cc1C ZINC000293796874 382283621 /nfs/dbraw/zinc/28/36/21/382283621.db2.gz CYJVYTVTQDBWTQ-INIZCTEOSA-N 0 3 275.392 2.888 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](O)C23CCCC3)cc1C ZINC000293796874 382283626 /nfs/dbraw/zinc/28/36/26/382283626.db2.gz CYJVYTVTQDBWTQ-INIZCTEOSA-N 0 3 275.392 2.888 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1Cc2ccccc2O1 ZINC000363879558 382249719 /nfs/dbraw/zinc/24/97/19/382249719.db2.gz PCVGPYGLSPEKMU-OAHLLOKOSA-N 0 3 269.344 2.828 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1Cc2ccccc2O1 ZINC000363879558 382249730 /nfs/dbraw/zinc/24/97/30/382249730.db2.gz PCVGPYGLSPEKMU-OAHLLOKOSA-N 0 3 269.344 2.828 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H](CO)C2CCCCC2)c1 ZINC000293734446 382255912 /nfs/dbraw/zinc/25/59/12/382255912.db2.gz VBZDFNXTELBEEQ-HNNXBMFYSA-N 0 3 293.407 2.679 20 10 CFCDHN COC(=O)[C@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C[C@H]1C ZINC000188106589 382344409 /nfs/dbraw/zinc/34/44/09/382344409.db2.gz SGBFYBMRGIWSQD-HIFRSBDPSA-N 0 3 291.391 2.640 20 10 CFCDHN COC(=O)[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C[C@H]1C ZINC000188106589 382344414 /nfs/dbraw/zinc/34/44/14/382344414.db2.gz SGBFYBMRGIWSQD-HIFRSBDPSA-N 0 3 291.391 2.640 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCC[C@@H]2CCO)c1 ZINC000188009353 382324173 /nfs/dbraw/zinc/32/41/73/382324173.db2.gz DVGGBEWPGPXISH-LALPHHSUSA-N 0 3 279.380 2.603 20 10 CFCDHN COCCCOCCN(C)Cc1ccc(N(C)C)c(C)c1 ZINC000293923985 382337909 /nfs/dbraw/zinc/33/79/09/382337909.db2.gz YDGRBQZBXFFKEX-UHFFFAOYSA-N 0 3 294.439 2.546 20 10 CFCDHN Oc1ccccc1CN1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000294014640 382378783 /nfs/dbraw/zinc/37/87/83/382378783.db2.gz NCLUVZBNPXWKEU-HZPDHXFCSA-N 0 3 259.349 2.536 20 10 CFCDHN COc1cccc(C[NH+]2CCC([C@H]3CCCO3)CC2)c1[O-] ZINC000188286955 382383851 /nfs/dbraw/zinc/38/38/51/382383851.db2.gz JIUAOLZQSZELLP-OAHLLOKOSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@]2(O)CCC[C@H]2C)c1[O-] ZINC000294149913 382434670 /nfs/dbraw/zinc/43/46/70/382434670.db2.gz VIHBOROLTPSREH-MEBBXXQBSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@]2(O)CCC[C@@H]2C)c1[O-] ZINC000294149919 382434724 /nfs/dbraw/zinc/43/47/24/382434724.db2.gz VIHBOROLTPSREH-ZUZCIYMTSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(CN2CC([C@H]3CCOC3)C2)c1O ZINC000365558284 382412340 /nfs/dbraw/zinc/41/23/40/382412340.db2.gz COALDYKPMCDQTH-JTQLQIEISA-N 0 3 297.782 2.523 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC23CCC(CO)CC3)c1[O-] ZINC000378448517 382462812 /nfs/dbraw/zinc/46/28/12/382462812.db2.gz KTVISYGSBVTUES-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN COc1cccc(C[N@H+]2CCC23CCC(CO)CC3)c1[O-] ZINC000378448517 382462816 /nfs/dbraw/zinc/46/28/16/382462816.db2.gz KTVISYGSBVTUES-UHFFFAOYSA-N 0 3 291.391 2.528 20 10 CFCDHN CO[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000378627904 382494165 /nfs/dbraw/zinc/49/41/65/382494165.db2.gz BANAODYFAVAQOV-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN CO[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1 ZINC000378627904 382494167 /nfs/dbraw/zinc/49/41/67/382494167.db2.gz BANAODYFAVAQOV-CYBMUJFWSA-N 0 3 253.317 2.532 20 10 CFCDHN Cc1nnc([C@@H]2CC23CC[NH+](Cc2ccccc2[O-])CC3)o1 ZINC000378495563 382473217 /nfs/dbraw/zinc/47/32/17/382473217.db2.gz MXDAFVZQUXNXDD-AWEZNQCLSA-N 0 3 299.374 2.853 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1cc(C)c(C)cc1[O-])OC ZINC000294690521 382525364 /nfs/dbraw/zinc/52/53/64/382525364.db2.gz BSOZOXFUEJFRGD-AWEZNQCLSA-N 0 3 251.370 2.914 20 10 CFCDHN CCn1cc([C@H](C)NCc2cccc(C)c2O)cn1 ZINC000294738066 382527062 /nfs/dbraw/zinc/52/70/62/382527062.db2.gz CEKHFXKBLHEMSY-LBPRGKRZSA-N 0 3 259.353 2.768 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H](c3nccn3C)C2)cc1C ZINC000366814182 382550910 /nfs/dbraw/zinc/55/09/10/382550910.db2.gz KNDWESMHQULQGT-AWEZNQCLSA-N 0 3 285.391 2.732 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H](c3nccn3C)C2)cc1C ZINC000366814182 382550915 /nfs/dbraw/zinc/55/09/15/382550915.db2.gz KNDWESMHQULQGT-AWEZNQCLSA-N 0 3 285.391 2.732 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@]2(CCO[C@@H]2C)C1 ZINC000367294851 382562651 /nfs/dbraw/zinc/56/26/51/382562651.db2.gz NKOQMNZZRCUELY-FRFSOERESA-N 0 3 291.391 2.723 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@]2(CCO[C@@H]2C)C1 ZINC000367294851 382562655 /nfs/dbraw/zinc/56/26/55/382562655.db2.gz NKOQMNZZRCUELY-FRFSOERESA-N 0 3 291.391 2.723 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@H](OC)[C@@H](C)CC)c1 ZINC000294840502 382533856 /nfs/dbraw/zinc/53/38/56/382533856.db2.gz RCOVYPWEOUTTBD-LRDDRELGSA-N 0 3 281.396 2.942 20 10 CFCDHN CCn1cc([C@@H](C)NCc2cc(C)ccc2O)cn1 ZINC000294872232 382535611 /nfs/dbraw/zinc/53/56/11/382535611.db2.gz PIRZSIJXCRKXQS-GFCCVEGCSA-N 0 3 259.353 2.768 20 10 CFCDHN CCN(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000189407236 382604567 /nfs/dbraw/zinc/60/45/67/382604567.db2.gz BFGTVGJREFJBAJ-KBPBESRZSA-N 0 3 291.439 2.660 20 10 CFCDHN CCN(C)C(=O)[C@@H]([NH2+]Cc1cc(C)c(C)cc1[O-])C(C)C ZINC000295138057 382578185 /nfs/dbraw/zinc/57/81/85/382578185.db2.gz ZBUHOPPTVLOBTK-INIZCTEOSA-N 0 3 292.423 2.602 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCC[C@H]2CCO)cc1C ZINC000189971911 382647776 /nfs/dbraw/zinc/64/77/76/382647776.db2.gz SGVYZBTUPAOIPP-ZFWWWQNUSA-N 0 3 263.381 2.650 20 10 CFCDHN C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccccc1[O-] ZINC000248393511 383234009 /nfs/dbraw/zinc/23/40/09/383234009.db2.gz WWIQGAKHDRGSPO-BTQDYEIMSA-N 0 3 261.365 2.856 20 10 CFCDHN CCC[N@H+](CCC1OCCCO1)Cc1ccccc1[O-] ZINC000267949454 384496221 /nfs/dbraw/zinc/49/62/21/384496221.db2.gz PYKJWTBJVMSRRH-UHFFFAOYSA-N 0 3 279.380 2.757 20 10 CFCDHN CCC[N@@H+](CCC1OCCCO1)Cc1ccccc1[O-] ZINC000267949454 384496226 /nfs/dbraw/zinc/49/62/26/384496226.db2.gz PYKJWTBJVMSRRH-UHFFFAOYSA-N 0 3 279.380 2.757 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCO[C@@H](CC)C2)c1 ZINC000281260986 385189560 /nfs/dbraw/zinc/18/95/60/385189560.db2.gz NEASHZVAYBQOAF-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCO[C@@H](CC)C2)c1 ZINC000281260986 385189564 /nfs/dbraw/zinc/18/95/64/385189564.db2.gz NEASHZVAYBQOAF-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CO[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)C1 ZINC000282123061 385218623 /nfs/dbraw/zinc/21/86/23/385218623.db2.gz AYCKHJATAJYONJ-TZMCWYRMSA-N 0 3 280.387 2.891 20 10 CFCDHN CCCCN(Cc1cncn1C)Cc1ccccc1O ZINC000282440027 385311374 /nfs/dbraw/zinc/31/13/74/385311374.db2.gz KXVJPYJDCPUHHP-UHFFFAOYSA-N 0 3 273.380 2.928 20 10 CFCDHN COc1cc([O-])c(C[N@H+](C)CCCOC(C)C)cc1OC ZINC000271058809 385323212 /nfs/dbraw/zinc/32/32/12/385323212.db2.gz BJRKBZWJFDLWDM-UHFFFAOYSA-N 0 3 297.395 2.656 20 10 CFCDHN COc1cc([O-])c(C[N@@H+](C)CCCOC(C)C)cc1OC ZINC000271058809 385323217 /nfs/dbraw/zinc/32/32/17/385323217.db2.gz BJRKBZWJFDLWDM-UHFFFAOYSA-N 0 3 297.395 2.656 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c1 ZINC000282390044 385299213 /nfs/dbraw/zinc/29/92/13/385299213.db2.gz RCUUKPCZMPFTOP-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)c1 ZINC000282390044 385299217 /nfs/dbraw/zinc/29/92/17/385299217.db2.gz RCUUKPCZMPFTOP-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CC[N@H+](CCOC)Cc1cc(Cl)cc(C)c1[O-] ZINC000271710498 385388564 /nfs/dbraw/zinc/38/85/64/385388564.db2.gz GSXRQLBUGGEPNQ-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN CC[N@@H+](CCOC)Cc1cc(Cl)cc(C)c1[O-] ZINC000271710498 385388569 /nfs/dbraw/zinc/38/85/69/385388569.db2.gz GSXRQLBUGGEPNQ-UHFFFAOYSA-N 0 3 257.761 2.822 20 10 CFCDHN CCCCN(Cc1ccccc1O)C(=O)CN(C)C(C)C ZINC000282563908 385342908 /nfs/dbraw/zinc/34/29/08/385342908.db2.gz UMWNDFHTXFLJGO-UHFFFAOYSA-N 0 3 292.423 2.861 20 10 CFCDHN Cc1ccc([O-])c(C[NH+]2CCC(C3(C)OCCO3)CC2)c1 ZINC000271174441 385362319 /nfs/dbraw/zinc/36/23/19/385362319.db2.gz JQIXGTHOWUYWGW-UHFFFAOYSA-N 0 3 291.391 2.676 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@](C)(O)c2cccs2)c1[O-] ZINC000271819149 385394096 /nfs/dbraw/zinc/39/40/96/385394096.db2.gz MLSZQURGOYCSDE-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CC2([C@H](C)CCO)CCC2)c1 ZINC000271873087 385395646 /nfs/dbraw/zinc/39/56/46/385395646.db2.gz YIUJUQYVVPDBBM-CQSZACIVSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCc3ccccc3[C@@H]2CO)c1[O-] ZINC000271874496 385395997 /nfs/dbraw/zinc/39/59/97/385395997.db2.gz STMARLWHEFVCFT-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1cccc(C[N@H+]2CCc3ccccc3[C@@H]2CO)c1[O-] ZINC000271874496 385396001 /nfs/dbraw/zinc/39/60/01/385396001.db2.gz STMARLWHEFVCFT-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN Cc1cccc(CN2CCc3ccccc3[C@@H]2CO)c1O ZINC000271874496 385396004 /nfs/dbraw/zinc/39/60/04/385396004.db2.gz STMARLWHEFVCFT-KRWDZBQOSA-N 0 3 283.371 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284301639 385547105 /nfs/dbraw/zinc/54/71/05/385547105.db2.gz BPKUHTSWIVBOIC-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000284301639 385547110 /nfs/dbraw/zinc/54/71/10/385547110.db2.gz BPKUHTSWIVBOIC-DOTOQJQBSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000272393373 385527106 /nfs/dbraw/zinc/52/71/06/385527106.db2.gz HQSIIBYFWVWQHV-GDBMZVCRSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000272393373 385527109 /nfs/dbraw/zinc/52/71/09/385527109.db2.gz HQSIIBYFWVWQHV-GDBMZVCRSA-N 0 3 293.407 2.630 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccccc1[O-] ZINC000285770977 385557143 /nfs/dbraw/zinc/55/71/43/385557143.db2.gz TZBIOHQNDMKSGI-AXAPSJFSSA-N 0 3 290.407 2.736 20 10 CFCDHN CC[C@H](C)NC(=O)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273303152 385676405 /nfs/dbraw/zinc/67/64/05/385676405.db2.gz CDBIYWIYEVWKAF-JSGCOSHPSA-N 0 3 292.423 2.964 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cn2ccnc2)c([O-])c1C ZINC000273375763 385679587 /nfs/dbraw/zinc/67/95/87/385679587.db2.gz HCNUGUDFFZPZDP-GXTWGEPZSA-N 0 3 273.380 2.945 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C[C@H]1O ZINC000273442753 385683439 /nfs/dbraw/zinc/68/34/39/385683439.db2.gz WSOKATNHEDDWCF-UKRRQHHQSA-N 0 3 281.371 2.760 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C[C@H]1O ZINC000273442753 385683447 /nfs/dbraw/zinc/68/34/47/385683447.db2.gz WSOKATNHEDDWCF-UKRRQHHQSA-N 0 3 281.371 2.760 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2ccncc2C)c1 ZINC000273490553 385684140 /nfs/dbraw/zinc/68/41/40/385684140.db2.gz OELRXPRSQBJEEQ-ZDUSSCGKSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1ccc([C@H](C)N[C@@H]2CCN(C(C)C)C2=O)c(O)c1C ZINC000273519154 385686279 /nfs/dbraw/zinc/68/62/79/385686279.db2.gz TVEKDIMYIOUGRD-DZGCQCFKSA-N 0 3 290.407 2.669 20 10 CFCDHN CC(C)[C@@H](O)C1(C[NH2+][C@H](C)c2cc(F)ccc2[O-])CC1 ZINC000273535767 385688099 /nfs/dbraw/zinc/68/80/99/385688099.db2.gz XGRIQJAVPWJKRW-IAQYHMDHSA-N 0 3 281.371 2.979 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@H]1C)c1cc(F)ccc1[O-] ZINC000273590357 385689775 /nfs/dbraw/zinc/68/97/75/385689775.db2.gz OYPFDPQOKPDAOD-JRPNMDOOSA-N 0 3 278.371 2.665 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@]2(N(C)C)CCSC2)c([O-])c1 ZINC000273570643 385689910 /nfs/dbraw/zinc/68/99/10/385689910.db2.gz KOXZBBBPXWUYEJ-XJKSGUPXSA-N 0 3 294.464 2.789 20 10 CFCDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c(O)c1C ZINC000273615752 385690944 /nfs/dbraw/zinc/69/09/44/385690944.db2.gz XHONCCVLFPJALF-STQMWFEESA-N 0 3 292.423 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]Cc2ccn(C)c2)c1 ZINC000273595961 385691130 /nfs/dbraw/zinc/69/11/30/385691130.db2.gz QQWWYPOTCYAHLF-NSHDSACASA-N 0 3 260.337 2.590 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCC(=O)N(C)C)c([O-])c1C ZINC000273607895 385691784 /nfs/dbraw/zinc/69/17/84/385691784.db2.gz USJDQIRIBDNPQE-CYBMUJFWSA-N 0 3 278.396 2.528 20 10 CFCDHN COc1cccc(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c1[O-] ZINC000273047716 385670380 /nfs/dbraw/zinc/67/03/80/385670380.db2.gz JTVITDZCSLTZAQ-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCO2)[C@H](O)c1ccccc1 ZINC000288478223 197088749 /nfs/dbraw/zinc/08/87/49/197088749.db2.gz GGVTUFHZPFHZEQ-UGSOOPFHSA-N 0 3 283.371 2.833 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CSCCS1)CC2 ZINC000297151021 285396803 /nfs/dbraw/zinc/39/68/03/285396803.db2.gz AVLCQZCKUWZGBY-RYUDHWBXSA-N 0 3 281.446 2.818 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1[O-] ZINC000372470887 393449563 /nfs/dbraw/zinc/44/95/63/393449563.db2.gz GVEUYLRVLYDEAJ-QRTARXTBSA-N 0 3 291.391 2.771 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@]1(CO)CCCc2ccccc21 ZINC000374134314 393485176 /nfs/dbraw/zinc/48/51/76/393485176.db2.gz AQPZUXNHVCYYEE-GOSISDBHSA-N 0 3 283.371 2.706 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1 ZINC000374158018 393486578 /nfs/dbraw/zinc/48/65/78/393486578.db2.gz JPLNKTYVIMNFTI-NUEKZKHPSA-N 0 3 275.392 2.994 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3nc[nH]c3C2)c([O-])c1 ZINC000377803452 393537137 /nfs/dbraw/zinc/53/71/37/393537137.db2.gz WQOYQHFOEHOAGA-NWDGAFQWSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3[nH]cnc3C2)c([O-])c1 ZINC000377803452 393537142 /nfs/dbraw/zinc/53/71/42/393537142.db2.gz WQOYQHFOEHOAGA-NWDGAFQWSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc(O)c(CNC(C)(C)C(=O)NCC(C)(C)C)c1 ZINC000121258969 393952391 /nfs/dbraw/zinc/95/23/91/393952391.db2.gz GYXROXCTGWHOGU-UHFFFAOYSA-N 0 3 292.423 2.731 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C(C)(C)C(=O)NCC(C)(C)C)c1 ZINC000121258969 393952393 /nfs/dbraw/zinc/95/23/93/393952393.db2.gz GYXROXCTGWHOGU-UHFFFAOYSA-N 0 3 292.423 2.731 20 10 CFCDHN C[C@@H](CN(C)C)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000287047450 394201575 /nfs/dbraw/zinc/20/15/75/394201575.db2.gz MRFSKNZFPQRABJ-STQMWFEESA-N 0 3 276.424 2.872 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1C[C@H](O)C2(CC2)C1 ZINC000364448490 394214395 /nfs/dbraw/zinc/21/43/95/394214395.db2.gz QDVHAJAKLOHTDZ-INIZCTEOSA-N 0 3 269.344 2.502 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1C[C@H](O)C2(CC2)C1 ZINC000364448490 394214400 /nfs/dbraw/zinc/21/44/00/394214400.db2.gz QDVHAJAKLOHTDZ-INIZCTEOSA-N 0 3 269.344 2.502 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CCCC[C@@H](CO)C2)c1 ZINC000366813036 394247881 /nfs/dbraw/zinc/24/78/81/394247881.db2.gz VVCGVJLANCMFFN-QWHCGFSZSA-N 0 3 279.380 2.556 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CCCC[C@@H](CO)C2)c1 ZINC000366813036 394247883 /nfs/dbraw/zinc/24/78/83/394247883.db2.gz VVCGVJLANCMFFN-QWHCGFSZSA-N 0 3 279.380 2.556 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(F)cc1[O-] ZINC000293670319 394284461 /nfs/dbraw/zinc/28/44/61/394284461.db2.gz MNCRUTDPEHHLFN-SMDDNHRTSA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)[C@H](C)O1 ZINC000295233690 394297850 /nfs/dbraw/zinc/29/78/50/394297850.db2.gz SECDSDFCNCIMQU-SUNKGSAMSA-N 0 3 266.360 2.547 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCN(C3CC3)C[C@@H](C)C2)c1 ZINC000295992239 394305165 /nfs/dbraw/zinc/30/51/65/394305165.db2.gz KHSNMYVTUWHQAQ-AWEZNQCLSA-N 0 3 274.408 2.617 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCN(C3CC3)C[C@@H](C)C2)c1 ZINC000295992239 394305166 /nfs/dbraw/zinc/30/51/66/394305166.db2.gz KHSNMYVTUWHQAQ-AWEZNQCLSA-N 0 3 274.408 2.617 20 10 CFCDHN CC(C)n1cc(CNCc2ccc3c(c2)CCN3C)cn1 ZINC000372355024 397536258 /nfs/dbraw/zinc/53/62/58/397536258.db2.gz FCAVUTLXXKSBSY-UHFFFAOYSA-N 0 3 284.407 2.746 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2[O-])cc1OC ZINC000008493730 170338109 /nfs/dbraw/zinc/33/81/09/170338109.db2.gz PGFDPHPAEUNGLT-UHFFFAOYSA-N 0 3 273.332 2.699 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000020123079 171004232 /nfs/dbraw/zinc/00/42/32/171004232.db2.gz VETMYTUMWFTHGJ-OAHLLOKOSA-N 0 3 286.375 2.912 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2[O-])cn1 ZINC000020186537 171050981 /nfs/dbraw/zinc/05/09/81/171050981.db2.gz MZAKRVIJMVDSEY-GFCCVEGCSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCCO2)c1 ZINC000020207101 171071329 /nfs/dbraw/zinc/07/13/29/171071329.db2.gz JSWAZCLCWIIPLE-PGUXBMHVSA-N 0 3 265.353 2.619 20 10 CFCDHN CCN1CCC([NH2+][C@H](C)c2cc(C)ccc2[O-])CC1 ZINC000038098075 174112761 /nfs/dbraw/zinc/11/27/61/174112761.db2.gz SMABLVJDEKKOBI-CYBMUJFWSA-N 0 3 262.397 2.836 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](O)c2ccccc2)c1 ZINC000071407047 176156420 /nfs/dbraw/zinc/15/64/20/176156420.db2.gz IYFSRYWHZNUCBO-MRXNPFEDSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1c([C@H](C)NCc2ccc3c(c2)CCO3)cnn1C ZINC000037363600 260094595 /nfs/dbraw/zinc/09/45/95/260094595.db2.gz ASPGFWOJENXNFL-NSHDSACASA-N 0 3 271.364 2.514 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H](CO)C2)c1[O-] ZINC000363905096 262021542 /nfs/dbraw/zinc/02/15/42/262021542.db2.gz BPCBDJOFNUYQNC-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCCC[C@H](CO)C2)c1[O-] ZINC000363905096 262021543 /nfs/dbraw/zinc/02/15/43/262021543.db2.gz BPCBDJOFNUYQNC-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]1C(=O)NC1CC1 ZINC000368021521 267136549 /nfs/dbraw/zinc/13/65/49/267136549.db2.gz ZFAXRJIBHNAAJN-CABCVRRESA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H]1C(=O)NC1CC1 ZINC000368021521 267136551 /nfs/dbraw/zinc/13/65/51/267136551.db2.gz ZFAXRJIBHNAAJN-CABCVRRESA-N 0 3 288.391 2.586 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCC[C@H]2COC[C@H]21 ZINC000368039742 267140064 /nfs/dbraw/zinc/14/00/64/267140064.db2.gz GYJNIPXHBWFBOT-NWANDNLSSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCC[C@H]2COC[C@H]21 ZINC000368039742 267140068 /nfs/dbraw/zinc/14/00/68/267140068.db2.gz GYJNIPXHBWFBOT-NWANDNLSSA-N 0 3 261.365 2.954 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@]23CCOC3)c1 ZINC000368486088 267176197 /nfs/dbraw/zinc/17/61/97/267176197.db2.gz APWBGOKTTVIOPM-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@]23CCOC3)c1 ZINC000368486088 267176199 /nfs/dbraw/zinc/17/61/99/267176199.db2.gz APWBGOKTTVIOPM-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c1[O-] ZINC000368597663 267190282 /nfs/dbraw/zinc/19/02/82/267190282.db2.gz YDBMVBLNNYWGFO-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)c1[O-] ZINC000368597663 267190284 /nfs/dbraw/zinc/19/02/84/267190284.db2.gz YDBMVBLNNYWGFO-CQSZACIVSA-N 0 3 285.391 2.814 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CC[C@](O)(C3CC3)C2)c([O-])c1 ZINC000369677896 267259554 /nfs/dbraw/zinc/25/95/54/267259554.db2.gz ZPZZBTPTKCMEPI-QGZVFWFLSA-N 0 3 291.391 2.528 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([O-])c1 ZINC000369677896 267259558 /nfs/dbraw/zinc/25/95/58/267259558.db2.gz ZPZZBTPTKCMEPI-QGZVFWFLSA-N 0 3 291.391 2.528 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]Cc2ccc3c(c2)CCN3C)c1 ZINC000370427301 267317748 /nfs/dbraw/zinc/31/77/48/267317748.db2.gz DFMQYPAEAUEKQZ-UHFFFAOYSA-N 0 3 282.387 2.983 20 10 CFCDHN Cc1ccc(O)c(CN[C@@H]2CN(C)Cc3ccccc32)c1 ZINC000371091526 267350204 /nfs/dbraw/zinc/35/02/04/267350204.db2.gz ZMICNRVERLBGHV-QGZVFWFLSA-N 0 3 282.387 2.977 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCO[C@@H]2C2CC2)c([O-])c1 ZINC000371219338 267374499 /nfs/dbraw/zinc/37/44/99/267374499.db2.gz KVRGKQCQGLVCLD-DOTOQJQBSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCO[C@@H]2C2CC2)cc1C ZINC000372864405 267611721 /nfs/dbraw/zinc/61/17/21/267611721.db2.gz VVZGYHAQWSJTBU-GOEBONIOSA-N 0 3 261.365 2.666 20 10 CFCDHN Cc1nccn1C[C@@H](C)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297562433 274861630 /nfs/dbraw/zinc/86/16/30/274861630.db2.gz GFQNAGKOCNUJNS-SWLSCSKDSA-N 0 3 285.391 2.810 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CC[C@](C)(C(=O)OC)C1 ZINC000368795930 280219072 /nfs/dbraw/zinc/21/90/72/280219072.db2.gz HQCMNUNRXJJCAX-BBRMVZONSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CC[C@](C)(C(=O)OC)C1 ZINC000368795930 280219073 /nfs/dbraw/zinc/21/90/73/280219073.db2.gz HQCMNUNRXJJCAX-BBRMVZONSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@H]([NH2+][C@H]1COc2ccccc2[C@H]1O)c1ccccc1[O-] ZINC000367996698 327087490 /nfs/dbraw/zinc/08/74/90/327087490.db2.gz ITFHRDSQSOYJFN-RLFYNMQTSA-N 0 3 299.370 2.928 20 10 CFCDHN CC[C@H]([NH2+][C@H]1COc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000367996697 327087524 /nfs/dbraw/zinc/08/75/24/327087524.db2.gz ITFHRDSQSOYJFN-MPGHIAIKSA-N 0 3 299.370 2.928 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000375260499 329002195 /nfs/dbraw/zinc/00/21/95/329002195.db2.gz OECTZHGBLJJMOV-DCGLDWPTSA-N 0 3 291.391 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC000375260499 329002197 /nfs/dbraw/zinc/00/21/97/329002197.db2.gz OECTZHGBLJJMOV-DCGLDWPTSA-N 0 3 291.391 2.963 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@H]2c3ccccc3C(=O)N2C)c1 ZINC000527804548 330284367 /nfs/dbraw/zinc/28/43/67/330284367.db2.gz FEEHGABFNILJPY-INIZCTEOSA-N 0 3 296.370 2.617 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC23CC(C2)CO3)c2c1c(F)ccc2[O-] ZINC000527983000 330298490 /nfs/dbraw/zinc/29/84/90/330298490.db2.gz RVKGYTDZGXSYQP-CEHVMXRASA-N 0 3 277.339 2.848 20 10 CFCDHN COc1ccc(CC[NH2+][C@H](C)c2ccc(C)cc2[O-])cn1 ZINC000527988357 330299028 /nfs/dbraw/zinc/29/90/28/330299028.db2.gz DJVOBYNHUSHXSQ-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN Cc1ccc(O)c([C@H](C)N[C@@H]2Cc3ccccc3NC2=O)c1 ZINC000527999990 330299914 /nfs/dbraw/zinc/29/99/14/330299914.db2.gz MIYLRSSNMAPNFL-BLLLJJGKSA-N 0 3 296.370 2.915 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1ccccc1[O-] ZINC000528001952 330300209 /nfs/dbraw/zinc/30/02/09/330300209.db2.gz QIERBHSXNHEJDQ-GOEBONIOSA-N 0 3 296.370 2.996 20 10 CFCDHN CCCC[N@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000159731282 520421257 /nfs/dbraw/zinc/42/12/57/520421257.db2.gz CEYQMXDBCYNOGP-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCCC[N@@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000159731282 520421270 /nfs/dbraw/zinc/42/12/70/520421270.db2.gz CEYQMXDBCYNOGP-UHFFFAOYSA-N 0 3 253.342 2.641 20 10 CFCDHN CCC[C@]1(CO)CCC[N@H+]1Cc1cccc(C)c1[O-] ZINC000278657060 521316760 /nfs/dbraw/zinc/31/67/60/521316760.db2.gz KDEYCFQKPROYOA-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOC(CC[NH2+]Cc1cccc(C)c1[O-])OCC ZINC000276176391 521629791 /nfs/dbraw/zinc/62/97/91/521629791.db2.gz KAKVLSXWACCEGL-UHFFFAOYSA-N 0 3 267.369 2.579 20 10 CFCDHN CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2[O-])C1 ZINC000246201898 521711696 /nfs/dbraw/zinc/71/16/96/521711696.db2.gz LVRBEJTXZDZJKO-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN CC(C)(C)OC(=O)C1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000272267551 518777629 /nfs/dbraw/zinc/77/76/29/518777629.db2.gz KXFROUMNLQSHPN-UHFFFAOYSA-N 0 3 291.391 2.946 20 10 CFCDHN CC(C)C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])N(C)C ZINC000226584321 519351217 /nfs/dbraw/zinc/35/12/17/519351217.db2.gz GJQFOHIGFAJAHO-CQSZACIVSA-N 0 3 268.376 2.597 20 10 CFCDHN CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])cn1 ZINC000279201000 519717813 /nfs/dbraw/zinc/71/78/13/519717813.db2.gz XIFWHADVMVLDOM-LBPRGKRZSA-N 0 3 299.374 2.905 20 10 CFCDHN CCOCCN[C@@H](C)c1ccc(N(C)CC)cc1 ZINC000161904438 519970115 /nfs/dbraw/zinc/97/01/15/519970115.db2.gz HZQSTJOOLPRNAL-ZDUSSCGKSA-N 0 3 250.386 2.830 20 10 CFCDHN CCOCc1cc(CNC[C@@H](CC)OC)ccc1OC ZINC000289907400 520186150 /nfs/dbraw/zinc/18/61/50/520186150.db2.gz ULVZAAJNRMIRLK-OAHLLOKOSA-N 0 3 281.396 2.746 20 10 CFCDHN CCN(C)C(=O)[C@H](C)N[C@H](C)c1ccc(N(C)CC)cc1 ZINC000189407215 520214539 /nfs/dbraw/zinc/21/45/39/520214539.db2.gz BFGTVGJREFJBAJ-KGLIPLIRSA-N 0 3 291.439 2.660 20 10 CFCDHN CCCOc1ccc(C[NH2+]C[C@]2(O)CCC[C@H]2C)c([O-])c1 ZINC000293237978 520369181 /nfs/dbraw/zinc/36/91/81/520369181.db2.gz ZQMYEOGNQYTAII-CXAGYDPISA-N 0 3 293.407 2.822 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290652193 521144518 /nfs/dbraw/zinc/14/45/18/521144518.db2.gz ZCSVYCCNMFOPGF-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@@]2(C)CCCO)c1 ZINC000290652193 521144526 /nfs/dbraw/zinc/14/45/26/521144526.db2.gz ZCSVYCCNMFOPGF-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOC(=O)[C@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 ZINC000276280972 521227748 /nfs/dbraw/zinc/22/77/48/521227748.db2.gz FGWBGNJYDDTFPG-OLZOCXBDSA-N 0 3 279.380 2.681 20 10 CFCDHN CC[N@@H+](Cc1cc(C)c(C)cc1[O-])C[C@@H](C)OC ZINC000291070794 521286663 /nfs/dbraw/zinc/28/66/63/521286663.db2.gz ITEGLDSHOGTOAM-CYBMUJFWSA-N 0 3 251.370 2.866 20 10 CFCDHN CC[N@H+](Cc1cc(C)c(C)cc1[O-])C[C@@H](C)OC ZINC000291070794 521286672 /nfs/dbraw/zinc/28/66/72/521286672.db2.gz ITEGLDSHOGTOAM-CYBMUJFWSA-N 0 3 251.370 2.866 20 10 CFCDHN CC[N@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H](C)CO ZINC000292796062 521288365 /nfs/dbraw/zinc/28/83/65/521288365.db2.gz MXGBLYFSFORORT-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN CC[N@@H+](Cc1cc(Cl)cc(C)c1[O-])[C@H](C)CO ZINC000292796062 521288375 /nfs/dbraw/zinc/28/83/75/521288375.db2.gz MXGBLYFSFORORT-SNVBAGLBSA-N 0 3 257.761 2.557 20 10 CFCDHN CCC[C@]1(CO)CCC[N@@H+]1Cc1cccc(C)c1[O-] ZINC000278657060 521316752 /nfs/dbraw/zinc/31/67/52/521316752.db2.gz KDEYCFQKPROYOA-MRXNPFEDSA-N 0 3 263.381 2.828 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000280565625 521335379 /nfs/dbraw/zinc/33/53/79/521335379.db2.gz VHUYUEGTOIHTKW-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000280565625 521335387 /nfs/dbraw/zinc/33/53/87/521335387.db2.gz VHUYUEGTOIHTKW-DZGCQCFKSA-N 0 3 293.407 2.916 20 10 CFCDHN CCOc1cccc(C[NH2+]C[C@@H]2CCO[C@@H](C)C2)c1[O-] ZINC000271591063 521365351 /nfs/dbraw/zinc/36/53/51/521365351.db2.gz ZUQNTENNXRIMCI-QWHCGFSZSA-N 0 3 279.380 2.696 20 10 CFCDHN CCN(Cc1[nH]ncc1C)Cc1ccc(N(C)C)cc1 ZINC000284039701 521445326 /nfs/dbraw/zinc/44/53/26/521445326.db2.gz LRSWBMGLAWGDCM-UHFFFAOYSA-N 0 3 272.396 2.806 20 10 CFCDHN CCCN(CC)CC[NH2+]Cc1cc(C)ccc1[O-] ZINC000223226620 521608236 /nfs/dbraw/zinc/60/82/36/521608236.db2.gz NESHTPYQMQIAEZ-UHFFFAOYSA-N 0 3 250.386 2.522 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000087015294 521657461 /nfs/dbraw/zinc/65/74/61/521657461.db2.gz WNLCUUCOTSSCEF-NSHDSACASA-N 0 3 267.369 2.603 20 10 CFCDHN CCOCC(C)(C)C[NH2+]Cc1cccc(C)c1[O-] ZINC000290080564 521669417 /nfs/dbraw/zinc/66/94/17/521669417.db2.gz GLGLFUDNLYROGS-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@H](C)c2cc(C)ccc2[O-])CCC1 ZINC000277372169 521733587 /nfs/dbraw/zinc/73/35/87/521733587.db2.gz XAVJKOPSRZHDRJ-CYBMUJFWSA-N 0 3 290.407 2.658 20 10 CFCDHN CN(C)[C@@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccccc1 ZINC000226618982 522030196 /nfs/dbraw/zinc/03/01/96/522030196.db2.gz ODXIXJDODVQGDN-INIZCTEOSA-N 0 3 288.366 2.924 20 10 CFCDHN CC[C@H](C[NH2+]Cc1cc(Cl)cc(C)c1[O-])OC ZINC000290378681 522194510 /nfs/dbraw/zinc/19/45/10/522194510.db2.gz AXCMCOFIQPNQCW-GFCCVEGCSA-N 0 3 257.761 2.869 20 10 CFCDHN CN(C)c1ccc(CN[C@@]2(CO)CCc3ccccc32)cc1 ZINC000305150068 522211752 /nfs/dbraw/zinc/21/17/52/522211752.db2.gz KCZMCNZRUWIJID-LJQANCHMSA-N 0 3 296.414 2.676 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2CCCc3nn(C)cc32)cc1 ZINC000280272500 522212226 /nfs/dbraw/zinc/21/22/26/522212226.db2.gz XYOXNZDDWJDHHG-MRXNPFEDSA-N 0 3 284.407 2.653 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](OC)C(C)C)c1[O-] ZINC000273729897 522540178 /nfs/dbraw/zinc/54/01/78/522540178.db2.gz KAZWUQWCMWMZAV-ZDUSSCGKSA-N 0 3 287.787 2.815 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC2CCOCC2)c1[O-] ZINC000228672971 522540391 /nfs/dbraw/zinc/54/03/91/522540391.db2.gz ZTSFIFXIGXKNOC-UHFFFAOYSA-N 0 3 285.771 2.570 20 10 CFCDHN CC[C@H]([NH2+]CCCC(=O)N(C)C)c1ccc(C)cc1[O-] ZINC000280003429 522577663 /nfs/dbraw/zinc/57/76/63/522577663.db2.gz GDXIBUJWUOCWSK-AWEZNQCLSA-N 0 3 278.396 2.610 20 10 CFCDHN CC[C@H]([NH2+]CCC[C@@H](C)O)c1ccc(C)cc1[O-] ZINC000280077165 522585620 /nfs/dbraw/zinc/58/56/20/522585620.db2.gz LLSRAAARNYZKHF-OCCSQVGLSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]([NH2+]CCN(C)CCCOC)c1ccc(C)cc1[O-] ZINC000279918885 522589352 /nfs/dbraw/zinc/58/93/52/522589352.db2.gz ABSSECVOXOOOQK-INIZCTEOSA-N 0 3 294.439 2.710 20 10 CFCDHN COC1CC[NH+](Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000271812035 522704284 /nfs/dbraw/zinc/70/42/84/522704284.db2.gz NLUFLAUZYFBRGA-UHFFFAOYSA-N 0 3 269.772 2.965 20 10 CFCDHN CC[C@H]([NH2+][C@H](CCO)C(C)C)c1ccccc1[O-] ZINC000156059868 522744087 /nfs/dbraw/zinc/74/40/87/522744087.db2.gz VEWWRDQRLBTAHQ-UONOGXRCSA-N 0 3 251.370 2.840 20 10 CFCDHN COc1cc([O-])c(C[NH2+]CCC=C(C)C)cc1OC ZINC000276698038 522779096 /nfs/dbraw/zinc/77/90/96/522779096.db2.gz ATIQYENHXTZZBT-UHFFFAOYSA-N 0 3 265.353 2.855 20 10 CFCDHN COc1cc(O)c(CNCc2occc2C)cc1OC ZINC000292753317 522781185 /nfs/dbraw/zinc/78/11/85/522781185.db2.gz ISBUYVIYRKNDBF-UHFFFAOYSA-N 0 3 277.320 2.601 20 10 CFCDHN CC[C@@H]([NH2+]CC1(C)OCCO1)c1ccc(C)cc1[O-] ZINC000280175844 522817581 /nfs/dbraw/zinc/81/75/81/522817581.db2.gz RKKKDXPFQHJGMQ-CYBMUJFWSA-N 0 3 265.353 2.504 20 10 CFCDHN CC[C@@H]([NH2+]CC(O)(CC)CC)c1ccccc1[O-] ZINC000087015316 522818777 /nfs/dbraw/zinc/81/87/77/522818777.db2.gz JPYPJWRBIOJUBB-CYBMUJFWSA-N 0 3 251.370 2.984 20 10 CFCDHN CC[C@@H]([NH2+]CCCN1CCOC1=O)c1ccc(C)cc1[O-] ZINC000279952364 522827596 /nfs/dbraw/zinc/82/75/96/522827596.db2.gz BWVNNCJKZTWGML-CQSZACIVSA-N 0 3 292.379 2.584 20 10 CFCDHN CC[C@@H]([NH2+]CCC[C@@H](C)CO)c1ccccc1[O-] ZINC000229565050 522830551 /nfs/dbraw/zinc/83/05/51/522830551.db2.gz UYPSVIKKMZLJJE-TZMCWYRMSA-N 0 3 251.370 2.842 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000230865490 522985041 /nfs/dbraw/zinc/98/50/41/522985041.db2.gz UUDXLBNRABVDEB-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN CN(Cc1ccccc1O)[C@H]1CCc2ccccc2NC1=O ZINC000192102778 523389075 /nfs/dbraw/zinc/38/90/75/523389075.db2.gz NZWARFBLXBETQD-INIZCTEOSA-N 0 3 296.370 2.778 20 10 CFCDHN CO[C@@H](C)[C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000290932124 523431694 /nfs/dbraw/zinc/43/16/94/523431694.db2.gz PBUHAFCGSMMTEM-ZJUUUORDSA-N 0 3 257.761 2.867 20 10 CFCDHN C[N@@H+]1CCC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000228183249 523833414 /nfs/dbraw/zinc/83/34/14/523833414.db2.gz XZIJPZZQSAQDIR-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN C[N@H+]1CCC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000228183249 523833419 /nfs/dbraw/zinc/83/34/19/523833419.db2.gz XZIJPZZQSAQDIR-IUODEOHRSA-N 0 3 294.826 2.962 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297918729 523921230 /nfs/dbraw/zinc/92/12/30/523921230.db2.gz XAVPSVYWHWWDLI-GXTWGEPZSA-N 0 3 262.397 2.699 20 10 CFCDHN COc1ccc(CNCc2cc(C)ccc2O)cc1O ZINC000172117767 524072323 /nfs/dbraw/zinc/07/23/23/524072323.db2.gz ZNNVYBDLHSOAIP-UHFFFAOYSA-N 0 3 273.332 2.705 20 10 CFCDHN COc1ccc(CN[C@H]2CCCc3nn(C)cc32)cc1C ZINC000280126096 524091989 /nfs/dbraw/zinc/09/19/89/524091989.db2.gz OPPURSMTSJWREK-HNNXBMFYSA-N 0 3 285.391 2.904 20 10 CFCDHN Cc1cccc(CC[NH2+][C@@H](C)c2ccccc2[O-])n1 ZINC000280064152 524363647 /nfs/dbraw/zinc/36/36/47/524363647.db2.gz KPZJHVZIMPIOOX-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN COc1ccc(N2CCN(CCCSC)CC2)cc1 ZINC000075594745 524424017 /nfs/dbraw/zinc/42/40/17/524424017.db2.gz QBPCOIGUUKNCFM-UHFFFAOYSA-N 0 3 280.437 2.570 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C2CC2)C(C)(C)CO)c1[O-] ZINC000290829709 524440415 /nfs/dbraw/zinc/44/04/15/524440415.db2.gz HKYHXUWCJKJDKN-OAHLLOKOSA-N 0 3 263.381 2.587 20 10 CFCDHN C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094617919 524477398 /nfs/dbraw/zinc/47/73/98/524477398.db2.gz WAGUPFMIBCMRKV-QWRGUYRKSA-N 0 3 254.349 2.522 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@@H](CSC)C2)c1 ZINC000292697803 524738038 /nfs/dbraw/zinc/73/80/38/524738038.db2.gz BZCYTQZOPBRTCF-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@@H](CSC)C2)c1 ZINC000292697803 524738052 /nfs/dbraw/zinc/73/80/52/524738052.db2.gz BZCYTQZOPBRTCF-GFCCVEGCSA-N 0 3 281.421 2.976 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2COc3ccccc32)c1 ZINC000290110397 524753947 /nfs/dbraw/zinc/75/39/47/524753947.db2.gz IHMHDCYFWCEFCZ-CYBMUJFWSA-N 0 3 285.343 2.667 20 10 CFCDHN C[C@@H](CO)N(C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000289427120 524788923 /nfs/dbraw/zinc/78/89/23/524788923.db2.gz KDLZCYWICQVHGN-JTQLQIEISA-N 0 3 290.329 2.584 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](O)C(C)(C)C2)c1[O-] ZINC000280483987 524866516 /nfs/dbraw/zinc/86/65/16/524866516.db2.gz OGAURCYESNEUQO-LBPRGKRZSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](O)C(C)(C)C2)c1[O-] ZINC000280483987 524866524 /nfs/dbraw/zinc/86/65/24/524866524.db2.gz OGAURCYESNEUQO-LBPRGKRZSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCCCCO)c1[O-] ZINC000193161264 524868590 /nfs/dbraw/zinc/86/85/90/524868590.db2.gz IIHXBHNZSPTTCP-UHFFFAOYSA-N 0 3 257.761 2.606 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@](C)(O)C(F)(F)F)c1[O-] ZINC000271785306 524871152 /nfs/dbraw/zinc/87/11/52/524871152.db2.gz FLQONXBZOHNGGX-NSHDSACASA-N 0 3 297.704 2.757 20 10 CFCDHN COc1ncccc1CN[C@@H](C)c1ccc(C)cc1O ZINC000037650333 525060289 /nfs/dbraw/zinc/06/02/89/525060289.db2.gz ZAWWDHRZMRONKS-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)N(C)C)c1cc(F)ccc1[O-] ZINC000094616857 525309893 /nfs/dbraw/zinc/30/98/93/525309893.db2.gz YCXDJXCQAVLILK-JTQLQIEISA-N 0 3 254.349 2.522 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@@H](n3cccn3)C2)cc1C ZINC000291173768 525317612 /nfs/dbraw/zinc/31/76/12/525317612.db2.gz RZCWSKHZXWKVCX-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@@H](n3cccn3)C2)cc1C ZINC000291173768 525317620 /nfs/dbraw/zinc/31/76/20/525317620.db2.gz RZCWSKHZXWKVCX-OAHLLOKOSA-N 0 3 271.364 2.653 20 10 CFCDHN C[C@H]([NH2+]CC1(O)CCCCC1)c1cc(F)ccc1[O-] ZINC000094618382 525318937 /nfs/dbraw/zinc/31/89/37/525318937.db2.gz NRUYWIALZGRWTR-NSHDSACASA-N 0 3 267.344 2.877 20 10 CFCDHN Cc1cc(O)c(CN[C@]2(CO)CCc3ccccc32)cc1C ZINC000305121302 525323197 /nfs/dbraw/zinc/32/31/97/525323197.db2.gz BLWDHERRELMBFX-IBGZPJMESA-N 0 3 297.398 2.933 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@]2(CO)CCc3ccccc32)cc1C ZINC000305121302 525323205 /nfs/dbraw/zinc/32/32/05/525323205.db2.gz BLWDHERRELMBFX-IBGZPJMESA-N 0 3 297.398 2.933 20 10 CFCDHN C[C@H]([NH2+]CCCOCC1CC1)c1cc(F)ccc1[O-] ZINC000094616975 525342481 /nfs/dbraw/zinc/34/24/81/525342481.db2.gz QAYGKSQGCYTJQO-NSHDSACASA-N 0 3 267.344 2.999 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1 ZINC000368766935 525350606 /nfs/dbraw/zinc/35/06/06/525350606.db2.gz VPIDIMIHMDHWME-DLBZAZTESA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)c1 ZINC000264990817 525352607 /nfs/dbraw/zinc/35/26/07/525352607.db2.gz XBJFJOZVBFWJGG-CQSZACIVSA-N 0 3 284.359 2.968 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c1 ZINC000271524596 525355712 /nfs/dbraw/zinc/35/57/12/525355712.db2.gz NJNLZAWZXGMYCC-HOCLYGCPSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)Cn2cccn2)c1 ZINC000037155950 525361881 /nfs/dbraw/zinc/36/18/81/525361881.db2.gz LKRNKIGNYOBQKM-CHWSQXEVSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c1 ZINC000300419167 525365313 /nfs/dbraw/zinc/36/53/13/525365313.db2.gz RARCGTAWHDJNFE-PEYYIBSZSA-N 0 3 261.365 2.919 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1cc(F)ccc1[O-] ZINC000094616606 525414494 /nfs/dbraw/zinc/41/44/94/525414494.db2.gz MIYATHRIBVTAGO-LLVKDONJSA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@@H](NCc1ccc(N2CCCC2)cc1)c1cn[nH]c1 ZINC000229883117 525525486 /nfs/dbraw/zinc/52/54/86/525525486.db2.gz OVVXUYMOCWNLQH-CYBMUJFWSA-N 0 3 270.380 2.861 20 10 CFCDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000222484570 525610113 /nfs/dbraw/zinc/61/01/13/525610113.db2.gz UNFKFOZKKUBGNX-NWDGAFQWSA-N 0 3 258.369 2.888 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])c1cnn(C)c1 ZINC000273370954 525657721 /nfs/dbraw/zinc/65/77/21/525657721.db2.gz CJQZOMYEBDBKQT-NXEZZACHSA-N 0 3 263.316 2.677 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCCCO)c([O-])c1C ZINC000279825181 525725700 /nfs/dbraw/zinc/72/57/00/525725700.db2.gz BUXTZLBRQZPABT-CYBMUJFWSA-N 0 3 251.370 2.822 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(C3CC3)C2)c([O-])c1 ZINC000037649049 525727958 /nfs/dbraw/zinc/72/79/58/525727958.db2.gz IAACUQGPBGHZGM-KGLIPLIRSA-N 0 3 274.408 2.836 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2)c([O-])c1 ZINC000273462957 525741303 /nfs/dbraw/zinc/74/13/03/525741303.db2.gz DCUMPTLFJAZLMG-NWDGAFQWSA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@H](O)CN(C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000291036094 525743734 /nfs/dbraw/zinc/74/37/34/525743734.db2.gz FTZNYFLJFUAYCE-JTQLQIEISA-N 0 3 290.329 2.584 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOCC(F)F)c([O-])c1C ZINC000276660729 525919269 /nfs/dbraw/zinc/91/92/69/525919269.db2.gz NTUUWDZPZYRDDB-NSHDSACASA-N 0 3 273.323 2.941 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)Cn2ccnc2)c([O-])c1 ZINC000037156851 525934480 /nfs/dbraw/zinc/93/44/80/525934480.db2.gz CRQWZQZPCXHGRH-STQMWFEESA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)Cn2ccnc2)c([O-])c1 ZINC000037156855 525941330 /nfs/dbraw/zinc/94/13/30/525941330.db2.gz CRQWZQZPCXHGRH-OLZOCXBDSA-N 0 3 259.353 2.636 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c1[O-] ZINC000290613044 526033895 /nfs/dbraw/zinc/03/38/95/526033895.db2.gz WQMKXVZZXVMEMR-USXIJHARSA-N 0 3 281.355 2.829 20 10 CFCDHN Cc1ccc(C(=O)NCC[NH2+][C@H](C)c2ccccc2[O-])cc1 ZINC000193911648 526167731 /nfs/dbraw/zinc/16/77/31/526167731.db2.gz XQFQWBOZSXOUPH-CQSZACIVSA-N 0 3 298.386 2.781 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CCCC(F)(F)F)OCO2 ZINC000097988755 526336766 /nfs/dbraw/zinc/33/67/66/526336766.db2.gz GYXDEZFWQKVHIP-UHFFFAOYSA-N 0 3 277.242 2.553 20 10 CFCDHN c1cc(CNCc2ccc(N3CCOCC3)cc2)cs1 ZINC000057993260 526428353 /nfs/dbraw/zinc/42/83/53/526428353.db2.gz YBTYBICBKVHETO-UHFFFAOYSA-N 0 3 288.416 2.875 20 10 CFCDHN [NH2+]=C(NCc1c([O-])ccc2c1CCCC2)NC1CCCC1 ZINC000172838897 526826640 /nfs/dbraw/zinc/82/66/40/526826640.db2.gz VRTKEENPQQHTQO-UHFFFAOYSA-N 0 3 287.407 2.828 20 10 CFCDHN Cc1nccn1CC[NH2+][C@H](C)c1cc(C)ccc1[O-] ZINC000273595872 527433970 /nfs/dbraw/zinc/43/39/70/527433970.db2.gz QMSXWFBTZFDBJN-GFCCVEGCSA-N 0 3 259.353 2.556 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC12CCC(CO)CC2 ZINC000361049089 527529248 /nfs/dbraw/zinc/52/92/48/527529248.db2.gz BJXFLHWMWRIPTK-UHFFFAOYSA-N 0 3 261.365 2.519 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC12CCC(CO)CC2 ZINC000361049089 527529249 /nfs/dbraw/zinc/52/92/49/527529249.db2.gz BJXFLHWMWRIPTK-UHFFFAOYSA-N 0 3 261.365 2.519 20 10 CFCDHN C[C@H]1COCCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000753987739 574061220 /nfs/dbraw/zinc/06/12/20/574061220.db2.gz SZYICRGBVMFZNF-GFCCVEGCSA-N 0 3 293.407 2.864 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CC2(C)OCCCO2)c2c1c(F)ccc2[O-] ZINC000754123921 574075690 /nfs/dbraw/zinc/07/56/90/574075690.db2.gz RHXLAPSBQOJPNF-JQWIXIFHSA-N 0 3 295.354 2.822 20 10 CFCDHN COc1ccc(N2CCN(C[C@@H]3C[C@@H]3C)CC2)cc1F ZINC000754127172 574076511 /nfs/dbraw/zinc/07/65/11/574076511.db2.gz SOXRALRTMXFTCV-STQMWFEESA-N 0 3 278.371 2.612 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCn2ccnc2)c2c1c(F)ccc2[O-] ZINC000756369722 574097834 /nfs/dbraw/zinc/09/78/34/574097834.db2.gz CYGJAKJSNYJTNC-CMPLNLGQSA-N 0 3 275.327 2.566 20 10 CFCDHN C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)c2cc([O-])cs2)C1 ZINC000731871946 574131403 /nfs/dbraw/zinc/13/14/03/574131403.db2.gz RCQIJMCAMPKVOZ-VXGBXAGGSA-N 0 3 296.436 2.552 20 10 CFCDHN CN(CC[N@H+](C)C1CCCCC1)C(=O)c1cc([O-])cs1 ZINC000732274364 574148900 /nfs/dbraw/zinc/14/89/00/574148900.db2.gz NLIVWFDUCACZHG-UHFFFAOYSA-N 0 3 296.436 2.790 20 10 CFCDHN CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc([O-])cs1 ZINC000732274364 574148901 /nfs/dbraw/zinc/14/89/01/574148901.db2.gz NLIVWFDUCACZHG-UHFFFAOYSA-N 0 3 296.436 2.790 20 10 CFCDHN COC[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2[O-])C1 ZINC000739870912 574227000 /nfs/dbraw/zinc/22/70/00/574227000.db2.gz AQWNUTYTPYOERG-GFCCVEGCSA-N 0 3 293.407 2.864 20 10 CFCDHN COC[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2[O-])C1 ZINC000739870912 574227003 /nfs/dbraw/zinc/22/70/03/574227003.db2.gz AQWNUTYTPYOERG-GFCCVEGCSA-N 0 3 293.407 2.864 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@H](C2CC2)N(C)C)c([O-])c1 ZINC000756434230 574237186 /nfs/dbraw/zinc/23/71/86/574237186.db2.gz VIBNZSKEFWDIMS-WFASDCNBSA-N 0 3 262.397 2.691 20 10 CFCDHN COC[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756467777 574239399 /nfs/dbraw/zinc/23/93/99/574239399.db2.gz YLOFHXKQYZQIGZ-CKYFFXLPSA-N 0 3 267.344 2.952 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)Cc2cnccn2)c1 ZINC000756496095 574241470 /nfs/dbraw/zinc/24/14/70/574241470.db2.gz UXXNBKHGDHHACS-QWHCGFSZSA-N 0 3 271.364 2.772 20 10 CFCDHN COC(=O)N1CCC[C@@H]([NH2+][C@H](C)c2cc(C)ccc2[O-])C1 ZINC000756528667 574243534 /nfs/dbraw/zinc/24/35/34/574243534.db2.gz OPGNVCHIFMKJDX-CHWSQXEVSA-N 0 3 292.379 2.582 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCCN2CCCCC2=O)c([O-])c1 ZINC000756557397 574247155 /nfs/dbraw/zinc/24/71/55/574247155.db2.gz SIFLJOSFCMVELH-CQSZACIVSA-N 0 3 290.407 2.754 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756573660 574249374 /nfs/dbraw/zinc/24/93/74/574249374.db2.gz BQLUZIZQABSFRU-NHCYSSNCSA-N 0 3 267.344 2.830 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756573656 574249385 /nfs/dbraw/zinc/24/93/85/574249385.db2.gz BQLUZIZQABSFRU-JFGNBEQYSA-N 0 3 267.344 2.830 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)c2ccc(C)o2)c1 ZINC000756606014 574252069 /nfs/dbraw/zinc/25/20/69/574252069.db2.gz KOZLUDZQBUXRJU-IAQYHMDHSA-N 0 3 291.347 2.686 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN2CC[C@H](C)C2)c1 ZINC000756630472 574254059 /nfs/dbraw/zinc/25/40/59/574254059.db2.gz WHUKRRSVPSLSBA-KBPBESRZSA-N 0 3 262.397 2.693 20 10 CFCDHN C[C@H]([NH2+]CC1(CO)CC1)c1cc2c(cc1[O-])CCCC2 ZINC000756639129 574254729 /nfs/dbraw/zinc/25/47/29/574254729.db2.gz YFWGISJXEJQTFK-LBPRGKRZSA-N 0 3 275.392 2.694 20 10 CFCDHN C[C@H](C[C@H]1CCOC1)[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000756645053 574255471 /nfs/dbraw/zinc/25/54/71/574255471.db2.gz DLMKKVKCKOEGAQ-IJLUTSLNSA-N 0 3 267.344 2.997 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCn2cccn2)c2c1c(F)ccc2[O-] ZINC000756684505 574257377 /nfs/dbraw/zinc/25/73/77/574257377.db2.gz KJDCBOASZUKWIY-JQWIXIFHSA-N 0 3 275.327 2.566 20 10 CFCDHN CCn1cnnc1CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756732757 574259653 /nfs/dbraw/zinc/25/96/53/574259653.db2.gz LDHZJFUZHIFCCV-CYBMUJFWSA-N 0 3 288.395 2.514 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCc2cnccn2)c2c1c(F)ccc2[O-] ZINC000756785979 574262722 /nfs/dbraw/zinc/26/27/22/574262722.db2.gz HKEQNTDVIOWRQO-MFKMUULPSA-N 0 3 287.338 2.702 20 10 CFCDHN COc1ccc(O)c([C@H](C)NC[C@@H](OC)C(F)(F)F)c1 ZINC000756835995 574266773 /nfs/dbraw/zinc/26/67/73/574266773.db2.gz RMWSBZFLYYJNFJ-QPUJVOFHSA-N 0 3 293.285 2.629 20 10 CFCDHN CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1[O-])C(F)(F)F ZINC000756834736 574266901 /nfs/dbraw/zinc/26/69/01/574266901.db2.gz JGMJEPYVJVTFTR-CABZTGNLSA-N 0 3 277.286 2.929 20 10 CFCDHN CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1[O-])C(F)(F)F ZINC000756834738 574266914 /nfs/dbraw/zinc/26/69/14/574266914.db2.gz JGMJEPYVJVTFTR-JOYOIKCWSA-N 0 3 277.286 2.929 20 10 CFCDHN CC(=O)Nc1ccccc1CNCc1cc(C)ccc1O ZINC000742375679 574325556 /nfs/dbraw/zinc/32/55/56/574325556.db2.gz RFOVLUCGMIWKBE-UHFFFAOYSA-N 0 3 284.359 2.949 20 10 CFCDHN CC(=O)Nc1ccccc1C[NH2+]Cc1cc(C)ccc1[O-] ZINC000742375679 574325557 /nfs/dbraw/zinc/32/55/57/574325557.db2.gz RFOVLUCGMIWKBE-UHFFFAOYSA-N 0 3 284.359 2.949 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCN(C)[C@H](C)C2)cc1C ZINC000742375351 574325571 /nfs/dbraw/zinc/32/55/71/574325571.db2.gz PZMMLPFMTFWWOT-HIFRSBDPSA-N 0 3 262.397 2.581 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@@H]2CCOC2)c1[O-] ZINC000753592114 574405742 /nfs/dbraw/zinc/40/57/42/574405742.db2.gz WMJCKFFRMQVUCU-LLVKDONJSA-N 0 3 269.772 2.870 20 10 CFCDHN COc1ccc(C[N@H+](C)[C@H](C)CCSC)c([O-])c1OC ZINC000892083484 617943098 /nfs/dbraw/zinc/94/30/98/617943098.db2.gz JFOLFDFITGBZAG-LLVKDONJSA-N 0 3 299.436 2.983 20 10 CFCDHN COc1ccc(C[N@@H+](C)[C@H](C)CCSC)c([O-])c1OC ZINC000892083484 617943102 /nfs/dbraw/zinc/94/31/02/617943102.db2.gz JFOLFDFITGBZAG-LLVKDONJSA-N 0 3 299.436 2.983 20 10 CFCDHN COc1cc(O)c(CN2C[C@@H](C)S[C@@H](C)C2)cc1OC ZINC000160301241 617965086 /nfs/dbraw/zinc/96/50/86/617965086.db2.gz DOWFYRMGQBGPCF-PHIMTYICSA-N 0 3 297.420 2.735 20 10 CFCDHN COc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)c([O-])c1OC ZINC000891449188 618213950 /nfs/dbraw/zinc/21/39/50/618213950.db2.gz NUFXXLVVPHQMQU-VXGBXAGGSA-N 0 3 279.380 2.887 20 10 CFCDHN CCC[C@](C)(O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000229554662 618218036 /nfs/dbraw/zinc/21/80/36/618218036.db2.gz QQVRBELDSFOZGQ-ZFWWWQNUSA-N 0 3 251.370 2.984 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@@H]2C)c1[O-] ZINC000310286529 618276974 /nfs/dbraw/zinc/27/69/74/618276974.db2.gz MKPJLQRBLRQSFW-GZMMTYOYSA-N 0 3 255.745 2.942 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@](C)(O)C2CC2)c1[O-] ZINC000776173822 618420559 /nfs/dbraw/zinc/42/05/59/618420559.db2.gz AACRSTTZYPOVNH-CQSZACIVSA-N 0 3 269.772 2.605 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc(F)cc2C)c([O-])c1 ZINC000894185591 618432668 /nfs/dbraw/zinc/43/26/68/618432668.db2.gz QICINALUVVJHSL-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CC[C@H](C(=O)OC)C1)c1ccccc1[O-] ZINC000193876372 618475582 /nfs/dbraw/zinc/47/55/82/618475582.db2.gz LTKIFCSDKVOSCJ-SCRDCRAPSA-N 0 3 277.364 2.775 20 10 CFCDHN CC1=NO[C@@H](CNC/C=C\c2ccc(N(C)C)cc2)C1 ZINC000895300772 618520242 /nfs/dbraw/zinc/52/02/42/618520242.db2.gz TXGPSYYOVJTXEJ-YIEVGGLXSA-N 0 3 273.380 2.520 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2cccc(OC)n2)c1 ZINC000182325454 625285552 /nfs/dbraw/zinc/28/55/52/625285552.db2.gz TVHJJDUVDOEHSC-NSHDSACASA-N 0 3 288.347 2.655 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@@H](C)C(=O)NC(C)C)cc1 ZINC000840890278 618724338 /nfs/dbraw/zinc/72/43/38/618724338.db2.gz LYXBAMVYODRXOQ-KBPBESRZSA-N 0 3 291.439 2.706 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@H]1CCC[C@@H](O)C1)CC2 ZINC000311948733 618772426 /nfs/dbraw/zinc/77/24/26/618772426.db2.gz XKVGIYQJCPHAAR-MRVWCRGKSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1COCC1(C)C)c1cc(F)ccc1[O-] ZINC000313061241 618974229 /nfs/dbraw/zinc/97/42/29/618974229.db2.gz HZMMKTWVRFKMCT-NOZJJQNGSA-N 0 3 253.317 2.607 20 10 CFCDHN CCc1ncc(CN[C@@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000840938181 619077829 /nfs/dbraw/zinc/07/78/29/619077829.db2.gz LPDUNDLPFGDGRA-ZDUSSCGKSA-N 0 3 284.407 2.956 20 10 CFCDHN C[C@@H]([NH2+]C[C@@]1(C(F)(F)F)CCCN1)c1ccccc1[O-] ZINC000925851651 619183001 /nfs/dbraw/zinc/18/30/01/619183001.db2.gz BWUQFBABRWBZOP-ZWNOBZJWSA-N 0 3 288.313 2.727 20 10 CFCDHN C[C@H]([NH2+]C[C@]1(C(F)(F)F)CCCN1)c1ccccc1[O-] ZINC000925851633 619183147 /nfs/dbraw/zinc/18/31/47/619183147.db2.gz BWUQFBABRWBZOP-GWCFXTLKSA-N 0 3 288.313 2.727 20 10 CFCDHN CC(C)(C[NH2+]Cc1cc(F)ccc1[O-])c1cccnc1 ZINC000840974441 619194246 /nfs/dbraw/zinc/19/42/46/619194246.db2.gz AYFQDEUQUMHYCO-UHFFFAOYSA-N 0 3 274.339 2.994 20 10 CFCDHN CC(C)n1cncc1CNCc1ccc(N(C)C)cc1 ZINC000090207687 619202737 /nfs/dbraw/zinc/20/27/37/619202737.db2.gz RTGWFLILEKRTKP-UHFFFAOYSA-N 0 3 272.396 2.820 20 10 CFCDHN COc1cc(C)cc(CNCc2scnc2C)c1O ZINC000894240313 619276549 /nfs/dbraw/zinc/27/65/49/619276549.db2.gz RJEVREZGKLBOEE-UHFFFAOYSA-N 0 3 278.377 2.764 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](O)Cc1ccc(F)cc1 ZINC000895753143 619599827 /nfs/dbraw/zinc/59/98/27/619599827.db2.gz OORADGLCBRVHLB-OAHLLOKOSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@]1(Br)C[C@@H]1CN1Cc2cccc(O)c2C1 ZINC000895786070 619606665 /nfs/dbraw/zinc/60/66/65/619606665.db2.gz WXKRQUKEDFYQSF-MFKMUULPSA-N 0 3 282.181 2.881 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000896281268 619709198 /nfs/dbraw/zinc/70/91/98/619709198.db2.gz VKYLFZURVKOXTC-GXFFZTMASA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1nn(C)c(Cl)c1C[NH2+]Cc1c([O-])cccc1F ZINC000896639276 619780920 /nfs/dbraw/zinc/78/09/20/619780920.db2.gz CFGCENXKPUFUPP-UHFFFAOYSA-N 0 3 283.734 2.516 20 10 CFCDHN Cc1nn(C)c(Cl)c1CNCc1c(O)cccc1F ZINC000896639276 619780922 /nfs/dbraw/zinc/78/09/22/619780922.db2.gz CFGCENXKPUFUPP-UHFFFAOYSA-N 0 3 283.734 2.516 20 10 CFCDHN COc1ccc(O)c(CN[C@H]2CCCc3cccnc32)c1 ZINC000897075369 619923351 /nfs/dbraw/zinc/92/33/51/619923351.db2.gz MMDFQLAKAUGOOR-HNNXBMFYSA-N 0 3 284.359 2.963 20 10 CFCDHN COC[C@@H]([NH2+]Cc1cc(Cl)cc(OC)c1[O-])C(C)C ZINC000228674567 620072723 /nfs/dbraw/zinc/07/27/23/620072723.db2.gz LCKDZFCXCZGJPD-GFCCVEGCSA-N 0 3 287.787 2.815 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2CC[C@H](C3CC3)O2)c([O-])c1 ZINC000897501050 620192170 /nfs/dbraw/zinc/19/21/70/620192170.db2.gz LTTJZRNLRQRUDA-GOEBONIOSA-N 0 3 261.365 2.748 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CC3(C2)CO[C@@H](C)C3)c([O-])c1 ZINC000897780863 620283946 /nfs/dbraw/zinc/28/39/46/620283946.db2.gz JQCDEFIAYJKOPD-MKQDKFQKSA-N 0 3 291.391 2.838 20 10 CFCDHN CCCOc1ccc(CN[C@@H]2COCC[C@H]2OC)cc1C ZINC000897889038 620299000 /nfs/dbraw/zinc/29/90/00/620299000.db2.gz LZHVCFBLWHHJRY-NVXWUHKLSA-N 0 3 293.407 2.677 20 10 CFCDHN CC1(C)CC2(CC([NH2+]Cc3cc(F)ccc3[O-])C2)CO1 ZINC000897972961 620306833 /nfs/dbraw/zinc/30/68/33/620306833.db2.gz KDYFCDCBWBNDDD-UHFFFAOYSA-N 0 3 279.355 2.969 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C[C@H](CO)C2)c1[O-] ZINC000927146582 620492798 /nfs/dbraw/zinc/49/27/98/620492798.db2.gz FUBKHOKLMRJUPD-CKYFFXLPSA-N 0 3 269.772 2.776 20 10 CFCDHN CC[C@@H](N[C@H]1C[NH2+]CC1(C)C)c1ccc(F)cc1[O-] ZINC000902445264 621083233 /nfs/dbraw/zinc/08/32/33/621083233.db2.gz PQDFLKDYXWTKCV-OCCSQVGLSA-N 0 3 266.360 2.570 20 10 CFCDHN C[C@H](N[C@H]1C[NH2+]CC1(C)C)c1cc(Cl)ccc1[O-] ZINC000902450792 621091491 /nfs/dbraw/zinc/09/14/91/621091491.db2.gz UKEYVLKADNNRDP-ZANVPECISA-N 0 3 268.788 2.694 20 10 CFCDHN CC[C@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902468926 621100516 /nfs/dbraw/zinc/10/05/16/621100516.db2.gz YJDSLANESLAMJD-VZZFWQQMSA-N 0 3 280.799 2.979 20 10 CFCDHN C[C@@H]1CC2(CC([NH2+][C@H]3CCc4cccc([O-])c43)C2)CO1 ZINC000903277887 621311132 /nfs/dbraw/zinc/31/11/32/621311132.db2.gz ANNDIFUNJDFIBW-DHFKXCJNSA-N 0 3 273.376 2.927 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C)[C@H]1C)c1ccc(C)cc1[O-] ZINC000903299799 621314447 /nfs/dbraw/zinc/31/44/47/621314447.db2.gz FCWXVPAJLWDBJT-AEGPPILISA-N 0 3 262.397 2.834 20 10 CFCDHN C[C@H]([NH2+]Cc1ccc(CCO)cc1)c1ccccc1[O-] ZINC000903395175 621353429 /nfs/dbraw/zinc/35/34/29/621353429.db2.gz BHYJKYNWDRSBRQ-ZDUSSCGKSA-N 0 3 271.360 2.778 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC[C@@H](O)C2CC2)c2c1c(F)ccc2[O-] ZINC000903404830 621361013 /nfs/dbraw/zinc/36/10/13/621361013.db2.gz ADWGLUNUXDMJRD-JIMOISOXSA-N 0 3 279.355 2.830 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COC[C@@H]1C1CC1)c1cc(F)ccc1[O-] ZINC000903438629 621375483 /nfs/dbraw/zinc/37/54/83/621375483.db2.gz WEKMTAWHHJRLLM-CUOATXAZSA-N 0 3 265.328 2.607 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCN1CCOC)c1ccccc1[O-] ZINC000155605046 622307106 /nfs/dbraw/zinc/30/71/06/622307106.db2.gz OBBHRMKQARYHDN-GDBMZVCRSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@H]2OC)c1[O-] ZINC000228672419 623155832 /nfs/dbraw/zinc/15/58/32/623155832.db2.gz QTKHGUUJBKQYGH-VXGBXAGGSA-N 0 3 285.771 2.711 20 10 CFCDHN C[C@@H]([NH2+]CCCN1CCCC1)c1ccc(F)cc1[O-] ZINC000062745047 623293905 /nfs/dbraw/zinc/29/39/05/623293905.db2.gz AQYDCJRDHSSKQV-GFCCVEGCSA-N 0 3 266.360 2.668 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000062748329 623295792 /nfs/dbraw/zinc/29/57/92/623295792.db2.gz GUVPYCYVGAKTHA-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN C[C@@H]([NH3+])[C@@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000063191321 623330287 /nfs/dbraw/zinc/33/02/87/623330287.db2.gz VIGBSIBIUVWHCP-MFKMUULPSA-N 0 3 268.788 2.747 20 10 CFCDHN COCC1CCC([NH2+]Cc2ccc(OC)cc2[O-])CC1 ZINC000824321688 623490452 /nfs/dbraw/zinc/49/04/52/623490452.db2.gz VGIXTKSMWPDBTR-UHFFFAOYSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCOC(C)C)c1[O-] ZINC000757978852 623497161 /nfs/dbraw/zinc/49/71/61/623497161.db2.gz WRVOXCHNESDRQF-UHFFFAOYSA-N 0 3 257.761 2.869 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCO[C@@H](C(C)C)C1 ZINC000824799324 623567932 /nfs/dbraw/zinc/56/79/32/623567932.db2.gz MOGJRLOPMSKBGU-SUMWQHHRSA-N 0 3 293.407 2.942 20 10 CFCDHN CC(C)[C@H](CO)[C@@H]([NH2+]Cc1ccccc1[O-])C(C)C ZINC000824847260 623577107 /nfs/dbraw/zinc/57/71/07/623577107.db2.gz XMTCBVJSEJXYPW-HOCLYGCPSA-N 0 3 265.397 2.771 20 10 CFCDHN CN1CC[C@@H]2C[N@H+](Cc3c([O-])ccc4ccccc43)C[C@@H]21 ZINC000824892867 623583787 /nfs/dbraw/zinc/58/37/87/623583787.db2.gz DDGOFOVSMIPLFU-PBHICJAKSA-N 0 3 282.387 2.681 20 10 CFCDHN CN1CC[C@@H]2C[N@@H+](Cc3c([O-])ccc4ccccc43)C[C@@H]21 ZINC000824892867 623583793 /nfs/dbraw/zinc/58/37/93/623583793.db2.gz DDGOFOVSMIPLFU-PBHICJAKSA-N 0 3 282.387 2.681 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@H]2C[C@H](OC)C23CCC3)c1[O-] ZINC000825103375 623629969 /nfs/dbraw/zinc/62/99/69/623629969.db2.gz DGLDPIOSOZQLQL-GJZGRUSLSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@H]2C[C@H](OC)C23CCC3)c1[O-] ZINC000825103375 623629971 /nfs/dbraw/zinc/62/99/71/623629971.db2.gz DGLDPIOSOZQLQL-GJZGRUSLSA-N 0 3 291.391 2.790 20 10 CFCDHN CO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103979 623631494 /nfs/dbraw/zinc/63/14/94/623631494.db2.gz JNLZRGDJSWQDPP-HUUCEWRRSA-N 0 3 279.355 2.921 20 10 CFCDHN CO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103979 623631497 /nfs/dbraw/zinc/63/14/97/623631497.db2.gz JNLZRGDJSWQDPP-HUUCEWRRSA-N 0 3 279.355 2.921 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@H](O)C2CCC2)c1[O-] ZINC000825240406 623656313 /nfs/dbraw/zinc/65/63/13/623656313.db2.gz KYSDDCZKWJFIDE-ZDUSSCGKSA-N 0 3 269.772 2.605 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]2OCC)c([O-])c1 ZINC000825284011 623663484 /nfs/dbraw/zinc/66/34/84/623663484.db2.gz CTRVSNFRUYJXCG-GDBMZVCRSA-N 0 3 279.380 2.838 20 10 CFCDHN CCN(CC)c1ccc(CN2C[C@H](O)C[C@H](C)C2)cc1F ZINC000825311339 623668922 /nfs/dbraw/zinc/66/89/22/623668922.db2.gz JFKPTAXTAFSUSN-DZGCQCFKSA-N 0 3 294.414 2.875 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000825320541 623670250 /nfs/dbraw/zinc/67/02/50/623670250.db2.gz KZZIVYROYNWMMA-YPMHNXCESA-N 0 3 282.815 2.926 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+](C)[C@H](C)C[S@](C)=O)cc1Cl ZINC000825505363 623704369 /nfs/dbraw/zinc/70/43/69/623704369.db2.gz XDTNPOCEKSDXFC-MGNBDDOMSA-N 0 3 289.828 2.553 20 10 CFCDHN Cc1cc([O-])c(C[N@H+](C)[C@H](C)C[S@](C)=O)cc1Cl ZINC000825505363 623704376 /nfs/dbraw/zinc/70/43/76/623704376.db2.gz XDTNPOCEKSDXFC-MGNBDDOMSA-N 0 3 289.828 2.553 20 10 CFCDHN CCCn1nccc1CN[C@@H](C)c1cc(OC)ccc1O ZINC000825935548 623771728 /nfs/dbraw/zinc/77/17/28/623771728.db2.gz XODCMELZIXYZKD-LBPRGKRZSA-N 0 3 289.379 2.858 20 10 CFCDHN Cc1cccc(CN2CCO[C@@](C)(C3CC3)C2)c1O ZINC000826877771 623901453 /nfs/dbraw/zinc/90/14/53/623901453.db2.gz LYBLATOFKVVLOI-MRXNPFEDSA-N 0 3 261.365 2.702 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@]3(O)C[C@H]3C2)cc1F ZINC000827292736 623982564 /nfs/dbraw/zinc/98/25/64/623982564.db2.gz SCJZSJDLTGWUDL-WMLDXEAASA-N 0 3 292.398 2.629 20 10 CFCDHN CC1(C)[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])C1(F)F ZINC000827515502 624021925 /nfs/dbraw/zinc/02/19/25/624021925.db2.gz KDDHJNGCLCTCKJ-LLVKDONJSA-N 0 3 259.271 2.912 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)c1[O-] ZINC000827596131 624042005 /nfs/dbraw/zinc/04/20/05/624042005.db2.gz VGKADSLGPUHXKD-YPMHNXCESA-N 0 3 281.783 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1[O-] ZINC000827596131 624042008 /nfs/dbraw/zinc/04/20/08/624042008.db2.gz VGKADSLGPUHXKD-YPMHNXCESA-N 0 3 281.783 2.822 20 10 CFCDHN C[N@H+](CC1=CCSC1)Cc1cc(F)ccc1[O-] ZINC000827804849 624097139 /nfs/dbraw/zinc/09/71/39/624097139.db2.gz AVFIYCAHDDUHSL-UHFFFAOYSA-N 0 3 253.342 2.636 20 10 CFCDHN C[N@@H+](CC1=CCSC1)Cc1cc(F)ccc1[O-] ZINC000827804849 624097144 /nfs/dbraw/zinc/09/71/44/624097144.db2.gz AVFIYCAHDDUHSL-UHFFFAOYSA-N 0 3 253.342 2.636 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C2(CO)CCC2)c1[O-] ZINC000827903581 624124223 /nfs/dbraw/zinc/12/42/23/624124223.db2.gz KTPRJZQUHOVVIQ-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C2(CO)CCC2)c1[O-] ZINC000827903581 624124227 /nfs/dbraw/zinc/12/42/27/624124227.db2.gz KTPRJZQUHOVVIQ-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN C[C@@H](NC(=O)[C@H](C)N1CCCCCC1)c1ccccc1O ZINC000827937193 624131479 /nfs/dbraw/zinc/13/14/79/624131479.db2.gz OBHHKLXPJDPQCN-KGLIPLIRSA-N 0 3 290.407 2.834 20 10 CFCDHN CCN(CC[NH2+][C@@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000185308423 625710588 /nfs/dbraw/zinc/71/05/88/625710588.db2.gz IXRJHKCTIAYULX-NSHDSACASA-N 0 3 266.360 2.666 20 10 CFCDHN C[C@@H](CO)C[N@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000121392815 624783598 /nfs/dbraw/zinc/78/35/98/624783598.db2.gz IEVMBMSYCZFXIW-CYBMUJFWSA-N 0 3 275.348 2.616 20 10 CFCDHN C[C@@H](CO)C[N@@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000121392815 624783603 /nfs/dbraw/zinc/78/36/03/624783603.db2.gz IEVMBMSYCZFXIW-CYBMUJFWSA-N 0 3 275.348 2.616 20 10 CFCDHN Oc1cccc2c1[C@@H](NCc1ccc(F)cn1)CC2 ZINC000834625033 625740322 /nfs/dbraw/zinc/74/03/22/625740322.db2.gz SIXNDBQPKQFNKL-ZDUSSCGKSA-N 0 3 258.296 2.703 20 10 CFCDHN CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834702600 625791725 /nfs/dbraw/zinc/79/17/25/625791725.db2.gz SHVJABSJDANKDX-UMVBOHGHSA-N 0 3 261.365 2.784 20 10 CFCDHN Cc1ccc(C[NH2+]C2Cc3ccccc3C2)c([O-])c1 ZINC000083396433 625843472 /nfs/dbraw/zinc/84/34/72/625843472.db2.gz NSGBLKCVWOJEJX-UHFFFAOYSA-N 0 3 253.345 2.958 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834778809 625852753 /nfs/dbraw/zinc/85/27/53/625852753.db2.gz GLDOHGWVSIEKRN-IAGOWNOFSA-N 0 3 297.398 2.881 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+][C@@H]2CCc3cccc([O-])c32)cc1 ZINC000834779169 625854660 /nfs/dbraw/zinc/85/46/60/625854660.db2.gz IKNHSDAUWBHVGM-IAGOWNOFSA-N 0 3 297.398 2.881 20 10 CFCDHN CCCN1CCC[C@H]1C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834798291 625864697 /nfs/dbraw/zinc/86/46/97/625864697.db2.gz ATFSKQIBKWEJKF-GJZGRUSLSA-N 0 3 274.408 2.844 20 10 CFCDHN CCN1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(C)c2[O-])CC1=O ZINC000834888824 625910871 /nfs/dbraw/zinc/91/08/71/625910871.db2.gz QHOZOOYIJGLPJI-JQWIXIFHSA-N 0 3 296.798 2.625 20 10 CFCDHN C[C@@H](Cc1cnn(C)c1)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000834896691 625913623 /nfs/dbraw/zinc/91/36/23/625913623.db2.gz MPZYZLATRZKLSL-QWRGUYRKSA-N 0 3 277.343 2.547 20 10 CFCDHN CCO[C@@H]1COC[C@H]1[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000834904853 625917353 /nfs/dbraw/zinc/91/73/53/625917353.db2.gz RZRPGSPYRDMDDN-IIAWOOMASA-N 0 3 279.380 2.545 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cnc(C)cn2)c([O-])c1 ZINC000834908142 625919986 /nfs/dbraw/zinc/91/99/86/625919986.db2.gz HBIVLILDHQFJNS-ZDUSSCGKSA-N 0 3 271.364 2.692 20 10 CFCDHN CCC[N@H+](Cc1ccc(OCC)cc1[O-])CC(C)(C)O ZINC000769326200 625920076 /nfs/dbraw/zinc/92/00/76/625920076.db2.gz FWARDRLGBBRVFB-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN CCC[N@@H+](Cc1ccc(OCC)cc1[O-])CC(C)(C)O ZINC000769326200 625920078 /nfs/dbraw/zinc/92/00/78/625920078.db2.gz FWARDRLGBBRVFB-UHFFFAOYSA-N 0 3 281.396 2.774 20 10 CFCDHN Oc1ccccc1CNCc1nccc2c1CCCC2 ZINC000921652123 626047608 /nfs/dbraw/zinc/04/76/08/626047608.db2.gz POTLRSASTPKYIS-UHFFFAOYSA-N 0 3 268.360 2.956 20 10 CFCDHN COC(C)(C)[C@@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000922583286 626317857 /nfs/dbraw/zinc/31/78/57/626317857.db2.gz OPBFNFFJHNJEBJ-SNVBAGLBSA-N 0 3 286.366 2.934 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@]23CCC[C@H]2OCC3)c([O-])c1 ZINC000922699161 626344578 /nfs/dbraw/zinc/34/45/78/626344578.db2.gz RXUZZXAKMQKJQG-IAGOWNOFSA-N 0 3 291.391 2.840 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1CCCC2(CCC2)O1 ZINC000922814715 626369280 /nfs/dbraw/zinc/36/92/80/626369280.db2.gz ZDSKFRCFQUODOF-AWEZNQCLSA-N 0 3 261.365 2.974 20 10 CFCDHN CN(C)c1ccc(/C=C\CN2CC3(C2)CCOCC3)cc1 ZINC000839141074 626528490 /nfs/dbraw/zinc/52/84/90/626528490.db2.gz LQRLKBHTZFCIIK-ARJAWSKDSA-N 0 3 286.419 2.878 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000839191139 626530515 /nfs/dbraw/zinc/53/05/15/626530515.db2.gz FFAFHJYATMSHHA-DOTOQJQBSA-N 0 3 275.392 2.765 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000839191139 626530516 /nfs/dbraw/zinc/53/05/16/626530516.db2.gz FFAFHJYATMSHHA-DOTOQJQBSA-N 0 3 275.392 2.765 20 10 CFCDHN CC[C@H](N[C@@H](C)c1ccn(C)n1)c1ccccc1O ZINC000839192683 626530905 /nfs/dbraw/zinc/53/09/05/626530905.db2.gz VXOOEICTUYXKQS-AAEUAGOBSA-N 0 3 259.353 2.928 20 10 CFCDHN COc1cccc(O)c1CN[C@@H]1CN(C)Cc2ccccc21 ZINC000756995772 626543240 /nfs/dbraw/zinc/54/32/40/626543240.db2.gz PITWRBZTXRMMQK-MRXNPFEDSA-N 0 3 298.386 2.677 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NC2COC(C)(C)OC2)cc1 ZINC000757706026 626559894 /nfs/dbraw/zinc/55/98/94/626559894.db2.gz TVDVMKGPBPFWBV-ZDUSSCGKSA-N 0 3 292.423 2.945 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000760897100 626782956 /nfs/dbraw/zinc/78/29/56/626782956.db2.gz PDCYUBVVQRJOKW-ZWNOBZJWSA-N 0 3 289.354 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H]2OC)c1[O-] ZINC000761216466 626816421 /nfs/dbraw/zinc/81/64/21/626816421.db2.gz SWRWIQSGAIVMMD-GXFFZTMASA-N 0 3 299.798 2.959 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(CC2CC2)C1)c1ccccc1[O-] ZINC000761500616 626840851 /nfs/dbraw/zinc/84/08/51/626840851.db2.gz XPFLLMOPJGSIJY-ZBFHGGJFSA-N 0 3 274.408 2.917 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12 ZINC000762619914 626926451 /nfs/dbraw/zinc/92/64/51/626926451.db2.gz XVOMRGKHHNGNIC-BNOWGMLFSA-N 0 3 281.446 2.861 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12 ZINC000762619917 626927469 /nfs/dbraw/zinc/92/74/69/626927469.db2.gz XVOMRGKHHNGNIC-MRVWCRGKSA-N 0 3 281.446 2.861 20 10 CFCDHN Cc1nn(C)cc1[C@@H](C)NCc1ccc(N(C)C)cc1C ZINC000766030053 627172559 /nfs/dbraw/zinc/17/25/59/627172559.db2.gz UBDJJOMVXQVLKF-CYBMUJFWSA-N 0 3 286.423 2.954 20 10 CFCDHN CCOc1ccc(C[N@H+](C[C@@H]2CCOC2)C2CC2)c([O-])c1 ZINC000768258816 627329048 /nfs/dbraw/zinc/32/90/48/627329048.db2.gz XHWBMYPNOCWSBC-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c([O-])c1 ZINC000768258816 627329050 /nfs/dbraw/zinc/32/90/50/627329050.db2.gz XHWBMYPNOCWSBC-ZDUSSCGKSA-N 0 3 291.391 2.792 20 10 CFCDHN CC[N@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768437825 627343233 /nfs/dbraw/zinc/34/32/33/627343233.db2.gz JUARAJOCCMVORE-QGZVFWFLSA-N 0 3 299.370 2.840 20 10 CFCDHN CC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000768437825 627343234 /nfs/dbraw/zinc/34/32/34/627343234.db2.gz JUARAJOCCMVORE-QGZVFWFLSA-N 0 3 299.370 2.840 20 10 CFCDHN CCOc1ccc(C[N@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC000769035132 627397881 /nfs/dbraw/zinc/39/78/81/627397881.db2.gz VPFBQVMUXJXNBF-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)C[C@@H]2CCCCO2)c([O-])c1 ZINC000769035132 627397882 /nfs/dbraw/zinc/39/78/82/627397882.db2.gz VPFBQVMUXJXNBF-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H](COC)C2)c([O-])c1 ZINC000769402561 627434645 /nfs/dbraw/zinc/43/46/45/627434645.db2.gz KBUGJRREYHQLTC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H](COC)C2)c([O-])c1 ZINC000769402561 627434649 /nfs/dbraw/zinc/43/46/49/627434649.db2.gz KBUGJRREYHQLTC-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@H+](C)[C@@H](C)CCSC ZINC000769462239 627442562 /nfs/dbraw/zinc/44/25/62/627442562.db2.gz CKYUFZIJKILBDD-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+](C)[C@@H](C)CCSC ZINC000769462239 627442564 /nfs/dbraw/zinc/44/25/64/627442564.db2.gz CKYUFZIJKILBDD-NSHDSACASA-N 0 3 269.410 2.974 20 10 CFCDHN Cc1cccc(CN[C@@H](CO)c2ccsc2)c1O ZINC000770668157 627539723 /nfs/dbraw/zinc/53/97/23/627539723.db2.gz KKOUFDOJZZBIHE-ZDUSSCGKSA-N 0 3 263.362 2.585 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c([O-])c1 ZINC000771888401 627643426 /nfs/dbraw/zinc/64/34/26/627643426.db2.gz OTDLPCDHRFNKAQ-BBRMVZONSA-N 0 3 279.380 2.694 20 10 CFCDHN CCCCn1cc(C[NH2+]Cc2ccccc2[O-])c(C)n1 ZINC000773407692 627815394 /nfs/dbraw/zinc/81/53/94/627815394.db2.gz AJFIFVPWRPBZMP-UHFFFAOYSA-N 0 3 273.380 2.987 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](O)c1ccco1)c1ccccc1[O-] ZINC000775416272 628023266 /nfs/dbraw/zinc/02/32/66/628023266.db2.gz UEVKBIZNHUBOEC-JSGCOSHPSA-N 0 3 261.321 2.760 20 10 CFCDHN CC[C@@H]([NH2+]CCN1CCC(OC)CC1)c1ccccc1[O-] ZINC000775511254 628033296 /nfs/dbraw/zinc/03/32/96/628033296.db2.gz CVPQZFLDINHIKO-MRXNPFEDSA-N 0 3 292.423 2.544 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2O)c2c1c(F)ccc2[O-] ZINC000775587207 628043181 /nfs/dbraw/zinc/04/31/81/628043181.db2.gz VFLMTYAUSGJZHW-OJAKKHQRSA-N 0 3 279.355 2.973 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)CN2CCCCC2)c([O-])c1 ZINC000775974859 628089623 /nfs/dbraw/zinc/08/96/23/628089623.db2.gz YVLFEENHIWIAJR-AWEZNQCLSA-N 0 3 292.423 2.755 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000776008689 628093880 /nfs/dbraw/zinc/09/38/80/628093880.db2.gz NZOOTHOAFSWRGU-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000776008689 628093884 /nfs/dbraw/zinc/09/38/84/628093884.db2.gz NZOOTHOAFSWRGU-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC[C@@H](C)CO)c1[O-] ZINC000776253126 628122607 /nfs/dbraw/zinc/12/26/07/628122607.db2.gz IRILCWWHKMDVGN-SNVBAGLBSA-N 0 3 271.788 2.852 20 10 CFCDHN C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[O-] ZINC000778999362 628344167 /nfs/dbraw/zinc/34/41/67/628344167.db2.gz FANQCPAXAQAGHA-ZDUSSCGKSA-N 0 3 289.350 2.914 20 10 CFCDHN C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[O-] ZINC000778999362 628344169 /nfs/dbraw/zinc/34/41/69/628344169.db2.gz FANQCPAXAQAGHA-ZDUSSCGKSA-N 0 3 289.350 2.914 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000779028944 628347088 /nfs/dbraw/zinc/34/70/88/628347088.db2.gz LSEYMUZLHDBXQL-FZMZJTMJSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000779028944 628347089 /nfs/dbraw/zinc/34/70/89/628347089.db2.gz LSEYMUZLHDBXQL-FZMZJTMJSA-N 0 3 265.328 2.532 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@H]2C(C)(C)O)c([O-])c1 ZINC000779165186 628357679 /nfs/dbraw/zinc/35/76/79/628357679.db2.gz AZLZBMFGSSXORK-OAHLLOKOSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c([O-])c1 ZINC000779165186 628357683 /nfs/dbraw/zinc/35/76/83/628357683.db2.gz AZLZBMFGSSXORK-OAHLLOKOSA-N 0 3 279.380 2.526 20 10 CFCDHN CCOC[C@H](C)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000779199116 628359865 /nfs/dbraw/zinc/35/98/65/628359865.db2.gz UGTNAXQBOYMCEY-JTQLQIEISA-N 0 3 257.761 2.869 20 10 CFCDHN COCC1(C)CC[NH+](Cc2c([O-])cccc2OC)CC1 ZINC000779606172 628389856 /nfs/dbraw/zinc/38/98/56/628389856.db2.gz OHSZDUQORIIPMS-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CCC=CO2)c([O-])c1 ZINC000780565634 628477658 /nfs/dbraw/zinc/47/76/58/628477658.db2.gz DVKUCRLAEWMXLS-AWEZNQCLSA-N 0 3 263.337 2.573 20 10 CFCDHN COc1cccc(O)c1CN1CCC[C@H](OC(F)F)C1 ZINC000781531854 628557203 /nfs/dbraw/zinc/55/72/03/628557203.db2.gz KYFWVKKGFVZDBX-JTQLQIEISA-N 0 3 287.306 2.604 20 10 CFCDHN COc1cccc(CN[C@@H](C)c2cncc(F)c2)c1O ZINC000781638889 628568248 /nfs/dbraw/zinc/56/82/48/628568248.db2.gz LKRVVNGDFIIUHY-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN CC1(C)CCC[C@](O)(C[NH2+]Cc2ccccc2[O-])C1 ZINC000782534734 628644117 /nfs/dbraw/zinc/64/41/17/628644117.db2.gz GTVGSPHQUZONTF-MRXNPFEDSA-N 0 3 263.381 2.813 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000784036297 628767493 /nfs/dbraw/zinc/76/74/93/628767493.db2.gz SSVORPOUPAYVTB-DOMZBBRYSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@@H]3O)C1 ZINC000784036297 628767496 /nfs/dbraw/zinc/76/74/96/628767496.db2.gz SSVORPOUPAYVTB-DOMZBBRYSA-N 0 3 291.391 2.686 20 10 CFCDHN COCC[C@H](Cc1ccco1)[NH2+]Cc1ccccc1[O-] ZINC000784626304 628832097 /nfs/dbraw/zinc/83/20/97/628832097.db2.gz YTDIQMNIJITNOO-CQSZACIVSA-N 0 3 275.348 2.723 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CCO[C@@H](C)C1 ZINC000784645919 628833725 /nfs/dbraw/zinc/83/37/25/628833725.db2.gz CUEBZWCDPIVDND-STQMWFEESA-N 0 3 279.380 2.696 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000788604050 629085576 /nfs/dbraw/zinc/08/55/76/629085576.db2.gz TUBVDQZNQGNPHR-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN CCn1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])c1=O ZINC000788606264 629085983 /nfs/dbraw/zinc/08/59/83/629085983.db2.gz WZHVRBRKZJEVGT-ZDUSSCGKSA-N 0 3 286.375 2.733 20 10 CFCDHN CCN(C)C(=O)[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000788984785 629113921 /nfs/dbraw/zinc/11/39/21/629113921.db2.gz TWUMUSQUPWHFMY-JBLDHEPKSA-N 0 3 294.370 2.536 20 10 CFCDHN Cc1ccc2c(c1)CCN(Cc1cc3c(cc1O)OCO3)C2 ZINC000790453353 629240965 /nfs/dbraw/zinc/24/09/65/629240965.db2.gz VYWDMCDABRZSLR-UHFFFAOYSA-N 0 3 297.354 2.988 20 10 CFCDHN CCN(C)c1ccc(C[NH2+]Cc2ccccc2[O-])cn1 ZINC000790955216 629273495 /nfs/dbraw/zinc/27/34/95/629273495.db2.gz NHXPTDGJCCLJSH-UHFFFAOYSA-N 0 3 271.364 2.533 20 10 CFCDHN Cc1cc(CNCC=Cc2ccc(N(C)C)cc2)[nH]n1 ZINC000835040334 629335467 /nfs/dbraw/zinc/33/54/67/629335467.db2.gz PKXOYEHYVCALIO-SNAWJCMRSA-N 0 3 270.380 2.587 20 10 CFCDHN COC(=O)c1cccc2c1CCN(Cc1ccccc1O)C2 ZINC000835068072 629367822 /nfs/dbraw/zinc/36/78/22/629367822.db2.gz DCMMMMBSSQADAI-UHFFFAOYSA-N 0 3 297.354 2.737 20 10 CFCDHN Cc1ccncc1CNCc1ccc(N(C)C)c(F)c1 ZINC000792938824 629468433 /nfs/dbraw/zinc/46/84/33/629468433.db2.gz DQVNRYRORQBPBQ-UHFFFAOYSA-N 0 3 273.355 2.885 20 10 CFCDHN Cc1cc(O)c(CNCc2cccnc2F)cc1C ZINC000793284318 629520261 /nfs/dbraw/zinc/52/02/61/629520261.db2.gz GBTHVYIKEQFGDF-UHFFFAOYSA-N 0 3 260.312 2.833 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCC2(O)CCC2)c2c1c(F)ccc2[O-] ZINC000793567600 629572898 /nfs/dbraw/zinc/57/28/98/629572898.db2.gz ZMEYXQFUSPKYFT-JQWIXIFHSA-N 0 3 279.355 2.974 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609091 629577977 /nfs/dbraw/zinc/57/79/77/629577977.db2.gz NSDKEMCNBOKZMC-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@H]2CCO)c1[O-] ZINC000793609091 629577980 /nfs/dbraw/zinc/57/79/80/629577980.db2.gz NSDKEMCNBOKZMC-AWEZNQCLSA-N 0 3 279.380 2.528 20 10 CFCDHN CC[C@H]([NH2+]C[C@]1(OC)CCOC1)c1ccc(C)cc1[O-] ZINC000794813905 629689374 /nfs/dbraw/zinc/68/93/74/629689374.db2.gz KGIKGRSQTQPCJP-GOEBONIOSA-N 0 3 279.380 2.547 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCC[C@H]1C(=O)NC)c1ccc(C)cc1[O-] ZINC000794817844 629690110 /nfs/dbraw/zinc/69/01/10/629690110.db2.gz PKEBDQSMHUVLGT-ILXRZTDVSA-N 0 3 290.407 2.656 20 10 CFCDHN CC[C@@H]([NH2+]CC1(CO)CCC1)c1ccc(C)cc1[O-] ZINC000794819465 629690248 /nfs/dbraw/zinc/69/02/48/629690248.db2.gz WNRCDMBYRZYUEM-CQSZACIVSA-N 0 3 263.381 2.904 20 10 CFCDHN CC[C@@H]([NH2+]C1COC(C)(C)OC1)c1ccc(C)cc1[O-] ZINC000794819950 629691012 /nfs/dbraw/zinc/69/10/12/629691012.db2.gz ZNSFJKILSFUXJS-CQSZACIVSA-N 0 3 279.380 2.893 20 10 CFCDHN CCCN1CCC[C@H]1C[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000796519351 629929377 /nfs/dbraw/zinc/92/93/77/629929377.db2.gz ABQMTVTWMKGXGC-HNNXBMFYSA-N 0 3 292.423 2.755 20 10 CFCDHN C[C@H](NCCCSc1nccs1)c1ncc[nH]1 ZINC000796771358 629963424 /nfs/dbraw/zinc/96/34/24/629963424.db2.gz JAKBYYBCZGQLMI-VIFPVBQESA-N 0 3 268.411 2.699 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000798963935 630265853 /nfs/dbraw/zinc/26/58/53/630265853.db2.gz LENNUKJREQYPBR-ZDUSSCGKSA-N 0 3 284.359 2.785 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000798963935 630265855 /nfs/dbraw/zinc/26/58/55/630265855.db2.gz LENNUKJREQYPBR-ZDUSSCGKSA-N 0 3 284.359 2.785 20 10 CFCDHN CO[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000799739738 630342001 /nfs/dbraw/zinc/34/20/01/630342001.db2.gz CIBXJSXECDJELU-JSGCOSHPSA-N 0 3 253.317 2.579 20 10 CFCDHN CC[S@](=O)CC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808696181 630400379 /nfs/dbraw/zinc/40/03/79/630400379.db2.gz STZLPRAXTIYMSU-YPMLDQLKSA-N 0 3 289.828 2.773 20 10 CFCDHN CCCCN(CC(=O)N(CC)CC)Cc1ccccc1O ZINC000801594794 630461108 /nfs/dbraw/zinc/46/11/08/630461108.db2.gz OONOHXHPYFHNRX-UHFFFAOYSA-N 0 3 292.423 2.863 20 10 CFCDHN CCOc1ccc(CN2CC[C@H](OC(F)F)C2)c(O)c1 ZINC000802658437 630536453 /nfs/dbraw/zinc/53/64/53/630536453.db2.gz AOYYPJNYHZOHGT-LBPRGKRZSA-N 0 3 287.306 2.604 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC(F)F)C2)c([O-])c1 ZINC000802658437 630536456 /nfs/dbraw/zinc/53/64/56/630536456.db2.gz AOYYPJNYHZOHGT-LBPRGKRZSA-N 0 3 287.306 2.604 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC(F)F)C2)c([O-])c1 ZINC000802658437 630536459 /nfs/dbraw/zinc/53/64/59/630536459.db2.gz AOYYPJNYHZOHGT-LBPRGKRZSA-N 0 3 287.306 2.604 20 10 CFCDHN COC[C@@H]1CCN1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000840083102 630857933 /nfs/dbraw/zinc/85/79/33/630857933.db2.gz LUSFMXVQGVSISG-ZDUSSCGKSA-N 0 3 293.407 2.919 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CCNC(=O)C(C)C)c1[O-] ZINC000808672918 631026222 /nfs/dbraw/zinc/02/62/22/631026222.db2.gz UVXBPMXNWLCQAC-LLVKDONJSA-N 0 3 298.814 2.777 20 10 CFCDHN CCNC(=O)[C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808672695 631026707 /nfs/dbraw/zinc/02/67/07/631026707.db2.gz RJRPWTBUCFWICQ-UWVGGRQHSA-N 0 3 284.787 2.529 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@@H](C)O)c1[O-] ZINC000808694543 631029646 /nfs/dbraw/zinc/02/96/46/631029646.db2.gz AEVCIQLBJKRMJX-NXEZZACHSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H](C)O)c1[O-] ZINC000808694544 631029706 /nfs/dbraw/zinc/02/97/06/631029706.db2.gz AEVCIQLBJKRMJX-UWVGGRQHSA-N 0 3 257.761 2.776 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@@H](O)C(C)C ZINC000840882996 631249848 /nfs/dbraw/zinc/24/98/48/631249848.db2.gz RCCHNWYIVZUVHS-DGFSRKRXSA-N 0 3 269.360 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH+]1CCC(c2ccncn2)CC1 ZINC000840953216 631281378 /nfs/dbraw/zinc/28/13/78/631281378.db2.gz JOGWWRMAKCFYBK-UHFFFAOYSA-N 0 3 287.338 2.701 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000840956359 631282197 /nfs/dbraw/zinc/28/21/97/631282197.db2.gz REPXNQWORFFHHW-HZPDHXFCSA-N 0 3 269.344 2.700 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000840956359 631282204 /nfs/dbraw/zinc/28/22/04/631282204.db2.gz REPXNQWORFFHHW-HZPDHXFCSA-N 0 3 269.344 2.700 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1ccc(OCC)cc1[O-] ZINC000809757911 631282372 /nfs/dbraw/zinc/28/23/72/631282372.db2.gz ZVXQDHAXLUWJLJ-UHFFFAOYSA-N 0 3 294.439 2.955 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1ccc(OCC)cc1[O-] ZINC000809757911 631282374 /nfs/dbraw/zinc/28/23/74/631282374.db2.gz ZVXQDHAXLUWJLJ-UHFFFAOYSA-N 0 3 294.439 2.955 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2CS[C@H](C)C2)c([O-])c1 ZINC000840957472 631284475 /nfs/dbraw/zinc/28/44/75/631284475.db2.gz BURGQQBPKKSLOQ-ZYHUDNBSSA-N 0 3 267.394 2.775 20 10 CFCDHN CO[C@](C)([C@@H](C)[NH2+]Cc1cc(F)ccc1[O-])C1CC1 ZINC000840961206 631286044 /nfs/dbraw/zinc/28/60/44/631286044.db2.gz SGXXKLYYIOKGDY-MEBBXXQBSA-N 0 3 267.344 2.825 20 10 CFCDHN COC1([C@H](C)[NH2+]Cc2cc(F)ccc2[O-])CCC1 ZINC000840970707 631290353 /nfs/dbraw/zinc/29/03/53/631290353.db2.gz WGELJMJFYQZJLF-JTQLQIEISA-N 0 3 253.317 2.579 20 10 CFCDHN COc1cccc(O)c1CN1CCCc2occc2C1 ZINC000809792419 631292231 /nfs/dbraw/zinc/29/22/31/631292231.db2.gz VCEIMKXCMYONMJ-UHFFFAOYSA-N 0 3 273.332 2.942 20 10 CFCDHN CC(C)C[C@@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841039063 631316071 /nfs/dbraw/zinc/31/60/71/631316071.db2.gz YZMAYDPBFXLRJY-VIFPVBQESA-N 0 3 274.767 2.648 20 10 CFCDHN CC(C)C[C@@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841039063 631316073 /nfs/dbraw/zinc/31/60/73/631316073.db2.gz YZMAYDPBFXLRJY-VIFPVBQESA-N 0 3 274.767 2.648 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)[C@]2(O)CCOC2)c1 ZINC000842917817 631781535 /nfs/dbraw/zinc/78/15/35/631781535.db2.gz BKFBEZWVUNYIRS-GUYCJALGSA-N 0 3 293.407 2.529 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC(C)(C)[C@@]2(O)CCOC2)c([O-])c1 ZINC000842918778 631782072 /nfs/dbraw/zinc/78/20/72/631782072.db2.gz IYBAWJWWFWSANP-SUMWQHHRSA-N 0 3 293.407 2.529 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c([O-])ccc3F)CO1 ZINC000842927240 631783886 /nfs/dbraw/zinc/78/38/86/631783886.db2.gz DFLTYPPMEXGFRI-WYFGTUCQSA-N 0 3 265.328 2.847 20 10 CFCDHN CC[C@H]([NH2+]CCSCCCO)c1ccccc1[O-] ZINC000155713476 650029993 /nfs/dbraw/zinc/02/99/93/650029993.db2.gz JNWCGYLRXXTDCU-ZDUSSCGKSA-N 0 3 269.410 2.549 20 10 CFCDHN C[NH2+]C[C@@H]1CCCN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000843045280 631812055 /nfs/dbraw/zinc/81/20/55/631812055.db2.gz UECHKFNPFFUSIZ-LBPRGKRZSA-N 0 3 282.815 2.785 20 10 CFCDHN [NH3+]CC[C@H]1CCCCN1Cc1c([O-])ccc(Cl)c1F ZINC000843123130 631843882 /nfs/dbraw/zinc/84/38/82/631843882.db2.gz HAPQUTKCXJHBQK-SNVBAGLBSA-N 0 3 286.778 2.888 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[NH2+]CC[C@H]3C2)c(Cl)c1 ZINC000843128456 631847645 /nfs/dbraw/zinc/84/76/45/631847645.db2.gz XQURSJROGBYHAB-SMDDNHRTSA-N 0 3 280.799 2.538 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCOC2)c1[O-] ZINC000843417900 631948582 /nfs/dbraw/zinc/94/85/82/631948582.db2.gz WYLKTBNQDKZXFC-GJZGRUSLSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c1[O-] ZINC000843417900 631948585 /nfs/dbraw/zinc/94/85/85/631948585.db2.gz WYLKTBNQDKZXFC-GJZGRUSLSA-N 0 3 291.391 2.792 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843417181 631949004 /nfs/dbraw/zinc/94/90/04/631949004.db2.gz QOZWHUWHETYGKE-LSDHHAIUSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000843417181 631949006 /nfs/dbraw/zinc/94/90/06/631949006.db2.gz QOZWHUWHETYGKE-LSDHHAIUSA-N 0 3 261.365 2.783 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1[O-] ZINC000843417901 631949195 /nfs/dbraw/zinc/94/91/95/631949195.db2.gz WYLKTBNQDKZXFC-HUUCEWRRSA-N 0 3 291.391 2.792 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1[O-] ZINC000843417901 631949197 /nfs/dbraw/zinc/94/91/97/631949197.db2.gz WYLKTBNQDKZXFC-HUUCEWRRSA-N 0 3 291.391 2.792 20 10 CFCDHN CCC[N@H+](Cc1cccc(OCC)c1[O-])[C@@H]1CCN(C)C1 ZINC000843421393 631951421 /nfs/dbraw/zinc/95/14/21/631951421.db2.gz DANFKAZKHKISPV-OAHLLOKOSA-N 0 3 292.423 2.707 20 10 CFCDHN CCC[N@@H+](Cc1cccc(OCC)c1[O-])[C@@H]1CCN(C)C1 ZINC000843421393 631951423 /nfs/dbraw/zinc/95/14/23/631951423.db2.gz DANFKAZKHKISPV-OAHLLOKOSA-N 0 3 292.423 2.707 20 10 CFCDHN C[C@@H]1CC2(C[N@@H+]1Cc1cc(F)ccc1[O-])CCOCC2 ZINC000843431593 631957385 /nfs/dbraw/zinc/95/73/85/631957385.db2.gz IOZWLGXKTKKSTO-GFCCVEGCSA-N 0 3 279.355 2.922 20 10 CFCDHN C[C@@H]1CC2(C[N@H+]1Cc1cc(F)ccc1[O-])CCOCC2 ZINC000843431593 631957386 /nfs/dbraw/zinc/95/73/86/631957386.db2.gz IOZWLGXKTKKSTO-GFCCVEGCSA-N 0 3 279.355 2.922 20 10 CFCDHN CC[C@H](O)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000813884156 631972527 /nfs/dbraw/zinc/97/25/27/631972527.db2.gz JRYUDLKZZBFYDA-ONGXEEELSA-N 0 3 257.761 2.776 20 10 CFCDHN CC[C@H]([NH2+]CCc1cncc(C)n1)c1ccccc1[O-] ZINC000844312468 632165217 /nfs/dbraw/zinc/16/52/17/632165217.db2.gz LBXHROGEHAJFSW-HNNXBMFYSA-N 0 3 271.364 2.774 20 10 CFCDHN CCN(C)c1ccc(CN2CC[C@H](OC(F)F)C2)cc1 ZINC000815112028 632203757 /nfs/dbraw/zinc/20/37/57/632203757.db2.gz JPYHNYIOMLKNDY-AWEZNQCLSA-N 0 3 284.350 2.956 20 10 CFCDHN CCOCC(C)(C)[NH2+]Cc1ccc(OCC)cc1[O-] ZINC000815148454 632217675 /nfs/dbraw/zinc/21/76/75/632217675.db2.gz WIOFDTOECLQXSW-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN [O-]c1c(CN2C[C@@H]3CCC[NH2+][C@@H]3C2)ccc2ccccc21 ZINC000816513164 632475958 /nfs/dbraw/zinc/47/59/58/632475958.db2.gz IGEJNPHALQOAHB-WMLDXEAASA-N 0 3 282.387 2.729 20 10 CFCDHN COc1ccc(N(C)CCN(C)Cc2ccncc2C)cc1 ZINC000846052280 632624304 /nfs/dbraw/zinc/62/43/04/632624304.db2.gz OITZZUIMHICGNO-UHFFFAOYSA-N 0 3 299.418 2.967 20 10 CFCDHN CCC[C@H](C)[C@H](CO)[NH2+][C@H](C)c1ccccc1[O-] ZINC000846184062 632655369 /nfs/dbraw/zinc/65/53/69/632655369.db2.gz MHAJJEIWFQSOJD-SCRDCRAPSA-N 0 3 251.370 2.840 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000846184065 632655544 /nfs/dbraw/zinc/65/55/44/632655544.db2.gz MHAJJEIWFQSOJD-SGMGOOAPSA-N 0 3 251.370 2.840 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1cc(F)ccc1[O-] ZINC000846206430 632659588 /nfs/dbraw/zinc/65/95/88/632659588.db2.gz YRUDVNQITKORTE-WDEREUQCSA-N 0 3 267.344 2.997 20 10 CFCDHN CC[C@H]([NH2+]C[C@H]1CC(=O)N(CC)C1)c1ccc(C)cc1[O-] ZINC000846209706 632660770 /nfs/dbraw/zinc/66/07/70/632660770.db2.gz SLBXDASWNKGMDQ-HIFRSBDPSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@@H]([NH2+]CCC1(CO)CCC1)c1cc(F)ccc1[O-] ZINC000846210493 632661695 /nfs/dbraw/zinc/66/16/95/632661695.db2.gz NKIDUJIMUGQLIM-LLVKDONJSA-N 0 3 267.344 2.735 20 10 CFCDHN COC1([C@@H](C)[NH2+][C@H](C)c2ccccc2[O-])CCOCC1 ZINC000817588022 632672443 /nfs/dbraw/zinc/67/24/43/632672443.db2.gz LGRZJWLWESVVIH-CHWSQXEVSA-N 0 3 279.380 2.627 20 10 CFCDHN CC[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)CCO1 ZINC000817587484 632672525 /nfs/dbraw/zinc/67/25/25/632672525.db2.gz YGYIVXGSHYIAOW-MGPQQGTHSA-N 0 3 261.365 2.927 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCNC1)c1ccc2ccccc2c1[O-] ZINC000817940091 632743805 /nfs/dbraw/zinc/74/38/05/632743805.db2.gz DTCJIDQULKBUQH-JSGCOSHPSA-N 0 3 270.376 2.948 20 10 CFCDHN C[C@H](NC[C@@H]1CCC[NH2+]1)c1cc(Br)ccc1[O-] ZINC000817951149 632751560 /nfs/dbraw/zinc/75/15/60/632751560.db2.gz AGKMAWVVYBCUKC-ONGXEEELSA-N 0 3 299.212 2.557 20 10 CFCDHN CC(C)C[C@H](CN)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000817958081 632757189 /nfs/dbraw/zinc/75/71/89/632757189.db2.gz HGGVZODQCDTWKF-ZYHUDNBSSA-N 0 3 254.349 2.555 20 10 CFCDHN C[C@@H](NCC(F)(F)CN)c1cccc(C(F)(F)F)c1O ZINC000817967544 632766882 /nfs/dbraw/zinc/76/68/82/632766882.db2.gz KDJKIAUQRKQQGA-SSDOTTSWSA-N 0 3 298.255 2.656 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(F)cc1[O-] ZINC000817969296 632767096 /nfs/dbraw/zinc/76/70/96/632767096.db2.gz BBXHPOFAVPJRED-BPNCWPANSA-N 0 3 266.360 2.570 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)CN)c1ccc(C(F)(F)F)cc1[O-] ZINC000817970287 632768353 /nfs/dbraw/zinc/76/83/53/632768353.db2.gz QNRSHKKDCCOUPS-KWQFWETISA-N 0 3 276.302 2.799 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1ccc(F)cc1[O-] ZINC000817971689 632770750 /nfs/dbraw/zinc/77/07/50/632770750.db2.gz PATJQNBUIPAHGR-SUHUHFCYSA-N 0 3 266.360 2.713 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(F)cc1[O-] ZINC000817971688 632771114 /nfs/dbraw/zinc/77/11/14/632771114.db2.gz PATJQNBUIPAHGR-QKCSRTOESA-N 0 3 266.360 2.713 20 10 CFCDHN C[C@@H]([NH3+])CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000817972082 632772344 /nfs/dbraw/zinc/77/23/44/632772344.db2.gz JOIHRAJBKMLCIW-RNFRBKRXSA-N 0 3 263.168 2.697 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1NCCc2ccccc21)c1ccccc1[O-] ZINC000817973661 632773266 /nfs/dbraw/zinc/77/32/66/632773266.db2.gz GBEGMQMRTVAOAH-CXAGYDPISA-N 0 3 282.387 2.930 20 10 CFCDHN C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1[O-] ZINC000817977344 632775185 /nfs/dbraw/zinc/77/51/85/632775185.db2.gz HZYZETBETGBUEB-UTUOFQBUSA-N 0 3 258.365 2.932 20 10 CFCDHN C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000817978142 632776317 /nfs/dbraw/zinc/77/63/17/632776317.db2.gz XAYPNTYITAEWOH-HLTSFMKQSA-N 0 3 276.302 2.797 20 10 CFCDHN CCN(C)c1ccc([C@H](C)N[C@@H]2CNCCC2(F)F)cc1 ZINC000817981348 632777592 /nfs/dbraw/zinc/77/75/92/632777592.db2.gz RGAALVBJZGUMQV-SWLSCSKDSA-N 0 3 297.393 2.791 20 10 CFCDHN CC[C@@H]([NH2+][C@@H]1CCCCNC1)c1ccc(F)cc1[O-] ZINC000817983579 632779592 /nfs/dbraw/zinc/77/95/92/632779592.db2.gz GSOAWVIFIADIKX-TZMCWYRMSA-N 0 3 266.360 2.714 20 10 CFCDHN CN(Cc1ccccc1O)CC1(Br)CC1 ZINC000846825212 632812083 /nfs/dbraw/zinc/81/20/83/632812083.db2.gz SRAJCAFMAAOCQS-UHFFFAOYSA-N 0 3 270.170 2.752 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H](C1CC1)[C@H]1CCCCO1 ZINC000848559585 633289288 /nfs/dbraw/zinc/28/92/88/633289288.db2.gz GBCKGWXRDKWKPS-CVEARBPZSA-N 0 3 261.365 2.830 20 10 CFCDHN CCC(C)(C)N1CCN(C(=O)Nc2ccc(N)cc2)CC1 ZINC000848594485 633297223 /nfs/dbraw/zinc/29/72/23/633297223.db2.gz LSZMNVAZFVUKCP-UHFFFAOYSA-N 0 3 290.411 2.607 20 10 CFCDHN CCc1cccc(CN[C@H]2CCCc3c[nH]nc32)c1O ZINC000848899229 633388024 /nfs/dbraw/zinc/38/80/24/633388024.db2.gz LKVJDPLVXUJSQO-AWEZNQCLSA-N 0 3 271.364 2.845 20 10 CFCDHN CCc1cccc(CNCc2cccnc2F)c1O ZINC000848908519 633393556 /nfs/dbraw/zinc/39/35/56/633393556.db2.gz WPBVMEJDJPHJOP-UHFFFAOYSA-N 0 3 260.312 2.779 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CCCN2CCCC[C@@H]12 ZINC000848928138 633410796 /nfs/dbraw/zinc/41/07/96/633410796.db2.gz WPZSLTVKYAOGCA-GJZGRUSLSA-N 0 3 278.371 2.638 20 10 CFCDHN Cc1c[nH]c(CN[C@@H](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000850328552 633943090 /nfs/dbraw/zinc/94/30/90/633943090.db2.gz VANSSNUPKQXFKG-ZDUSSCGKSA-N 0 3 286.423 2.813 20 10 CFCDHN Cn1cc(C[C@@H]2CCC[C@H]2[NH2+]Cc2ccccc2[O-])cn1 ZINC000850383976 633970236 /nfs/dbraw/zinc/97/02/36/633970236.db2.gz GLEGMIYMSMQHFW-GOEBONIOSA-N 0 3 285.391 2.627 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCCc1ccco1 ZINC000850408028 633980648 /nfs/dbraw/zinc/98/06/48/633980648.db2.gz VQSFEUAORRVESP-UHFFFAOYSA-N 0 3 261.321 2.716 20 10 CFCDHN C[C@H](COCC1CC1)NCc1cc(F)c(N(C)C)cc1F ZINC000858183984 636149427 /nfs/dbraw/zinc/14/94/27/636149427.db2.gz LLOYNHLVOGPHTK-LLVKDONJSA-N 0 3 298.377 2.936 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](OC)[C@@H]1CCOC1)c1ccc(C)cc1[O-] ZINC000850484943 634013195 /nfs/dbraw/zinc/01/31/95/634013195.db2.gz VFPGQJDPDJCJAY-KMFMINBZSA-N 0 3 293.407 2.793 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@@H]([S@@](C)=O)C1)c1ccccc1[O-] ZINC000850500665 634019498 /nfs/dbraw/zinc/01/94/98/634019498.db2.gz GECGYAJJUPIXCM-ZOQLZFICSA-N 0 3 281.421 2.733 20 10 CFCDHN CO[C@@H]1CCC[C@H]([C@H](CO)[NH2+][C@H](C)c2ccccc2[O-])C1 ZINC000850503826 634020974 /nfs/dbraw/zinc/02/09/74/634020974.db2.gz ZHJZNHSXCKTTEV-CTASWTNQSA-N 0 3 293.407 2.609 20 10 CFCDHN C[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000850502465 634020996 /nfs/dbraw/zinc/02/09/96/634020996.db2.gz PXVIMFCHEYTSRY-VGWCWKRBSA-N 0 3 293.432 2.659 20 10 CFCDHN CO[C@@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000850520821 634029210 /nfs/dbraw/zinc/02/92/10/634029210.db2.gz GSCGOLGKEAYBQM-YWVKMMECSA-N 0 3 253.317 2.704 20 10 CFCDHN CC[C@@H](O)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000850528674 634035899 /nfs/dbraw/zinc/03/58/99/634035899.db2.gz JRYUDLKZZBFYDA-GXSJLCMTSA-N 0 3 257.761 2.776 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](O)C23CCC3)c([O-])c1 ZINC000850548254 634048623 /nfs/dbraw/zinc/04/86/23/634048623.db2.gz ZTNDTSFGNGWDDL-CQDKDKBSSA-N 0 3 261.365 2.655 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1[O-] ZINC000850555936 634052485 /nfs/dbraw/zinc/05/24/85/634052485.db2.gz KCNKYQZTOAFFEX-QWHCGFSZSA-N 0 3 290.407 2.690 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@H](O)C2)c1[O-] ZINC000850577896 634058454 /nfs/dbraw/zinc/05/84/54/634058454.db2.gz FBUCWTNCUOHEHH-LSJOCFKGSA-N 0 3 255.745 2.528 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCOCCF)c2c1c(F)ccc2[O-] ZINC000853238402 634948770 /nfs/dbraw/zinc/94/87/70/634948770.db2.gz ICJCZAWDKFUBIP-GXSJLCMTSA-N 0 3 271.307 2.655 20 10 CFCDHN C[C@@H]1CC[C@@H](CNCc2cc(F)c(N(C)C)cc2F)O1 ZINC000858174311 636147024 /nfs/dbraw/zinc/14/70/24/636147024.db2.gz BVSIEEIQVYBNOT-PWSUYJOCSA-N 0 3 284.350 2.688 20 10 CFCDHN CN(C)c1cc(F)c(CN[C@H]2COCC2(C)C)cc1F ZINC000858174621 636147055 /nfs/dbraw/zinc/14/70/55/636147055.db2.gz TWORZOHZDDRVFO-AWEZNQCLSA-N 0 3 284.350 2.545 20 10 CFCDHN CC(C)N1CC[C@H](C[NH2+]Cc2cccc(Cl)c2[O-])C1 ZINC000158731853 650235004 /nfs/dbraw/zinc/23/50/04/650235004.db2.gz URYHJKPYFBVLHU-GFCCVEGCSA-N 0 3 282.815 2.866 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1COc2cccc(C)c2C1 ZINC000858215452 636157420 /nfs/dbraw/zinc/15/74/20/636157420.db2.gz FMHJQOLHOWELQV-CYBMUJFWSA-N 0 3 299.370 2.803 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnc(C3CC3)nc2)c1 ZINC000858238878 636160912 /nfs/dbraw/zinc/16/09/12/636160912.db2.gz DXAOPKMHODADAW-UHFFFAOYSA-N 0 3 269.348 2.658 20 10 CFCDHN CCN(CC)c1ccc(CNCc2ccc[nH]c2=O)cc1 ZINC000858304882 636182999 /nfs/dbraw/zinc/18/29/99/636182999.db2.gz YNSFBRDSIRFWQG-UHFFFAOYSA-N 0 3 285.391 2.923 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000858506594 636276315 /nfs/dbraw/zinc/27/63/15/636276315.db2.gz VCADZDZMBHXJSO-ZWNOBZJWSA-N 0 3 293.338 2.834 20 10 CFCDHN CCOC(=O)C1=CC[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000858508384 636277697 /nfs/dbraw/zinc/27/76/97/636277697.db2.gz NIQSKSYJVWQNOK-ZIAGYGMSSA-N 0 3 287.359 2.621 20 10 CFCDHN CN(C)c1cc(F)c(CN(C)C[C@@H]2CCCOC2)cc1F ZINC000862239646 637296233 /nfs/dbraw/zinc/29/62/33/637296233.db2.gz BNARAVOVCOMOKJ-LBPRGKRZSA-N 0 3 298.377 2.889 20 10 CFCDHN COC(=O)C1=CC[C@H]([NH2+]Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000862467209 637393088 /nfs/dbraw/zinc/39/30/88/637393088.db2.gz UBEGBJCAWVXSRB-ZDUSSCGKSA-N 0 3 295.766 2.705 20 10 CFCDHN C[C@@H](N[C@@H]1CC[NH2+][C@H]1C)c1cc(Br)ccc1[O-] ZINC000863547279 637692932 /nfs/dbraw/zinc/69/29/32/637692932.db2.gz RITPRVSOHTXKQL-VDDIYKPWSA-N 0 3 299.212 2.556 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)c(Cl)c1 ZINC000863649637 637724983 /nfs/dbraw/zinc/72/49/83/637724983.db2.gz BXBWWZTVNGWXIN-IYBDPMFKSA-N 0 3 294.826 2.785 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000865752797 638552153 /nfs/dbraw/zinc/55/21/53/638552153.db2.gz DDTIZRDNCZDKQC-VXGBXAGGSA-N 0 3 258.287 2.793 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000865784829 638572169 /nfs/dbraw/zinc/57/21/69/638572169.db2.gz KKYZZPIFVOQMLV-GJZGRUSLSA-N 0 3 261.365 2.545 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](O)C(F)F)c1ccc(C)cc1[O-] ZINC000866442390 638821935 /nfs/dbraw/zinc/82/19/35/638821935.db2.gz KTXYURJBGCQGOA-NWDGAFQWSA-N 0 3 273.323 2.757 20 10 CFCDHN CC1(C)[C@H](N)c2ccccc2N1C(=O)Cc1ccc(N)cc1 ZINC000867988535 638911756 /nfs/dbraw/zinc/91/17/56/638911756.db2.gz NTSQOZVPXTXNHF-QGZVFWFLSA-N 0 3 295.386 2.637 20 10 CFCDHN Cc1ccc(C[C@H](CO)[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000191680476 650516483 /nfs/dbraw/zinc/51/64/83/650516483.db2.gz RSLSXXYMYUMXGM-MRXNPFEDSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H](NC(=O)[C@@H](N)CC1CCCCC1)c1ccccc1O ZINC000870988613 641139429 /nfs/dbraw/zinc/13/94/29/641139429.db2.gz UZBKUGNRACGAAR-WFASDCNBSA-N 0 3 290.407 2.867 20 10 CFCDHN CC(C)[C@H]1C[N@H+](Cc2c([O-])ccc3ccncc32)CCN1C ZINC000872736165 641917504 /nfs/dbraw/zinc/91/75/04/641917504.db2.gz LZPZVNAYDSJRSK-QGZVFWFLSA-N 0 3 299.418 2.712 20 10 CFCDHN CC(C)[C@H]1C[N@@H+](Cc2c([O-])ccc3ccncc32)CCN1C ZINC000872736165 641917508 /nfs/dbraw/zinc/91/75/08/641917508.db2.gz LZPZVNAYDSJRSK-QGZVFWFLSA-N 0 3 299.418 2.712 20 10 CFCDHN COCC(C)(C)CC[NH2+]Cc1c([O-])cccc1OC ZINC000873153486 642034574 /nfs/dbraw/zinc/03/45/74/642034574.db2.gz VBLBSBPNZZSGCT-UHFFFAOYSA-N 0 3 267.369 2.553 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1COc2ccccc2O1)c1ccccc1[O-] ZINC000020137836 642305877 /nfs/dbraw/zinc/30/58/77/642305877.db2.gz SDGZRMCCNWAJHV-QWHCGFSZSA-N 0 3 285.343 2.883 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1c(C)cccc1[O-] ZINC000876564273 642924959 /nfs/dbraw/zinc/92/49/59/642924959.db2.gz INLSYIRNDPETOU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1c(C)cccc1[O-] ZINC000876564273 642924961 /nfs/dbraw/zinc/92/49/61/642924961.db2.gz INLSYIRNDPETOU-UHFFFAOYSA-N 0 3 251.370 2.685 20 10 CFCDHN C[C@H]([NH2+]CC1(O)CCC(C)CC1)c1ccccc1[O-] ZINC000087043954 650799295 /nfs/dbraw/zinc/79/92/95/650799295.db2.gz SEXRWQYCTSDZOB-UYJPIKCFSA-N 0 3 263.381 2.984 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])CC1CCSCC1 ZINC000876616572 642946819 /nfs/dbraw/zinc/94/68/19/642946819.db2.gz ZWZDUMMMTBTHOZ-UHFFFAOYSA-N 0 3 251.395 2.967 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])CC1CCSCC1 ZINC000876616572 642946825 /nfs/dbraw/zinc/94/68/25/642946825.db2.gz ZWZDUMMMTBTHOZ-UHFFFAOYSA-N 0 3 251.395 2.967 20 10 CFCDHN Cc1ccc(C[N@H+](CCO)CCc2ccccc2)c([O-])c1 ZINC000876737399 642988315 /nfs/dbraw/zinc/98/83/15/642988315.db2.gz SSTOSQQAFHPFOE-UHFFFAOYSA-N 0 3 285.387 2.738 20 10 CFCDHN Cc1ccc(C[N@@H+](CCO)CCc2ccccc2)c([O-])c1 ZINC000876737399 642988318 /nfs/dbraw/zinc/98/83/18/642988318.db2.gz SSTOSQQAFHPFOE-UHFFFAOYSA-N 0 3 285.387 2.738 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000876804904 643016362 /nfs/dbraw/zinc/01/63/62/643016362.db2.gz VURINJSVIFUBAM-UKRRQHHQSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000876804904 643016368 /nfs/dbraw/zinc/01/63/68/643016368.db2.gz VURINJSVIFUBAM-UKRRQHHQSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000876807449 643017499 /nfs/dbraw/zinc/01/74/99/643017499.db2.gz DRPZKIANAKJMKJ-ZBFHGGJFSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000876807449 643017504 /nfs/dbraw/zinc/01/75/04/643017504.db2.gz DRPZKIANAKJMKJ-ZBFHGGJFSA-N 0 3 285.391 2.980 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc3c(c2)OCCO3)c([O-])c1 ZINC000876891539 643054393 /nfs/dbraw/zinc/05/43/93/643054393.db2.gz AOKNYPDHXKNXPL-UHFFFAOYSA-N 0 3 299.370 2.804 20 10 CFCDHN Cc1ccc([C@@H](O)C[NH2+]Cc2c(C)cccc2[O-])cc1 ZINC000876959090 643080922 /nfs/dbraw/zinc/08/09/22/643080922.db2.gz GIBGYSQAFXQVLL-KRWDZBQOSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](CO)Cc1ccccc1 ZINC000876965720 643086358 /nfs/dbraw/zinc/08/63/58/643086358.db2.gz IUQJQFXCMDAKLG-INIZCTEOSA-N 0 3 285.387 2.641 20 10 CFCDHN Cc1noc(C)c1CC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877012511 643104198 /nfs/dbraw/zinc/10/41/98/643104198.db2.gz VSWNOMLJUXOTCJ-UHFFFAOYSA-N 0 3 260.337 2.638 20 10 CFCDHN CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877029534 643109994 /nfs/dbraw/zinc/10/99/94/643109994.db2.gz GLDXDKNAVNWALL-IUODEOHRSA-N 0 3 251.370 2.587 20 10 CFCDHN CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877029536 643110442 /nfs/dbraw/zinc/11/04/42/643110442.db2.gz GLDXDKNAVNWALL-WFASDCNBSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@](C)(O)c2ccsc2)c([O-])c1 ZINC000877052666 643122181 /nfs/dbraw/zinc/12/21/81/643122181.db2.gz ZXOKGHKCXJSEPG-HNNXBMFYSA-N 0 3 277.389 2.759 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(C)CCCC[C@H]2O)c([O-])c1 ZINC000877080665 643140908 /nfs/dbraw/zinc/14/09/08/643140908.db2.gz GJGDURHHSPHXBP-CVEARBPZSA-N 0 3 263.381 2.731 20 10 CFCDHN CCOCCC1(C[NH2+]Cc2ccc(C)cc2[O-])CC1 ZINC000877114699 643157454 /nfs/dbraw/zinc/15/74/54/643157454.db2.gz YEKQHSHCSUSTDM-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)CC(C)(C)C)c([O-])c1 ZINC000877117206 643159780 /nfs/dbraw/zinc/15/97/80/643159780.db2.gz OEZYEXVUPHEBFH-CYBMUJFWSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC(C)(C)[C@H](O)C(C)C ZINC000877123676 643162488 /nfs/dbraw/zinc/16/24/88/643162488.db2.gz NXQBUINQKIAFTP-OAHLLOKOSA-N 0 3 265.397 2.833 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c([O-])c1 ZINC000877126509 643165175 /nfs/dbraw/zinc/16/51/75/643165175.db2.gz MITNBDDSFXTIQO-NUEKZKHPSA-N 0 3 273.376 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@@H](C(C)C)C1 ZINC000877136050 643170809 /nfs/dbraw/zinc/17/08/09/643170809.db2.gz WRURPAYRDLDZII-CZUORRHYSA-N 0 3 263.381 2.994 20 10 CFCDHN Cc1ccc(C[NH2+][C@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000877316702 643234106 /nfs/dbraw/zinc/23/41/06/643234106.db2.gz LFHPFWIJSMPMQJ-JKSUJKDBSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc(C[NH2+][C@@]2(C)CCO[C@H]2C2CC2)c([O-])c1 ZINC000877316700 643234594 /nfs/dbraw/zinc/23/45/94/643234594.db2.gz LFHPFWIJSMPMQJ-HOTGVXAUSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]1CCO[C@H](C2CC2)C1 ZINC000877375127 643250040 /nfs/dbraw/zinc/25/00/40/643250040.db2.gz OPGNTNPSLRNDHC-CJNGLKHVSA-N 0 3 261.365 2.748 20 10 CFCDHN COc1ccc(C[NH2+]C[C@]2(C)CCCS2)c([O-])c1 ZINC000126496045 643254373 /nfs/dbraw/zinc/25/43/73/643254373.db2.gz CKXNUOJRYDSPSN-AWEZNQCLSA-N 0 3 267.394 2.776 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+]Cc2c(C)cccc2[O-])c1 ZINC000877463628 643284363 /nfs/dbraw/zinc/28/43/63/643284363.db2.gz CSZSSOVIBJQFKS-INIZCTEOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1ccc(C[NH2+][C@H](CO)Cc2ccccc2C)c([O-])c1 ZINC000877463836 643284627 /nfs/dbraw/zinc/28/46/27/643284627.db2.gz DOMHXZOCTFVSDO-KRWDZBQOSA-N 0 3 285.387 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](c1ccnn1C)C(C)C ZINC000877467613 643287558 /nfs/dbraw/zinc/28/75/58/643287558.db2.gz KWJNCJCNOXTNAU-CQSZACIVSA-N 0 3 287.407 2.964 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H](CO)Cc1ccc(F)cc1 ZINC000877474107 643291922 /nfs/dbraw/zinc/29/19/22/643291922.db2.gz QLJKGBPKKWPTNP-HNNXBMFYSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](CO)Cc1ccc(F)cc1 ZINC000877474108 643292156 /nfs/dbraw/zinc/29/21/56/643292156.db2.gz QLJKGBPKKWPTNP-OAHLLOKOSA-N 0 3 289.350 2.533 20 10 CFCDHN Cc1ccc(C[N@H+]2CCSC[C@@H](C)C2)c([O-])c1 ZINC000877474863 643293447 /nfs/dbraw/zinc/29/34/47/643293447.db2.gz HZAYVUAYRMOYQH-LBPRGKRZSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCSC[C@@H](C)C2)c([O-])c1 ZINC000877474863 643293450 /nfs/dbraw/zinc/29/34/50/643293450.db2.gz HZAYVUAYRMOYQH-LBPRGKRZSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCSC[C@H](C)C1 ZINC000877474960 643293542 /nfs/dbraw/zinc/29/35/42/643293542.db2.gz KJOSYZDYCOLJTA-LLVKDONJSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCSC[C@H](C)C1 ZINC000877474960 643293545 /nfs/dbraw/zinc/29/35/45/643293545.db2.gz KJOSYZDYCOLJTA-LLVKDONJSA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@H](c3nccn3C)C2)c([O-])c1 ZINC000877481180 643298314 /nfs/dbraw/zinc/29/83/14/643298314.db2.gz XIJRLKKQXCTHIP-HNNXBMFYSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@H](c3nccn3C)C2)c([O-])c1 ZINC000877481180 643298321 /nfs/dbraw/zinc/29/83/21/643298321.db2.gz XIJRLKKQXCTHIP-HNNXBMFYSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000877507531 643316575 /nfs/dbraw/zinc/31/65/75/643316575.db2.gz HGRIWFNXCNLZNY-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000877507531 643316579 /nfs/dbraw/zinc/31/65/79/643316579.db2.gz HGRIWFNXCNLZNY-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000877507530 643317265 /nfs/dbraw/zinc/31/72/65/643317265.db2.gz HGRIWFNXCNLZNY-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000877507530 643317271 /nfs/dbraw/zinc/31/72/71/643317271.db2.gz HGRIWFNXCNLZNY-INIZCTEOSA-N 0 3 261.365 2.703 20 10 CFCDHN CCC[C@@]1(CO)CC[N@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877536741 643339864 /nfs/dbraw/zinc/33/98/64/643339864.db2.gz BJKZDBLLVONAQY-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(C)cc2[O-])C1 ZINC000877536741 643339870 /nfs/dbraw/zinc/33/98/70/643339870.db2.gz BJKZDBLLVONAQY-MRXNPFEDSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000877544260 643346560 /nfs/dbraw/zinc/34/65/60/643346560.db2.gz NITYZEKSBMWBIV-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000877544260 643346567 /nfs/dbraw/zinc/34/65/67/643346567.db2.gz NITYZEKSBMWBIV-LJQANCHMSA-N 0 3 297.398 2.837 20 10 CFCDHN Cc1cccc(O)c1CN1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000877555173 643356192 /nfs/dbraw/zinc/35/61/92/643356192.db2.gz RTVBHSFEPLWVHG-IRXDYDNUSA-N 0 3 273.376 2.844 20 10 CFCDHN CO[C@@H]1CC[N@H+](Cc2ccc(C)cc2[O-])CC1(C)C ZINC000877565113 643365207 /nfs/dbraw/zinc/36/52/07/643365207.db2.gz CCFZTWIMICXEOA-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN CO[C@@H]1CC[N@@H+](Cc2ccc(C)cc2[O-])CC1(C)C ZINC000877565113 643365213 /nfs/dbraw/zinc/36/52/13/643365213.db2.gz CCFZTWIMICXEOA-OAHLLOKOSA-N 0 3 263.381 2.948 20 10 CFCDHN CCC(C)(C)OCC[NH2+]Cc1ccc(C)cc1[O-] ZINC000877578559 643375489 /nfs/dbraw/zinc/37/54/89/643375489.db2.gz IBLSWUGDSRAXAZ-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN CO[C@@H]1C[C@H]([NH2+]Cc2ccc(C)cc2[O-])C12CCC2 ZINC000877583734 643378828 /nfs/dbraw/zinc/37/88/28/643378828.db2.gz AIXILXFJKDEEOT-LSDHHAIUSA-N 0 3 261.365 2.748 20 10 CFCDHN CO[C@@](C)([C@H](C)[NH2+]Cc1ccc(C)cc1[O-])C1CC1 ZINC000877587939 643382842 /nfs/dbraw/zinc/38/28/42/643382842.db2.gz JWKOGZBTVXMSTH-LRDDRELGSA-N 0 3 263.381 2.994 20 10 CFCDHN CC[C@H]([NH2+]Cc1ccc(C)cc1[O-])[C@@H](O)C(C)C ZINC000877591632 643384939 /nfs/dbraw/zinc/38/49/39/643384939.db2.gz WJBSNXORGFPEQN-ZFWWWQNUSA-N 0 3 251.370 2.586 20 10 CFCDHN Cc1ccc(CN2CCOC[C@@H]2C2CCC2)c(O)c1 ZINC000877606410 643393989 /nfs/dbraw/zinc/39/39/89/643393989.db2.gz AMECVCPRWBPAHI-OAHLLOKOSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c([O-])c1 ZINC000877616053 643402593 /nfs/dbraw/zinc/40/25/93/643402593.db2.gz BUHZVOOULUVIPM-CYBMUJFWSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c([O-])c1 ZINC000877616053 643402595 /nfs/dbraw/zinc/40/25/95/643402595.db2.gz BUHZVOOULUVIPM-CYBMUJFWSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H](C)Cc1ccccn1 ZINC000877617960 643403664 /nfs/dbraw/zinc/40/36/64/643403664.db2.gz AVEDKUQXBDRRII-ZDUSSCGKSA-N 0 3 256.349 2.816 20 10 CFCDHN Cc1ccc(CNCc2cccnc2N2CCCC2)c(O)c1 ZINC000877623260 643409341 /nfs/dbraw/zinc/40/93/41/643409341.db2.gz JYBVSDMZWGCFOV-UHFFFAOYSA-N 0 3 297.402 2.986 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@H]1[NH2+]Cc1ccc(C)cc1[O-] ZINC000877639406 643424550 /nfs/dbraw/zinc/42/45/50/643424550.db2.gz IVPFHEGEJOJEBD-NVXWUHKLSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc(CN2CCc3c(O)cccc3C2)c(O)c1 ZINC000877658601 643437673 /nfs/dbraw/zinc/43/76/73/643437673.db2.gz UUTKMAYQZIZYGD-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Oc1cc2c(cc1CN1CC(c3ccccc3)C1)OCO2 ZINC000877665743 643441915 /nfs/dbraw/zinc/44/19/15/643441915.db2.gz HOGNBLHRGZHZBT-UHFFFAOYSA-N 0 3 283.327 2.720 20 10 CFCDHN CC1([NH+]2CCCC2)CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000877675458 643447299 /nfs/dbraw/zinc/44/72/99/643447299.db2.gz ZZLKAUKASOUMBG-UHFFFAOYSA-N 0 3 292.398 2.982 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877736851 643497155 /nfs/dbraw/zinc/49/71/55/643497155.db2.gz DNNUHKNCTLADAH-PWSUYJOCSA-N 0 3 267.369 2.716 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000877736851 643497162 /nfs/dbraw/zinc/49/71/62/643497162.db2.gz DNNUHKNCTLADAH-PWSUYJOCSA-N 0 3 267.369 2.716 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877741714 643513009 /nfs/dbraw/zinc/51/30/09/643513009.db2.gz ZFFXHABTLCDXDZ-CHWSQXEVSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000877741714 643513015 /nfs/dbraw/zinc/51/30/15/643513015.db2.gz ZFFXHABTLCDXDZ-CHWSQXEVSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c(Cl)c1 ZINC000877742993 643515306 /nfs/dbraw/zinc/51/53/06/643515306.db2.gz SPTGFQOOPSKNQW-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c(Cl)c1 ZINC000877742993 643515307 /nfs/dbraw/zinc/51/53/07/643515307.db2.gz SPTGFQOOPSKNQW-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c(Cl)c1 ZINC000877742995 643516682 /nfs/dbraw/zinc/51/66/82/643516682.db2.gz SPTGFQOOPSKNQW-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c(Cl)c1 ZINC000877742995 643516690 /nfs/dbraw/zinc/51/66/90/643516690.db2.gz SPTGFQOOPSKNQW-WFASDCNBSA-N 0 3 294.826 2.880 20 10 CFCDHN COc1cc(Cl)cc(CN2C[C@H](O)CC(C)(C)C2)c1O ZINC000877751628 643528077 /nfs/dbraw/zinc/52/80/77/643528077.db2.gz IFXWCWXLMVGKIM-GFCCVEGCSA-N 0 3 299.798 2.647 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2[O-])[C@H]1SC ZINC000877756009 643535388 /nfs/dbraw/zinc/53/53/88/643535388.db2.gz YHMIDDJEMIHARF-DZGBDDFRSA-N 0 3 281.421 2.952 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1C(=O)N(C)C)c1ccccc1[O-] ZINC000877755635 643535798 /nfs/dbraw/zinc/53/57/98/643535798.db2.gz IVLDNZFSKXIRKE-CYBMUJFWSA-N 0 3 298.386 2.945 20 10 CFCDHN Cc1cc(C)n2c(C[NH2+][C@H](C)c3ccccc3[O-])cnc2n1 ZINC000877756310 643536491 /nfs/dbraw/zinc/53/64/91/643536491.db2.gz GFURZLPNAJOUSJ-CYBMUJFWSA-N 0 3 296.374 2.903 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)c2ccccc2[O-])c1O ZINC000877756243 643537538 /nfs/dbraw/zinc/53/75/38/643537538.db2.gz ALGMSWCGNVSQIT-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN COc1ncc(CN[C@@H](C)c2ccccc2O)s1 ZINC000877758013 643538267 /nfs/dbraw/zinc/53/82/67/643538267.db2.gz CYVQUOFFRZRTFN-VIFPVBQESA-N 0 3 264.350 2.708 20 10 CFCDHN C[C@@H]1CN(Cc2ccccc2O)CC[C@H](C(F)(F)F)O1 ZINC000877822195 643589396 /nfs/dbraw/zinc/58/93/96/643589396.db2.gz FGWSTVRGYNMBMT-ZWNOBZJWSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]1C[N@H+](Cc2ccccc2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877822195 643589402 /nfs/dbraw/zinc/58/94/02/643589402.db2.gz FGWSTVRGYNMBMT-ZWNOBZJWSA-N 0 3 289.297 2.934 20 10 CFCDHN C[C@@H]1C[N@@H+](Cc2ccccc2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877822195 643589410 /nfs/dbraw/zinc/58/94/10/643589410.db2.gz FGWSTVRGYNMBMT-ZWNOBZJWSA-N 0 3 289.297 2.934 20 10 CFCDHN CCOC(=O)[C@@H](C)C1CN(Cc2cccc(CC)c2O)C1 ZINC000877830585 643595947 /nfs/dbraw/zinc/59/59/47/643595947.db2.gz OAPDBOQNHNIHHH-LBPRGKRZSA-N 0 3 291.391 2.586 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CC(C)(C)O ZINC000878566007 643943584 /nfs/dbraw/zinc/94/35/84/643943584.db2.gz YGSSFRJSLRYXSZ-HNNXBMFYSA-N 0 3 295.423 2.516 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CC(C)(C)O ZINC000878566007 643943587 /nfs/dbraw/zinc/94/35/87/643943587.db2.gz YGSSFRJSLRYXSZ-HNNXBMFYSA-N 0 3 295.423 2.516 20 10 CFCDHN CC[C@H]1CCCCN1C(=O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000879647805 644361445 /nfs/dbraw/zinc/36/14/45/644361445.db2.gz MAQOHTCDBJMWCQ-KGLIPLIRSA-N 0 3 290.407 2.834 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1[C@@H](C)CCC[C@@H]1C)c1ccccc1[O-] ZINC000879647356 644361485 /nfs/dbraw/zinc/36/14/85/644361485.db2.gz BIHOXIXJKFIEED-MELADBBJSA-N 0 3 290.407 2.832 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)NCCC(C)(C)C)c1ccccc1[O-] ZINC000879648681 644362375 /nfs/dbraw/zinc/36/23/75/644362375.db2.gz ZCPQMFNKOKUNQU-GFCCVEGCSA-N 0 3 278.396 2.595 20 10 CFCDHN CCC[C@@H](C)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649041 644362794 /nfs/dbraw/zinc/36/27/94/644362794.db2.gz JZDBDEVEEJZEAP-UPJWGTAASA-N 0 3 278.396 2.736 20 10 CFCDHN Cc1cnc([C@H](C)N[C@H](C)c2ccccc2O)cn1 ZINC000879648839 644363578 /nfs/dbraw/zinc/36/35/78/644363578.db2.gz BSKGSTVMTPPQLR-NEPJUHHUSA-N 0 3 257.337 2.902 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)Nc1nccs1 ZINC000879651125 644364081 /nfs/dbraw/zinc/36/40/81/644364081.db2.gz JHPSZRZQQMARBA-UWVGGRQHSA-N 0 3 291.376 2.527 20 10 CFCDHN CCS(=O)(=O)CCCCC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879650822 644364641 /nfs/dbraw/zinc/36/46/41/644364641.db2.gz RENDEIXWEBTXJH-ZDUSSCGKSA-N 0 3 299.436 2.648 20 10 CFCDHN CCN(C)c1ccc(CN[C@H](C)c2ccnn2C)cc1 ZINC000879687950 644380895 /nfs/dbraw/zinc/38/08/95/644380895.db2.gz YRUXUXRRDVFKIQ-CYBMUJFWSA-N 0 3 272.396 2.727 20 10 CFCDHN COc1ccc(O)c([C@@H](C)NCc2cnoc2C)c1 ZINC000129843728 645419279 /nfs/dbraw/zinc/41/92/79/645419279.db2.gz XNQVBBHZADIXSO-SECBINFHSA-N 0 3 262.309 2.548 20 10 CFCDHN COc1cccc(CN[C@@]2(c3ccccc3)C[C@@H](O)C2)c1O ZINC000883235104 645684247 /nfs/dbraw/zinc/68/42/47/645684247.db2.gz VALZXRDEMNERIO-RHNCMZPLSA-N 0 3 299.370 2.541 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+]CC1(CC3CC3)CC1)OCO2 ZINC000883249709 645697170 /nfs/dbraw/zinc/69/71/70/645697170.db2.gz OLNQTKBLPYAMEE-UHFFFAOYSA-N 0 3 275.348 2.791 20 10 CFCDHN CCN1CC[C@@H]1C[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000883354930 645759829 /nfs/dbraw/zinc/75/98/29/645759829.db2.gz FMARDRWERWHEBR-NQBHXWOUSA-N 0 3 278.371 2.763 20 10 CFCDHN [O-]c1ccccc1C[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000134226594 646308444 /nfs/dbraw/zinc/30/84/44/646308444.db2.gz QKLIEUBOHYUHSS-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886522590 647027634 /nfs/dbraw/zinc/02/76/34/647027634.db2.gz MUIXNSGOMBASEI-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN CC[NH+](CC)C[C@H](C)N[C@@H](C)c1c([O-])cccc1F ZINC000886522590 647027639 /nfs/dbraw/zinc/02/76/39/647027639.db2.gz MUIXNSGOMBASEI-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN CCc1ncc(CN[C@H](C)c2c([O-])cccc2F)o1 ZINC000886620384 647071551 /nfs/dbraw/zinc/07/15/51/647071551.db2.gz IRWIPDQMRFHDNP-SECBINFHSA-N 0 3 264.300 2.933 20 10 CFCDHN CCc1ncc(C[NH2+][C@H](C)c2c([O-])cccc2F)o1 ZINC000886620384 647071558 /nfs/dbraw/zinc/07/15/58/647071558.db2.gz IRWIPDQMRFHDNP-SECBINFHSA-N 0 3 264.300 2.933 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H]1CC3(CCC3)CO1)CC2 ZINC000886701826 647117029 /nfs/dbraw/zinc/11/70/29/647117029.db2.gz WJUWVXLPFOKNKL-KGLIPLIRSA-N 0 3 273.376 2.928 20 10 CFCDHN CC[C@H]([NH2+]CCc1cc(C)n(C)n1)c1ccccc1[O-] ZINC000926912360 648655114 /nfs/dbraw/zinc/65/51/14/648655114.db2.gz WCYFRUPVNCXVLR-HNNXBMFYSA-N 0 3 273.380 2.718 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2CC3(C2)OCCO3)c([O-])c1 ZINC000927004307 648680252 /nfs/dbraw/zinc/68/02/52/648680252.db2.gz RKLKFTHNWUGMRE-GFCCVEGCSA-N 0 3 277.364 2.504 20 10 CFCDHN C[C@@]1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCCCO1 ZINC000927018206 648684206 /nfs/dbraw/zinc/68/42/06/648684206.db2.gz KXGWQASOVMVZBT-CJNGLKHVSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCO[C@H]2CCOC2)c1[O-] ZINC000927081034 648701295 /nfs/dbraw/zinc/70/12/95/648701295.db2.gz MVLQARPCEBMAKN-AAEUAGOBSA-N 0 3 299.798 2.810 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@H]1C[N@H+](C)Cc1ccccc1[O-] ZINC000929977837 649158941 /nfs/dbraw/zinc/15/89/41/649158941.db2.gz XCEOIJCOHBVMRO-UKRRQHHQSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccccc1[O-] ZINC000929977837 649158943 /nfs/dbraw/zinc/15/89/43/649158943.db2.gz XCEOIJCOHBVMRO-UKRRQHHQSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@H]1C[N@H+](C)Cc1ccccc1[O-] ZINC000929977838 649159536 /nfs/dbraw/zinc/15/95/36/649159536.db2.gz XCEOIJCOHBVMRO-ZFWWWQNUSA-N 0 3 291.391 2.803 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1[O-] ZINC000929977838 649159538 /nfs/dbraw/zinc/15/95/38/649159538.db2.gz XCEOIJCOHBVMRO-ZFWWWQNUSA-N 0 3 291.391 2.803 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H](O)c2ccco2)c1[O-] ZINC000305780383 651077720 /nfs/dbraw/zinc/07/77/20/651077720.db2.gz OAGCJPLVUDENQE-GFCCVEGCSA-N 0 3 281.739 2.770 20 10 CFCDHN CC(C)O[C@H]1CC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000706554773 770409859 /nfs/dbraw/zinc/40/98/59/770409859.db2.gz HAJMUOPJPJSWOF-ZDUSSCGKSA-N 0 3 253.317 2.531 20 10 CFCDHN CC(C)O[C@H]1CC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000706554773 770409862 /nfs/dbraw/zinc/40/98/62/770409862.db2.gz HAJMUOPJPJSWOF-ZDUSSCGKSA-N 0 3 253.317 2.531 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCOC1CCCC1)CC2 ZINC000382255832 770605210 /nfs/dbraw/zinc/60/52/10/770605210.db2.gz MHCGUKILXMUNJV-CQSZACIVSA-N 0 3 261.365 2.928 20 10 CFCDHN Cc1ccc(O)c(CN2CC3(C2)CC(F)(F)C3)c1 ZINC001140617015 773217629 /nfs/dbraw/zinc/21/76/29/773217629.db2.gz AGCDTDNHHOBUAV-UHFFFAOYSA-N 0 3 253.292 2.932 20 10 CFCDHN C[C@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(F)ccc1[O-] ZINC000396559945 775939376 /nfs/dbraw/zinc/93/93/76/775939376.db2.gz WEXLXICLWLHQNX-GXSJLCMTSA-N 0 3 253.317 2.749 20 10 CFCDHN C[C@@H]1C[C@H](C[NH2+][C@H]2CCc3cccc([O-])c32)[C@H](C)O1 ZINC000686517678 776159086 /nfs/dbraw/zinc/15/90/86/776159086.db2.gz OXVKGKPHQHOHRR-WVWOOGAGSA-N 0 3 261.365 2.783 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCN(c3ccccn3)CC2)c1 ZINC000125605456 776379200 /nfs/dbraw/zinc/37/92/00/776379200.db2.gz BULCWDCGXHZMIC-UHFFFAOYSA-N 0 3 297.402 2.726 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC000722320595 776466787 /nfs/dbraw/zinc/46/67/87/776466787.db2.gz GMASMRCXULKBMV-HIFRSBDPSA-N 0 3 265.328 2.579 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H](CO)CC1CCCCC1 ZINC000223882833 776630313 /nfs/dbraw/zinc/63/03/13/776630313.db2.gz HLWWRXAMCLIYNF-HNNXBMFYSA-N 0 3 263.381 2.813 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[NH+]1CC(C2COC2)C1 ZINC001231588497 777269036 /nfs/dbraw/zinc/26/90/36/777269036.db2.gz RJENHDBHYJUBSB-UHFFFAOYSA-N 0 3 269.344 2.624 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231588955 777269916 /nfs/dbraw/zinc/26/99/16/777269916.db2.gz ZRHITNYUJRPDNK-JSGCOSHPSA-N 0 3 271.360 2.748 20 10 CFCDHN C[C@H]1C[C@@H](CO)[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231588955 777269920 /nfs/dbraw/zinc/26/99/20/777269920.db2.gz ZRHITNYUJRPDNK-JSGCOSHPSA-N 0 3 271.360 2.748 20 10 CFCDHN Cc1cccc(CN(CCO)Cc2cccs2)c1O ZINC001231591726 777270412 /nfs/dbraw/zinc/27/04/12/777270412.db2.gz AVUGHXFPFGANET-UHFFFAOYSA-N 0 3 277.389 2.757 20 10 CFCDHN COc1cc(CN(C)Cc2ccc(F)cc2)c(O)cc1O ZINC001231634097 777287384 /nfs/dbraw/zinc/28/73/84/777287384.db2.gz ICIMAQKZQXWXSK-UHFFFAOYSA-N 0 3 291.322 2.878 20 10 CFCDHN Cc1cc(C)c(CN2CCC(=O)[C@@H](C)CC2)c(O)c1 ZINC001231843003 777344679 /nfs/dbraw/zinc/34/46/79/777344679.db2.gz RRRXXAHVJZLWOO-LBPRGKRZSA-N 0 3 261.365 2.810 20 10 CFCDHN Cc1cc(C)c(CN2CCCC(=O)[C@H](C)C2)c(O)c1 ZINC001231842437 777345460 /nfs/dbraw/zinc/34/54/60/777345460.db2.gz LXQXVYBCSYAIHX-CYBMUJFWSA-N 0 3 261.365 2.810 20 10 CFCDHN Cc1cc(C)c(CN2CCO[C@H](C(C)C)C2)c(O)c1 ZINC001231847508 777348684 /nfs/dbraw/zinc/34/86/84/777348684.db2.gz DNVIKJUJMBMZEN-INIZCTEOSA-N 0 3 263.381 2.866 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1C[C@@H]2C[C@H]1C[C@H]2F ZINC001231852810 777351844 /nfs/dbraw/zinc/35/18/44/777351844.db2.gz OKTFBRJSDYZPTH-AEGPPILISA-N 0 3 278.371 2.694 20 10 CFCDHN CNc1ccccc1C[N@@H+]1CCc2cccc([O-])c2C1 ZINC001232674233 777638776 /nfs/dbraw/zinc/63/87/76/777638776.db2.gz VBLDADSLOJZBFM-UHFFFAOYSA-N 0 3 268.360 2.992 20 10 CFCDHN CNc1ccccc1C[N@H+]1CCc2cccc([O-])c2C1 ZINC001232674233 777638782 /nfs/dbraw/zinc/63/87/82/777638782.db2.gz VBLDADSLOJZBFM-UHFFFAOYSA-N 0 3 268.360 2.992 20 10 CFCDHN COC(=O)CC1CN(Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286459 777868121 /nfs/dbraw/zinc/86/81/21/777868121.db2.gz UWFUAXLOWABFAJ-UHFFFAOYSA-N 0 3 291.391 2.685 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c1[O-] ZINC001233290125 777869757 /nfs/dbraw/zinc/86/97/57/777869757.db2.gz KWOFTTTWYIUNQF-CNDDSTCGSA-N 0 3 285.746 2.702 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c1[O-] ZINC001233290125 777869768 /nfs/dbraw/zinc/86/97/68/777869768.db2.gz KWOFTTTWYIUNQF-CNDDSTCGSA-N 0 3 285.746 2.702 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](O)[C@H](C)C2)c1[O-] ZINC001233288083 777870098 /nfs/dbraw/zinc/87/00/98/777870098.db2.gz VASHECYYYGQRBY-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H](O)[C@H](C)C2)c1[O-] ZINC001233288083 777870107 /nfs/dbraw/zinc/87/01/07/777870107.db2.gz VASHECYYYGQRBY-MFKMUULPSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@H]4OCC[C@H]43)c2c1 ZINC001234525506 778243730 /nfs/dbraw/zinc/24/37/30/778243730.db2.gz IMIIHHWRXHAAAO-SJLPKXTDSA-N 0 3 299.370 2.917 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@H]4OCC[C@H]43)c2c1 ZINC001234525506 778243735 /nfs/dbraw/zinc/24/37/35/778243735.db2.gz IMIIHHWRXHAAAO-SJLPKXTDSA-N 0 3 299.370 2.917 20 10 CFCDHN CCN(Cc1c(O)ccc2ccc(OC)cc21)C1COC1 ZINC001234561817 778252829 /nfs/dbraw/zinc/25/28/29/778252829.db2.gz BTOYTXQLBUNKLX-UHFFFAOYSA-N 0 3 287.359 2.775 20 10 CFCDHN CC(C)(C)c1ccc(CN2CCN(C3CC3)CC2)c(O)c1 ZINC001235676817 778534516 /nfs/dbraw/zinc/53/45/16/778534516.db2.gz VYOGXYCYFUPJIU-UHFFFAOYSA-N 0 3 288.435 2.970 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)cc1Cl ZINC001236061766 778675073 /nfs/dbraw/zinc/67/50/73/778675073.db2.gz YPKPXNXLTWGYFW-AAEUAGOBSA-N 0 3 280.799 2.538 20 10 CFCDHN CN(Cc1c([O-])cccc1Cl)[C@@]1(C)CCC[NH2+]C1 ZINC001236205332 778733614 /nfs/dbraw/zinc/73/36/14/778733614.db2.gz DLLNYWBYIGXNHI-AWEZNQCLSA-N 0 3 268.788 2.620 20 10 CFCDHN CN(Cc1cc(F)c(Cl)cc1[O-])[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236217011 778741960 /nfs/dbraw/zinc/74/19/60/778741960.db2.gz MQJUNJCKANWKHX-QWHCGFSZSA-N 0 3 286.778 2.886 20 10 CFCDHN CN(Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219807 778744002 /nfs/dbraw/zinc/74/40/02/778744002.db2.gz XOMCMYBCYCWHJB-STQMWFEESA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@H+](Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@@H]1N ZINC001236219807 778744005 /nfs/dbraw/zinc/74/40/05/778744005.db2.gz XOMCMYBCYCWHJB-STQMWFEESA-N 0 3 286.778 2.886 20 10 CFCDHN C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])[C@H]1CCCC[C@@H]1N ZINC001236219807 778744008 /nfs/dbraw/zinc/74/40/08/778744008.db2.gz XOMCMYBCYCWHJB-STQMWFEESA-N 0 3 286.778 2.886 20 10 CFCDHN CC(C)(C)c1cc([O-])c(CN2C[C@@H]3C[NH2+][C@@H]3C2)cc1Cl ZINC001236286478 778762275 /nfs/dbraw/zinc/76/22/75/778762275.db2.gz NDQXLECPDLIPKE-SMDDNHRTSA-N 0 3 294.826 2.747 20 10 CFCDHN CCCN(Cc1cc(Cl)c(C)cc1[O-])[C@@H]1CC[NH2+]C1 ZINC001236324017 778781009 /nfs/dbraw/zinc/78/10/09/778781009.db2.gz NAQDRZABIIJTMB-CYBMUJFWSA-N 0 3 282.815 2.928 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](O)[C@H](C)C2)c([O-])c1 ZINC001236782876 778933233 /nfs/dbraw/zinc/93/32/33/778933233.db2.gz GGASGXJDLJGZHE-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](O)[C@H](C)C2)c([O-])c1 ZINC001236782876 778933237 /nfs/dbraw/zinc/93/32/37/778933237.db2.gz GGASGXJDLJGZHE-IUODEOHRSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@H](O)[C@H](C)C2)c([O-])c1 ZINC001236782874 778933504 /nfs/dbraw/zinc/93/35/04/778933504.db2.gz GGASGXJDLJGZHE-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@H](O)[C@H](C)C2)c([O-])c1 ZINC001236782874 778933506 /nfs/dbraw/zinc/93/35/06/778933506.db2.gz GGASGXJDLJGZHE-DOMZBBRYSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784230 778934992 /nfs/dbraw/zinc/93/49/92/778934992.db2.gz SCBCEAZAHDRGPO-BLLLJJGKSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@](C)(O)[C@@H](C)C2)c([O-])c1 ZINC001236784230 778934997 /nfs/dbraw/zinc/93/49/97/778934997.db2.gz SCBCEAZAHDRGPO-BLLLJJGKSA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001236784734 778935087 /nfs/dbraw/zinc/93/50/87/778935087.db2.gz ZSAQQIFJCJAJBH-KRWDZBQOSA-N 0 3 277.408 2.939 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001236784734 778935091 /nfs/dbraw/zinc/93/50/91/778935091.db2.gz ZSAQQIFJCJAJBH-KRWDZBQOSA-N 0 3 277.408 2.939 20 10 CFCDHN CCO[C@@H]1CCC[N@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236785904 778935317 /nfs/dbraw/zinc/93/53/17/778935317.db2.gz AROAFSPJBUMPMF-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCO[C@@H]1CCC[N@@H+](Cc2ccc(CC)cc2[O-])C1 ZINC001236785904 778935322 /nfs/dbraw/zinc/93/53/22/778935322.db2.gz AROAFSPJBUMPMF-OAHLLOKOSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(CN(C)Cc2ccncc2)c(O)c1 ZINC001236783391 778935758 /nfs/dbraw/zinc/93/57/58/778935758.db2.gz LEIAFVFTTRQMLN-UHFFFAOYSA-N 0 3 256.349 2.982 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC001236791485 778937412 /nfs/dbraw/zinc/93/74/12/778937412.db2.gz HRUWSEUAKIDKIQ-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@]23CCOC3)c([O-])c1 ZINC001236791485 778937417 /nfs/dbraw/zinc/93/74/17/778937417.db2.gz HRUWSEUAKIDKIQ-MRXNPFEDSA-N 0 3 261.365 2.710 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](c3nc(C)no3)C2)c([O-])c1 ZINC001236791757 778937437 /nfs/dbraw/zinc/93/74/37/778937437.db2.gz KEGOTZSZFPJCPM-CQSZACIVSA-N 0 3 287.363 2.636 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](c3nc(C)no3)C2)c([O-])c1 ZINC001236791757 778937439 /nfs/dbraw/zinc/93/74/39/778937439.db2.gz KEGOTZSZFPJCPM-CQSZACIVSA-N 0 3 287.363 2.636 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC001236812571 778950001 /nfs/dbraw/zinc/95/00/01/778950001.db2.gz BOYRSCITFPSODF-CYBMUJFWSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H](OC(C)C)C2)c([O-])c1 ZINC001236812571 778950007 /nfs/dbraw/zinc/95/00/07/778950007.db2.gz BOYRSCITFPSODF-CYBMUJFWSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236816044 778950728 /nfs/dbraw/zinc/95/07/28/778950728.db2.gz QGZGEAWOIGCJLP-SWLSCSKDSA-N 0 3 289.375 2.510 20 10 CFCDHN COc1cc(C)c(C[N@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c([O-])c1 ZINC001236816044 778950732 /nfs/dbraw/zinc/95/07/32/778950732.db2.gz QGZGEAWOIGCJLP-SWLSCSKDSA-N 0 3 289.375 2.510 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@@H](CO)C1 ZINC001236831568 778958275 /nfs/dbraw/zinc/95/82/75/778958275.db2.gz AOOZPIBDQSNITD-CYBMUJFWSA-N 0 3 271.360 2.750 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@@H](CO)C1 ZINC001236831568 778958277 /nfs/dbraw/zinc/95/82/77/778958277.db2.gz AOOZPIBDQSNITD-CYBMUJFWSA-N 0 3 271.360 2.750 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCC[C@@H](O)C1 ZINC001236840341 778962529 /nfs/dbraw/zinc/96/25/29/778962529.db2.gz NDWBASCTFZVRTO-OAHLLOKOSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCC[C@@H](O)C1 ZINC001236840341 778962536 /nfs/dbraw/zinc/96/25/36/778962536.db2.gz NDWBASCTFZVRTO-OAHLLOKOSA-N 0 3 257.333 2.502 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001237042655 778995707 /nfs/dbraw/zinc/99/57/07/778995707.db2.gz JJXCSIZFAOXWHR-RVSPLBMKSA-N 0 3 291.391 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c([O-])c1 ZINC001237042655 778995712 /nfs/dbraw/zinc/99/57/12/778995712.db2.gz JJXCSIZFAOXWHR-RVSPLBMKSA-N 0 3 291.391 2.790 20 10 CFCDHN COC(=O)[C@H]1CCC[N@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044783 778997683 /nfs/dbraw/zinc/99/76/83/778997683.db2.gz DKBYZOVGWMEZJG-HNNXBMFYSA-N 0 3 291.391 2.901 20 10 CFCDHN COC(=O)[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)cc2[O-])C1 ZINC001237044783 778997687 /nfs/dbraw/zinc/99/76/87/778997687.db2.gz DKBYZOVGWMEZJG-HNNXBMFYSA-N 0 3 291.391 2.901 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@@]3(CCCO3)C2)c([O-])c1 ZINC001237049767 779001032 /nfs/dbraw/zinc/00/10/32/779001032.db2.gz JALJYMFFHCSILO-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@@]3(CCCO3)C2)c([O-])c1 ZINC001237049767 779001037 /nfs/dbraw/zinc/00/10/37/779001037.db2.gz JALJYMFFHCSILO-INIZCTEOSA-N 0 3 277.364 2.546 20 10 CFCDHN CC[N@H+](CCC(=O)OC)Cc1ccc(C(C)C)cc1[O-] ZINC001237054548 779002015 /nfs/dbraw/zinc/00/20/15/779002015.db2.gz CJNWUVXIEGKHLN-UHFFFAOYSA-N 0 3 279.380 2.901 20 10 CFCDHN CC[N@@H+](CCC(=O)OC)Cc1ccc(C(C)C)cc1[O-] ZINC001237054548 779002021 /nfs/dbraw/zinc/00/20/21/779002021.db2.gz CJNWUVXIEGKHLN-UHFFFAOYSA-N 0 3 279.380 2.901 20 10 CFCDHN CC(=O)[C@H]1CCCN(Cc2c(O)ccc(F)c2Cl)C1 ZINC001237127237 779020835 /nfs/dbraw/zinc/02/08/35/779020835.db2.gz XLJAOYLQDJWXOE-JTQLQIEISA-N 0 3 285.746 2.986 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C)[C@](C)(O)CC1 ZINC001237485813 779118055 /nfs/dbraw/zinc/11/80/55/779118055.db2.gz UGFYMIUOSRAYDW-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C)[C@](C)(O)CC1 ZINC001237485813 779118058 /nfs/dbraw/zinc/11/80/58/779118058.db2.gz UGFYMIUOSRAYDW-CZUORRHYSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC001237482529 779118186 /nfs/dbraw/zinc/11/81/86/779118186.db2.gz LKWYRIQUMAEUPI-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC001237482529 779118190 /nfs/dbraw/zinc/11/81/90/779118190.db2.gz LKWYRIQUMAEUPI-CJNGLKHVSA-N 0 3 261.365 2.702 20 10 CFCDHN CCOC(=O)[C@H]1CCC[N@H+](Cc2c(C)cccc2[O-])[C@@H]1C ZINC001237488466 779118970 /nfs/dbraw/zinc/11/89/70/779118970.db2.gz YLRRLZAEFWJCPE-KGLIPLIRSA-N 0 3 291.391 2.864 20 10 CFCDHN CCOC(=O)[C@H]1CCC[N@@H+](Cc2c(C)cccc2[O-])[C@@H]1C ZINC001237488466 779118974 /nfs/dbraw/zinc/11/89/74/779118974.db2.gz YLRRLZAEFWJCPE-KGLIPLIRSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)CCc1cccnc1 ZINC001237487827 779119424 /nfs/dbraw/zinc/11/94/24/779119424.db2.gz NKVXHUYTDJSPPA-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)CCc1cccnc1 ZINC001237487827 779119426 /nfs/dbraw/zinc/11/94/26/779119426.db2.gz NKVXHUYTDJSPPA-UHFFFAOYSA-N 0 3 256.349 2.770 20 10 CFCDHN COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(C)cccc1[O-] ZINC001237493358 779120257 /nfs/dbraw/zinc/12/02/57/779120257.db2.gz XUAKGHLPPZTGLM-PBWFPOADSA-N 0 3 261.365 2.842 20 10 CFCDHN COC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(C)cccc1[O-] ZINC001237493358 779120262 /nfs/dbraw/zinc/12/02/62/779120262.db2.gz XUAKGHLPPZTGLM-PBWFPOADSA-N 0 3 261.365 2.842 20 10 CFCDHN CC[N@H+](C)Cc1cc(Br)c(C)cc1[O-] ZINC001237676199 779158963 /nfs/dbraw/zinc/15/89/63/779158963.db2.gz GQRJEBRZWXXHEX-UHFFFAOYSA-N 0 3 258.159 2.915 20 10 CFCDHN CC[N@@H+](C)Cc1cc(Br)c(C)cc1[O-] ZINC001237676199 779158965 /nfs/dbraw/zinc/15/89/65/779158965.db2.gz GQRJEBRZWXXHEX-UHFFFAOYSA-N 0 3 258.159 2.915 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC3(COC3)C2)c1[O-] ZINC001237679071 779159681 /nfs/dbraw/zinc/15/96/81/779159681.db2.gz GAJKFXWZYAEEND-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC3(COC3)C2)c1[O-] ZINC001237679071 779159684 /nfs/dbraw/zinc/15/96/84/779159684.db2.gz GAJKFXWZYAEEND-UHFFFAOYSA-N 0 3 281.783 2.966 20 10 CFCDHN CC(=O)[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237688465 779160698 /nfs/dbraw/zinc/16/06/98/779160698.db2.gz JKCHFNJNPCGACX-LLVKDONJSA-N 0 3 267.756 2.765 20 10 CFCDHN CC(=O)[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC001237688465 779160700 /nfs/dbraw/zinc/16/07/00/779160700.db2.gz JKCHFNJNPCGACX-LLVKDONJSA-N 0 3 267.756 2.765 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CCCO)C(C)C)c1[O-] ZINC001237688042 779160992 /nfs/dbraw/zinc/16/09/92/779160992.db2.gz ZQJUZIIUMZYMNR-UHFFFAOYSA-N 0 3 271.788 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CCCO)C(C)C)c1[O-] ZINC001237688042 779160994 /nfs/dbraw/zinc/16/09/94/779160994.db2.gz ZQJUZIIUMZYMNR-UHFFFAOYSA-N 0 3 271.788 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@](C)(O)C2)c1[O-] ZINC001237681885 779161630 /nfs/dbraw/zinc/16/16/30/779161630.db2.gz UKRUGXYFACLHBD-IAQYHMDHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@](C)(O)C2)c1[O-] ZINC001237681885 779161634 /nfs/dbraw/zinc/16/16/34/779161634.db2.gz UKRUGXYFACLHBD-IAQYHMDHSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@H]2CO)c1[O-] ZINC001237682082 779161681 /nfs/dbraw/zinc/16/16/81/779161681.db2.gz XNWMQZXIMOWGLC-IINYFYTJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c1[O-] ZINC001237682082 779161686 /nfs/dbraw/zinc/16/16/86/779161686.db2.gz XNWMQZXIMOWGLC-IINYFYTJSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@@H]3CCO[C@@H]3C2)c1[O-] ZINC001237687346 779161718 /nfs/dbraw/zinc/16/17/18/779161718.db2.gz XZADOQQLHBQVGJ-GXFFZTMASA-N 0 3 267.756 2.575 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@@H]3CCO[C@@H]3C2)c1[O-] ZINC001237687346 779161721 /nfs/dbraw/zinc/16/17/21/779161721.db2.gz XZADOQQLHBQVGJ-GXFFZTMASA-N 0 3 267.756 2.575 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCCC[C@](O)(CF)C2)c1[O-] ZINC001238055791 779241608 /nfs/dbraw/zinc/24/16/08/779241608.db2.gz DNXARWARBLILLS-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCCC[C@](O)(CF)C2)c1[O-] ZINC001238055791 779241609 /nfs/dbraw/zinc/24/16/09/779241609.db2.gz DNXARWARBLILLS-HNNXBMFYSA-N 0 3 285.334 2.526 20 10 CFCDHN Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2C(C)(C)O)c1[O-] ZINC001238066080 779244490 /nfs/dbraw/zinc/24/44/90/779244490.db2.gz DXRPSLCKBCAEEP-ZDUSSCGKSA-N 0 3 267.344 2.575 20 10 CFCDHN Cc1cc(F)cc(C[N@H+]2CCC[C@H]2C(C)(C)O)c1[O-] ZINC001238066080 779244498 /nfs/dbraw/zinc/24/44/98/779244498.db2.gz DXRPSLCKBCAEEP-ZDUSSCGKSA-N 0 3 267.344 2.575 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC(n3ccnc3)CC2)c1[O-] ZINC001238069243 779245354 /nfs/dbraw/zinc/24/53/54/779245354.db2.gz IALIRCMRFTVPCV-UHFFFAOYSA-N 0 3 289.354 2.873 20 10 CFCDHN CC[C@H]([NH3+])CN(C)Cc1cccc(C(F)(F)F)c1[O-] ZINC001236884891 779655457 /nfs/dbraw/zinc/65/54/57/779655457.db2.gz VCGYLUGSNNLSMN-JTQLQIEISA-N 0 3 276.302 2.580 20 10 CFCDHN CC[C@H](N)C[N@H+](C)Cc1cccc(C(F)(F)F)c1[O-] ZINC001236884891 779655465 /nfs/dbraw/zinc/65/54/65/779655465.db2.gz VCGYLUGSNNLSMN-JTQLQIEISA-N 0 3 276.302 2.580 20 10 CFCDHN CC[C@H](N)C[N@@H+](C)Cc1cccc(C(F)(F)F)c1[O-] ZINC001236884891 779655468 /nfs/dbraw/zinc/65/54/68/779655468.db2.gz VCGYLUGSNNLSMN-JTQLQIEISA-N 0 3 276.302 2.580 20 10 CFCDHN CN1CCC=C(c2ccn(Cc3cccc(F)c3)c(=O)c2)C1 ZINC001241571898 780989810 /nfs/dbraw/zinc/98/98/10/780989810.db2.gz KOZKKWVYANTFHC-UHFFFAOYSA-N 0 3 298.361 2.755 20 10 CFCDHN C[C@@H](Cc1ccccn1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000703254745 781004173 /nfs/dbraw/zinc/00/41/73/781004173.db2.gz DUQWAMRJGHYKEE-NSHDSACASA-N 0 3 260.312 2.647 20 10 CFCDHN Cc1ncccc1CNCc1ccc(N(C)C)cc1 ZINC000705568740 781142313 /nfs/dbraw/zinc/14/23/13/781142313.db2.gz BBIZNEMULIVGJL-UHFFFAOYSA-N 0 3 255.365 2.746 20 10 CFCDHN CN(C)c1ccc(CN(C[C@H]2CCCO2)C2CC2)cc1 ZINC000298691467 282289073 /nfs/dbraw/zinc/28/90/73/282289073.db2.gz DFJMWMGKOXLCMP-QGZVFWFLSA-N 0 3 274.408 2.896 20 10 CFCDHN COc1cccc(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)c1[O-] ZINC000032131236 346300432 /nfs/dbraw/zinc/30/04/32/346300432.db2.gz QAQTZSBWVPRFJE-MLGOLLRUSA-N 0 3 287.359 2.613 20 10 CFCDHN OCC1CCN(c2ccc(CNCc3cc[nH]c3)cc2)CC1 ZINC000086251659 347484494 /nfs/dbraw/zinc/48/44/94/347484494.db2.gz PSYMXUPAZTUKHL-UHFFFAOYSA-N 0 3 299.418 2.513 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]C[C@@H](C)CCCO)cc1C ZINC000294895521 199236071 /nfs/dbraw/zinc/23/60/71/199236071.db2.gz WVNVQPYFVNAADC-NSHDSACASA-N 0 3 251.370 2.507 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCC(C)(C)CO)cc1C ZINC000294897049 199237279 /nfs/dbraw/zinc/23/72/79/199237279.db2.gz WWWLLQJPPAXBSI-UHFFFAOYSA-N 0 3 251.370 2.507 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@H](CO)c2ccccc2)c1 ZINC000294923352 199251142 /nfs/dbraw/zinc/25/11/42/199251142.db2.gz BCISZISNBUCRIA-MRXNPFEDSA-N 0 3 287.359 2.566 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CCCCO)c1ccccc1[O-] ZINC000294933650 199257060 /nfs/dbraw/zinc/25/70/60/199257060.db2.gz BSVVLRGNKPOVBE-GXTWGEPZSA-N 0 3 251.370 2.984 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H](O)C1CCCCC1)CC2 ZINC000297531875 200220621 /nfs/dbraw/zinc/22/06/21/200220621.db2.gz DOQUMIRYMROTLD-ZBFHGGJFSA-N 0 3 275.392 2.910 20 10 CFCDHN CC(C)(CO)CCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297818120 200286489 /nfs/dbraw/zinc/28/64/89/200286489.db2.gz RGDLOINAHVQBCY-CYBMUJFWSA-N 0 3 263.381 2.768 20 10 CFCDHN COc1cccc(C[NH2+]CCc2cccs2)c1[O-] ZINC000019948900 372214199 /nfs/dbraw/zinc/21/41/99/372214199.db2.gz KTOTZYMSUMHIGL-UHFFFAOYSA-N 0 3 263.362 2.795 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCN1CC)c1ccccc1[O-] ZINC000019960445 372216405 /nfs/dbraw/zinc/21/64/05/372216405.db2.gz QKHDDYWIPPPXHV-UKRRQHHQSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccccc1[O-] ZINC000020120690 372232513 /nfs/dbraw/zinc/23/25/13/372232513.db2.gz HTAWMKBXCCQVDT-OAHLLOKOSA-N 0 3 292.423 2.544 20 10 CFCDHN COc1cccc(C[NH2+]CCc2ccsc2)c1[O-] ZINC000042598983 372936495 /nfs/dbraw/zinc/93/64/95/372936495.db2.gz APUPVHMLIBFXNC-UHFFFAOYSA-N 0 3 263.362 2.795 20 10 CFCDHN Cc1ccc(CNCc2ccc(N(C)C)cc2)cn1 ZINC000057591295 373602416 /nfs/dbraw/zinc/60/24/16/373602416.db2.gz PBSOHEQYYRTVFS-UHFFFAOYSA-N 0 3 255.365 2.746 20 10 CFCDHN COc1ccccc1CC[NH2+]Cc1ccccc1[O-] ZINC000083422159 374744126 /nfs/dbraw/zinc/74/41/26/374744126.db2.gz NKGBWMZOAYQWOZ-UHFFFAOYSA-N 0 3 257.333 2.733 20 10 CFCDHN CCCOc1ccc(C[N@H+](CC)CCC(=O)OC)c([O-])c1 ZINC000092380200 375103047 /nfs/dbraw/zinc/10/30/47/375103047.db2.gz PNBDEHUSLXQWCK-UHFFFAOYSA-N 0 3 295.379 2.566 20 10 CFCDHN CCCOc1ccc(C[N@@H+](CC)CCC(=O)OC)c([O-])c1 ZINC000092380200 375103056 /nfs/dbraw/zinc/10/30/56/375103056.db2.gz PNBDEHUSLXQWCK-UHFFFAOYSA-N 0 3 295.379 2.566 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@@H](Oc3cccnc3)C2)cc1 ZINC000093690489 375297482 /nfs/dbraw/zinc/29/74/82/375297482.db2.gz FSONAPHPGKEMPT-GOSISDBHSA-N 0 3 297.402 2.801 20 10 CFCDHN COc1cccc(C[N@@H+]2CCC[C@H]2CSC)c1[O-] ZINC000093761322 375308373 /nfs/dbraw/zinc/30/83/73/375308373.db2.gz CSILISQQIRYMLH-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc(C[N@H+]2CCC[C@H]2CSC)c1[O-] ZINC000093761322 375308379 /nfs/dbraw/zinc/30/83/79/375308379.db2.gz CSILISQQIRYMLH-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CCc2nccs2)c1[O-] ZINC000093843878 375321079 /nfs/dbraw/zinc/32/10/79/375321079.db2.gz AQFQSXPCQNDPPA-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CCc2nccs2)c1[O-] ZINC000093843878 375321081 /nfs/dbraw/zinc/32/10/81/375321081.db2.gz AQFQSXPCQNDPPA-UHFFFAOYSA-N 0 3 292.404 2.922 20 10 CFCDHN CN(C)c1ccc(CN(C)[C@H]2CCCc3c2cnn3C)cc1 ZINC000093863642 375323799 /nfs/dbraw/zinc/32/37/99/375323799.db2.gz NDBXCBRXZBIAIT-KRWDZBQOSA-N 0 3 298.434 2.996 20 10 CFCDHN C[C@H](CCN(C)C)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094617920 375370371 /nfs/dbraw/zinc/37/03/71/375370371.db2.gz WAGUPFMIBCMRKV-MNOVXSKESA-N 0 3 254.349 2.522 20 10 CFCDHN CC(C)[C@H](C)[N@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658630 375578108 /nfs/dbraw/zinc/57/81/08/375578108.db2.gz NJAZEEKUCIWHGK-JTQLQIEISA-N 0 3 251.326 2.597 20 10 CFCDHN CC(C)[C@H](C)[N@@H+](C)Cc1cc2c(cc1[O-])OCO2 ZINC000097658630 375578114 /nfs/dbraw/zinc/57/81/14/375578114.db2.gz NJAZEEKUCIWHGK-JTQLQIEISA-N 0 3 251.326 2.597 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@H]1CCc2c1cccc2O ZINC000105486784 375789436 /nfs/dbraw/zinc/78/94/36/375789436.db2.gz YVJVQGREJGSYQK-AWEZNQCLSA-N 0 3 255.317 2.875 20 10 CFCDHN CCC[N@@H+]1CC[C@H](CNCc2c([O-])cccc2Cl)C1 ZINC000113326833 376010910 /nfs/dbraw/zinc/01/09/10/376010910.db2.gz FEJSUNLQMORNDQ-GFCCVEGCSA-N 0 3 282.815 2.867 20 10 CFCDHN CCC[N@H+]1CC[C@H](CNCc2c([O-])cccc2Cl)C1 ZINC000113326833 376010915 /nfs/dbraw/zinc/01/09/15/376010915.db2.gz FEJSUNLQMORNDQ-GFCCVEGCSA-N 0 3 282.815 2.867 20 10 CFCDHN COCCCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000117881485 376264132 /nfs/dbraw/zinc/26/41/32/376264132.db2.gz HUYZJPCRRNOEQU-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN COCCCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000117881485 376264139 /nfs/dbraw/zinc/26/41/39/376264139.db2.gz HUYZJPCRRNOEQU-MRXNPFEDSA-N 0 3 293.407 2.800 20 10 CFCDHN COCC[N@@H+](Cc1cccc(OC)c1[O-])CC(C)C ZINC000132649115 377861903 /nfs/dbraw/zinc/86/19/03/377861903.db2.gz GAFRZWWUQJBAIV-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN COCC[N@H+](Cc1cccc(OC)c1[O-])CC(C)C ZINC000132649115 377861907 /nfs/dbraw/zinc/86/19/07/377861907.db2.gz GAFRZWWUQJBAIV-UHFFFAOYSA-N 0 3 267.369 2.505 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)C2CC(F)(F)C2)c([O-])c1 ZINC000529557333 383729793 /nfs/dbraw/zinc/72/97/93/383729793.db2.gz MJPMJEUYRQFOJV-SECBINFHSA-N 0 3 271.307 2.924 20 10 CFCDHN CSCC[N@@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000176798517 380274166 /nfs/dbraw/zinc/27/41/66/380274166.db2.gz HKQMGNWBEDQAHY-CQSZACIVSA-N 0 3 281.421 2.736 20 10 CFCDHN CSCC[N@H+](Cc1ccccc1[O-])C[C@H]1CCCO1 ZINC000176798517 380274173 /nfs/dbraw/zinc/27/41/73/380274173.db2.gz HKQMGNWBEDQAHY-CQSZACIVSA-N 0 3 281.421 2.736 20 10 CFCDHN C[C@H]([N@H+](C)Cc1cc2c(cc1[O-])OCO2)C1(C)CC1 ZINC000176834378 380277203 /nfs/dbraw/zinc/27/72/03/380277203.db2.gz SPOBEOQRGGXMPV-JTQLQIEISA-N 0 3 263.337 2.741 20 10 CFCDHN C[C@H]([N@@H+](C)Cc1cc2c(cc1[O-])OCO2)C1(C)CC1 ZINC000176834378 380277208 /nfs/dbraw/zinc/27/72/08/380277208.db2.gz SPOBEOQRGGXMPV-JTQLQIEISA-N 0 3 263.337 2.741 20 10 CFCDHN CCCN(Cc1cncn1C)Cc1ccccc1O ZINC000177037210 380296610 /nfs/dbraw/zinc/29/66/10/380296610.db2.gz DXXDLVTVBOZEOQ-UHFFFAOYSA-N 0 3 259.353 2.538 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000177630980 380361021 /nfs/dbraw/zinc/36/10/21/380361021.db2.gz PZFSEQCYXYFSRS-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2cc(C)c(C)cc2[O-])C1 ZINC000177630980 380361026 /nfs/dbraw/zinc/36/10/26/380361026.db2.gz PZFSEQCYXYFSRS-AWEZNQCLSA-N 0 3 263.381 2.867 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCCN(c2nccs2)CC1 ZINC000179563272 380556670 /nfs/dbraw/zinc/55/66/70/380556670.db2.gz UCVGBJFKQOPUGO-UHFFFAOYSA-N 0 3 289.404 2.561 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCCN(c2nccs2)CC1 ZINC000179563272 380556675 /nfs/dbraw/zinc/55/66/75/380556675.db2.gz UCVGBJFKQOPUGO-UHFFFAOYSA-N 0 3 289.404 2.561 20 10 CFCDHN CCN(C)c1ccc([C@H](C)NCC2(C)OCCO2)cc1 ZINC000179575911 380561043 /nfs/dbraw/zinc/56/10/43/380561043.db2.gz AYOMJSVHEVKFAQ-ZDUSSCGKSA-N 0 3 278.396 2.556 20 10 CFCDHN CC[C@H](CSC)[N@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000179787503 380580361 /nfs/dbraw/zinc/58/03/61/380580361.db2.gz WUHQVOQJZABIKR-GFCCVEGCSA-N 0 3 299.436 2.983 20 10 CFCDHN CC[C@H](CSC)[N@@H+](C)Cc1cc(OC)c(OC)cc1[O-] ZINC000179787503 380580366 /nfs/dbraw/zinc/58/03/66/380580366.db2.gz WUHQVOQJZABIKR-GFCCVEGCSA-N 0 3 299.436 2.983 20 10 CFCDHN CCN1CC[C@@H]([N@H+](C)Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000180194780 380631768 /nfs/dbraw/zinc/63/17/68/380631768.db2.gz QDLGQPDIELSQJY-IUODEOHRSA-N 0 3 280.387 2.693 20 10 CFCDHN CCN1CC[C@@H]([N@@H+](C)Cc2cc(F)ccc2[O-])[C@H](C)C1 ZINC000180194780 380631771 /nfs/dbraw/zinc/63/17/71/380631771.db2.gz QDLGQPDIELSQJY-IUODEOHRSA-N 0 3 280.387 2.693 20 10 CFCDHN C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)NCc1ccccc1 ZINC000179878569 380591938 /nfs/dbraw/zinc/59/19/38/380591938.db2.gz TWKDNFKBYFXDCK-ZIAGYGMSSA-N 0 3 298.386 2.748 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCO[C@H](C)C2)c1[O-] ZINC000180028189 380610993 /nfs/dbraw/zinc/61/09/93/380610993.db2.gz RLJDBGDMADULSF-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCO[C@H](C)C2)c1[O-] ZINC000180028189 380611002 /nfs/dbraw/zinc/61/10/02/380611002.db2.gz RLJDBGDMADULSF-LLVKDONJSA-N 0 3 269.772 2.965 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000180173156 380628678 /nfs/dbraw/zinc/62/86/78/380628678.db2.gz PHBQOTYFAVJCKY-IAQYHMDHSA-N 0 3 265.328 2.532 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000180173156 380628686 /nfs/dbraw/zinc/62/86/86/380628686.db2.gz PHBQOTYFAVJCKY-IAQYHMDHSA-N 0 3 265.328 2.532 20 10 CFCDHN CCOC1CC2(C1)CC[N@H+](Cc1cc(F)ccc1[O-])C2 ZINC000289271761 381028591 /nfs/dbraw/zinc/02/85/91/381028591.db2.gz GIYOIZJPDHPFHZ-UHFFFAOYSA-N 0 3 279.355 2.922 20 10 CFCDHN CCOC1CC2(C1)CC[N@@H+](Cc1cc(F)ccc1[O-])C2 ZINC000289271761 381028599 /nfs/dbraw/zinc/02/85/99/381028599.db2.gz GIYOIZJPDHPFHZ-UHFFFAOYSA-N 0 3 279.355 2.922 20 10 CFCDHN Cc1cccc(C[N@H+]2CC=C(c3ccnn3C)CC2)c1[O-] ZINC000289345004 381030357 /nfs/dbraw/zinc/03/03/57/381030357.db2.gz IJDMLYZIWYPEFM-UHFFFAOYSA-N 0 3 283.375 2.723 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC=C(c3ccnn3C)CC2)c1[O-] ZINC000289345004 381030365 /nfs/dbraw/zinc/03/03/65/381030365.db2.gz IJDMLYZIWYPEFM-UHFFFAOYSA-N 0 3 283.375 2.723 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)CCc1ccccc1 ZINC000182520736 381103868 /nfs/dbraw/zinc/10/38/68/381103868.db2.gz SQHFNUHNINFVOV-QGZVFWFLSA-N 0 3 285.387 2.818 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)CCc1ccccc1 ZINC000182520736 381103878 /nfs/dbraw/zinc/10/38/78/381103878.db2.gz SQHFNUHNINFVOV-QGZVFWFLSA-N 0 3 285.387 2.818 20 10 CFCDHN Cc1cccnc1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295845912 381112206 /nfs/dbraw/zinc/11/22/06/381112206.db2.gz AUMCVNIIAZLCJM-OAHLLOKOSA-N 0 3 268.360 2.915 20 10 CFCDHN C[C@H](CC(C)(C)O)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000295854094 381118634 /nfs/dbraw/zinc/11/86/34/381118634.db2.gz BDIYZBFGIGULMZ-ZJUUUORDSA-N 0 3 255.333 2.731 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000368593088 381077107 /nfs/dbraw/zinc/07/71/07/381077107.db2.gz SAZWAXHEEKFEED-AWEZNQCLSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000368593088 381077110 /nfs/dbraw/zinc/07/71/10/381077110.db2.gz SAZWAXHEEKFEED-AWEZNQCLSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](O)c2ccccc2C1 ZINC000368819307 381143088 /nfs/dbraw/zinc/14/30/88/381143088.db2.gz SKPBHNDLRAKODK-KRWDZBQOSA-N 0 3 269.344 2.832 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](O)c2ccccc2C1 ZINC000368819307 381143094 /nfs/dbraw/zinc/14/30/94/381143094.db2.gz SKPBHNDLRAKODK-KRWDZBQOSA-N 0 3 269.344 2.832 20 10 CFCDHN C[C@@H]1CCCCN1CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295920649 381159714 /nfs/dbraw/zinc/15/97/14/381159714.db2.gz JSQWAVRBCVQCNL-UKRRQHHQSA-N 0 3 274.408 2.844 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](O)c1cccc(F)c1)CC2 ZINC000295999218 381205140 /nfs/dbraw/zinc/20/51/40/381205140.db2.gz OFOQGMYATCLYGD-GOEBONIOSA-N 0 3 287.334 2.842 20 10 CFCDHN CC(C)C[C@H](C[NH2+][C@@H]1CCc2cccc([O-])c21)N(C)C ZINC000296101336 381256912 /nfs/dbraw/zinc/25/69/12/381256912.db2.gz UITSQHBUSBYSAL-HUUCEWRRSA-N 0 3 276.424 2.945 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccccc1O)c1ccccc1[O-] ZINC000183481150 381277913 /nfs/dbraw/zinc/27/79/13/381277913.db2.gz UHWDVBZEMKYXSA-GFCCVEGCSA-N 0 3 257.333 2.991 20 10 CFCDHN C[C@@H]([NH2+]CCCNC(=O)OC(C)(C)C)c1ccccc1[O-] ZINC000183490808 381278255 /nfs/dbraw/zinc/27/82/55/381278255.db2.gz KSOGNCFTRVQYKM-GFCCVEGCSA-N 0 3 294.395 2.958 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCCO)c([O-])c1 ZINC000296313005 381342885 /nfs/dbraw/zinc/34/28/85/381342885.db2.gz GLPPXQMWXCNIAW-QWHCGFSZSA-N 0 3 251.370 2.902 20 10 CFCDHN C[C@H]([NH2+]CCC(C)(C)CO)c1cc(F)ccc1[O-] ZINC000296353058 381358681 /nfs/dbraw/zinc/35/86/81/381358681.db2.gz IKLHBVHBEQBPEF-JTQLQIEISA-N 0 3 255.333 2.591 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c1 ZINC000184731969 381471062 /nfs/dbraw/zinc/47/10/62/381471062.db2.gz HTENFGGQJGSJLJ-HNNXBMFYSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](Cc3nccn3C)C2)c1 ZINC000184731969 381471067 /nfs/dbraw/zinc/47/10/67/381471067.db2.gz HTENFGGQJGSJLJ-HNNXBMFYSA-N 0 3 299.418 2.889 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000185030082 381516561 /nfs/dbraw/zinc/51/65/61/381516561.db2.gz BQCJPDLIRBTWIN-AWEZNQCLSA-N 0 3 292.423 3.000 20 10 CFCDHN CNC(=O)c1cccc(CN[C@H](C)c2cc(C)ccc2O)c1 ZINC000185150182 381547295 /nfs/dbraw/zinc/54/72/95/381547295.db2.gz XGFDHSXAHDXVMH-CYBMUJFWSA-N 0 3 298.386 2.911 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CCOc1ncccc1F)CC2 ZINC000296763463 381531812 /nfs/dbraw/zinc/53/18/12/381531812.db2.gz KGKQELZGECWAFD-CYBMUJFWSA-N 0 3 288.322 2.582 20 10 CFCDHN CC1(C)[C@H]([NH2+][C@@H]2CCc3cccc([O-])c32)[C@H]2CCO[C@H]21 ZINC000297965887 381575385 /nfs/dbraw/zinc/57/53/85/381575385.db2.gz ZPCGFIWRJNUONS-CZPYZCIJSA-N 0 3 273.376 2.783 20 10 CFCDHN C[C@H]([NH2+]CCNC(=O)OC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185267433 381582492 /nfs/dbraw/zinc/58/24/92/381582492.db2.gz PULLHKYCHQZWIH-JTQLQIEISA-N 0 3 298.358 2.707 20 10 CFCDHN C[C@H](COCC(F)(F)F)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297710081 381570079 /nfs/dbraw/zinc/57/00/79/381570079.db2.gz MRWHBDKGNWFPRM-MWLCHTKSSA-N 0 3 289.297 2.937 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000371313474 381588753 /nfs/dbraw/zinc/58/87/53/381588753.db2.gz HQHZVPVFZNGSBH-UONOGXRCSA-N 0 3 291.391 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000371313474 381588759 /nfs/dbraw/zinc/58/87/59/381588759.db2.gz HQHZVPVFZNGSBH-UONOGXRCSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c1 ZINC000185368759 381612770 /nfs/dbraw/zinc/61/27/70/381612770.db2.gz URCWCPYHCQKPPN-NEPJUHHUSA-N 0 3 278.396 2.534 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)Cc2ccccc2)c([O-])c1 ZINC000185370553 381615205 /nfs/dbraw/zinc/61/52/05/381615205.db2.gz XPGYNTNBHNHVDZ-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(F)ccc1[O-] ZINC000185460538 381638891 /nfs/dbraw/zinc/63/88/91/381638891.db2.gz ZIKSJXAFJNMVGD-FUPATZSFSA-N 0 3 251.301 2.502 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC[S@@](=O)C(C)(C)C)c1 ZINC000185475033 381644250 /nfs/dbraw/zinc/64/42/50/381644250.db2.gz JZKICPYQGQAUOA-BIBXISHDSA-N 0 3 299.436 2.599 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCCC(C)(C)CO)c1 ZINC000185537354 381659826 /nfs/dbraw/zinc/65/98/26/381659826.db2.gz PNAMLWVENNVIBV-GFCCVEGCSA-N 0 3 281.396 2.850 20 10 CFCDHN CN1CC[C@H]2CC[N@H+](Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909369 381673066 /nfs/dbraw/zinc/67/30/66/381673066.db2.gz YXXNKVGQUCWZQB-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN CN1CC[C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909369 381673071 /nfs/dbraw/zinc/67/30/71/381673071.db2.gz YXXNKVGQUCWZQB-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909369 381673076 /nfs/dbraw/zinc/67/30/76/381673076.db2.gz YXXNKVGQUCWZQB-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CCN(Cc3cc(Cl)ccc3[O-])[C@@H]2C1 ZINC000359909369 381673080 /nfs/dbraw/zinc/67/30/80/381673080.db2.gz YXXNKVGQUCWZQB-SMDDNHRTSA-N 0 3 280.799 2.572 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)CO[C@@H]2CCOC2)c([O-])c1 ZINC000185673750 381701129 /nfs/dbraw/zinc/70/11/29/381701129.db2.gz NGKKNCKVCXHJKE-BFHYXJOUSA-N 0 3 279.380 2.545 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC(=O)N(C(C)(C)C)C2)c([O-])c1 ZINC000186086323 381821849 /nfs/dbraw/zinc/82/18/49/381821849.db2.gz QOKMWOYDTCQNOU-STQMWFEESA-N 0 3 290.407 2.751 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H]2CCc3n[nH]cc3C2)c1 ZINC000186114986 381826694 /nfs/dbraw/zinc/82/66/94/381826694.db2.gz WIGPCWXEPXEZLR-YPMHNXCESA-N 0 3 271.364 2.632 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](CO)CC(C)(C)C)c1 ZINC000186143508 381833409 /nfs/dbraw/zinc/83/34/09/381833409.db2.gz ROADPXQPXUMCJD-VXGBXAGGSA-N 0 3 281.396 2.849 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C1CC1 ZINC000186154219 381837516 /nfs/dbraw/zinc/83/75/16/381837516.db2.gz CZDHXJRDQBPGEA-RNCFNFMXSA-N 0 3 253.317 2.607 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1ccccc1[O-] ZINC000186249121 381863496 /nfs/dbraw/zinc/86/34/96/381863496.db2.gz DNYSVXHDJWXOTG-VNHYZAJKSA-N 0 3 263.381 2.984 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000186354265 381889110 /nfs/dbraw/zinc/88/91/10/381889110.db2.gz LDNVHCNYWPVMQZ-GFCCVEGCSA-N 0 3 278.396 2.514 20 10 CFCDHN C/C=C/C[C@@H](CO)[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000186531239 381939566 /nfs/dbraw/zinc/93/95/66/381939566.db2.gz DCXATLDSTZFJBU-OOPCZODUSA-N 0 3 269.772 2.771 20 10 CFCDHN C[C@@H](C[S@@](C)=O)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000186540724 381941373 /nfs/dbraw/zinc/94/13/73/381941373.db2.gz CBFBCQGSPAZHES-JOOBJXAISA-N 0 3 295.448 2.689 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1[O-] ZINC000373368142 381988535 /nfs/dbraw/zinc/98/85/35/381988535.db2.gz DEPFWBUKYBGGIE-IRXDYDNUSA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1[O-] ZINC000373368143 381989384 /nfs/dbraw/zinc/98/93/84/381989384.db2.gz DEPFWBUKYBGGIE-SJORKVTESA-N 0 3 275.392 2.995 20 10 CFCDHN CC(C)OCCN1CC=C(c2ccc(N(C)C)cc2)C1 ZINC000374782568 382056479 /nfs/dbraw/zinc/05/64/79/382056479.db2.gz PMFBTWMKEZYOLE-UHFFFAOYSA-N 0 3 274.408 2.877 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCCCCS(C)(=O)=O)c1 ZINC000186862182 382032356 /nfs/dbraw/zinc/03/23/56/382032356.db2.gz NTASVDDYYOLELM-ZDUSSCGKSA-N 0 3 299.436 2.566 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCC[C@]3(CCCCO3)C2)c1 ZINC000376109901 382120022 /nfs/dbraw/zinc/12/00/22/382120022.db2.gz GCRGMNJCMZEGKU-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCC[C@]3(CCCCO3)C2)c1 ZINC000376109901 382120026 /nfs/dbraw/zinc/12/00/26/382120026.db2.gz GCRGMNJCMZEGKU-QGZVFWFLSA-N 0 3 291.391 2.936 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC3(CC2)OCCCO3)cc1C ZINC000293564319 382177057 /nfs/dbraw/zinc/17/70/57/382177057.db2.gz GKGDZJUWRFQEFK-UHFFFAOYSA-N 0 3 291.391 2.738 20 10 CFCDHN COC[C@@H]1CC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000293587294 382185998 /nfs/dbraw/zinc/18/59/98/382185998.db2.gz IEMCKHQHFINRTQ-ZDUSSCGKSA-N 0 3 257.333 2.766 20 10 CFCDHN COC[C@@H]1CC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000293587294 382186000 /nfs/dbraw/zinc/18/60/00/382186000.db2.gz IEMCKHQHFINRTQ-ZDUSSCGKSA-N 0 3 257.333 2.766 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@]2(O)CCCC2(C)C)c1[O-] ZINC000293524500 382158532 /nfs/dbraw/zinc/15/85/32/382158532.db2.gz BHRVJBGWVRUODW-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN COc1cccc(CN[C@@H]2C[C@@H](CO)c3ccccc32)c1O ZINC000376958360 382196288 /nfs/dbraw/zinc/19/62/88/382196288.db2.gz PKIYFTVEPNGFAN-XJKSGUPXSA-N 0 3 299.370 2.711 20 10 CFCDHN CS[C@H](CO)[C@@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293666030 382222454 /nfs/dbraw/zinc/22/24/54/382222454.db2.gz JLOTYRNRURMSLG-MBNYWOFBSA-N 0 3 283.437 2.772 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2(O)Cc3ccccc3C2)c1 ZINC000363862463 382249444 /nfs/dbraw/zinc/24/94/44/382249444.db2.gz JDIGKEJEBXYWOG-CQSZACIVSA-N 0 3 297.398 2.881 20 10 CFCDHN CN(C)c1ccc(CN[C@H]2CCOC2(C)C)cc1F ZINC000293748441 382263227 /nfs/dbraw/zinc/26/32/27/382263227.db2.gz OAPNITMYPBPEEF-AWEZNQCLSA-N 0 3 266.360 2.549 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCOC[C@H]1C1CC1 ZINC000377619036 382303435 /nfs/dbraw/zinc/30/34/35/382303435.db2.gz DFASUKQXYLZQSE-GJZGRUSLSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCOC[C@H]1C1CC1 ZINC000377619036 382303438 /nfs/dbraw/zinc/30/34/38/382303438.db2.gz DFASUKQXYLZQSE-GJZGRUSLSA-N 0 3 261.365 2.954 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C2CC(c3ccccn3)C2)c1 ZINC000377645168 382310967 /nfs/dbraw/zinc/31/09/67/382310967.db2.gz HXTIZDFHMAFWQG-UHFFFAOYSA-N 0 3 284.359 2.832 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000364637109 382345267 /nfs/dbraw/zinc/34/52/67/382345267.db2.gz NYQMFFMYEVKOPR-MJBXVCDLSA-N 0 3 291.391 2.820 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000364637109 382345276 /nfs/dbraw/zinc/34/52/76/382345276.db2.gz NYQMFFMYEVKOPR-MJBXVCDLSA-N 0 3 291.391 2.820 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000377755929 382336620 /nfs/dbraw/zinc/33/66/20/382336620.db2.gz MBIAXMHPXJATKN-ONGXEEELSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1cc(Cl)ccc1[O-] ZINC000377755929 382336621 /nfs/dbraw/zinc/33/66/21/382336621.db2.gz MBIAXMHPXJATKN-ONGXEEELSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000377755928 382337454 /nfs/dbraw/zinc/33/74/54/382337454.db2.gz MBIAXMHPXJATKN-MWLCHTKSSA-N 0 3 291.782 2.977 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1cc(Cl)ccc1[O-] ZINC000377755928 382337461 /nfs/dbraw/zinc/33/74/61/382337461.db2.gz MBIAXMHPXJATKN-MWLCHTKSSA-N 0 3 291.782 2.977 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c([O-])c1 ZINC000377803451 382350144 /nfs/dbraw/zinc/35/01/44/382350144.db2.gz WQOYQHFOEHOAGA-NEPJUHHUSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3[nH]cnc3C2)c([O-])c1 ZINC000377803451 382350150 /nfs/dbraw/zinc/35/01/50/382350150.db2.gz WQOYQHFOEHOAGA-NEPJUHHUSA-N 0 3 271.364 2.632 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000378495457 382472761 /nfs/dbraw/zinc/47/27/61/382472761.db2.gz MFDMDQZVEKWGQE-UHFFFAOYSA-N 0 3 268.360 2.844 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000378495457 382472766 /nfs/dbraw/zinc/47/27/66/382472766.db2.gz MFDMDQZVEKWGQE-UHFFFAOYSA-N 0 3 268.360 2.844 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@](C)(COC)C2)c1[O-] ZINC000294243331 382474556 /nfs/dbraw/zinc/47/45/56/382474556.db2.gz PJATZHTZRCCIGT-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@](C)(COC)C2)c1[O-] ZINC000294243331 382474565 /nfs/dbraw/zinc/47/45/65/382474565.db2.gz PJATZHTZRCCIGT-INIZCTEOSA-N 0 3 279.380 2.649 20 10 CFCDHN C[N@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000378499019 382474788 /nfs/dbraw/zinc/47/47/88/382474788.db2.gz SSJXITOTUNJKOL-NWANDNLSSA-N 0 3 279.355 2.777 20 10 CFCDHN C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000378499019 382474792 /nfs/dbraw/zinc/47/47/92/382474792.db2.gz SSJXITOTUNJKOL-NWANDNLSSA-N 0 3 279.355 2.777 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@](C)(COC)C2)c1[O-] ZINC000294243338 382474942 /nfs/dbraw/zinc/47/49/42/382474942.db2.gz PJATZHTZRCCIGT-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@](C)(COC)C2)c1[O-] ZINC000294243338 382474946 /nfs/dbraw/zinc/47/49/46/382474946.db2.gz PJATZHTZRCCIGT-MRXNPFEDSA-N 0 3 279.380 2.649 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1cc(C)ccc1[O-])OC ZINC000294298431 382499691 /nfs/dbraw/zinc/49/96/91/382499691.db2.gz UUNMBFVFTFMAFL-SWLSCSKDSA-N 0 3 251.370 2.851 20 10 CFCDHN Cn1cc2c(n1)CCC[C@@H]2NCc1ccc2c(c1)CCN2C ZINC000366436585 382509763 /nfs/dbraw/zinc/50/97/63/382509763.db2.gz ZFEXQUCGDQPJJJ-INIZCTEOSA-N 0 3 296.418 2.580 20 10 CFCDHN CCN1CCC[N@H+](Cc2c([O-])ccc3ccccc32)CC1=O ZINC000189217969 382568114 /nfs/dbraw/zinc/56/81/14/382568114.db2.gz XMKHRYGDTDGOGI-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CCN1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)CC1=O ZINC000189217969 382568116 /nfs/dbraw/zinc/56/81/16/382568116.db2.gz XMKHRYGDTDGOGI-UHFFFAOYSA-N 0 3 298.386 2.600 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000295234521 382595458 /nfs/dbraw/zinc/59/54/58/382595458.db2.gz OHNZHTCVBNRCNS-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c1[O-] ZINC000295234521 382595463 /nfs/dbraw/zinc/59/54/63/382595463.db2.gz OHNZHTCVBNRCNS-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCSCC[C@@H]2C)cc1OC ZINC000189920987 382645455 /nfs/dbraw/zinc/64/54/55/382645455.db2.gz HWRWQFIFARVFDL-NSHDSACASA-N 0 3 297.420 2.737 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCSCC[C@@H]2C)cc1OC ZINC000189920987 382645456 /nfs/dbraw/zinc/64/54/56/382645456.db2.gz HWRWQFIFARVFDL-NSHDSACASA-N 0 3 297.420 2.737 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)cc1C ZINC000247291010 383159987 /nfs/dbraw/zinc/15/99/87/383159987.db2.gz UENIJDGBTLFBSU-GDBMZVCRSA-N 0 3 293.432 2.715 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCS[C@@H]3COCC[C@H]32)cc1C ZINC000247291010 383159992 /nfs/dbraw/zinc/15/99/92/383159992.db2.gz UENIJDGBTLFBSU-GDBMZVCRSA-N 0 3 293.432 2.715 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H]2OCCC[C@@H]12)c1cc(F)ccc1[O-] ZINC000251848010 383397270 /nfs/dbraw/zinc/39/72/70/383397270.db2.gz NGRDPKOUTBNGJO-GVAXYQGFSA-N 0 3 265.328 2.749 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCCO[C@@H](CC)C2)c1[O-] ZINC000281164725 385184052 /nfs/dbraw/zinc/18/40/52/385184052.db2.gz GJSDFSQDIPHJNY-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCCO[C@@H](CC)C2)c1[O-] ZINC000281164725 385184061 /nfs/dbraw/zinc/18/40/61/385184061.db2.gz GJSDFSQDIPHJNY-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@H]2CCC(F)(F)C2)c1 ZINC000281278052 385189332 /nfs/dbraw/zinc/18/93/32/385189332.db2.gz ZAZPQTOOENBZCP-SNVBAGLBSA-N 0 3 271.307 2.926 20 10 CFCDHN CCCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)CCOCC ZINC000282463675 385317539 /nfs/dbraw/zinc/31/75/39/385317539.db2.gz NCLSNTJRFWCAQD-INIZCTEOSA-N 0 3 295.423 2.782 20 10 CFCDHN CCCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)CCOCC ZINC000282463675 385317542 /nfs/dbraw/zinc/31/75/42/385317542.db2.gz NCLSNTJRFWCAQD-INIZCTEOSA-N 0 3 295.423 2.782 20 10 CFCDHN CO[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000271170345 385360893 /nfs/dbraw/zinc/36/08/93/385360893.db2.gz HJMNJCVOGKNVAK-KRWDZBQOSA-N 0 3 274.408 2.898 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000271775268 385391658 /nfs/dbraw/zinc/39/16/58/385391658.db2.gz CLJYLCMZGGHAAE-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN CC[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1O ZINC000271820787 385393957 /nfs/dbraw/zinc/39/39/57/385393957.db2.gz KNTNFKXMMTVCNA-GXFFZTMASA-N 0 3 269.772 2.557 20 10 CFCDHN CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1O ZINC000271820787 385393961 /nfs/dbraw/zinc/39/39/61/385393961.db2.gz KNTNFKXMMTVCNA-GXFFZTMASA-N 0 3 269.772 2.557 20 10 CFCDHN CCOc1cccc(C[NH2+]C(CC)(CC)CCO)c1[O-] ZINC000282996696 385421614 /nfs/dbraw/zinc/42/16/14/385421614.db2.gz NLPOLJKQIPBNMF-UHFFFAOYSA-N 0 3 281.396 2.822 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000272243427 385486005 /nfs/dbraw/zinc/48/60/05/385486005.db2.gz GYIUFXVNGLDEJF-NSHDSACASA-N 0 3 275.327 2.634 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000272243427 385486007 /nfs/dbraw/zinc/48/60/07/385486007.db2.gz GYIUFXVNGLDEJF-NSHDSACASA-N 0 3 275.327 2.634 20 10 CFCDHN CCC[N@H+](CCc1ccnn1C)Cc1ccccc1[O-] ZINC000284429034 385548543 /nfs/dbraw/zinc/54/85/43/385548543.db2.gz PDTARPZGZILMRZ-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN CCC[N@@H+](CCc1ccnn1C)Cc1ccccc1[O-] ZINC000284429034 385548548 /nfs/dbraw/zinc/54/85/48/385548548.db2.gz PDTARPZGZILMRZ-UHFFFAOYSA-N 0 3 273.380 2.580 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c1 ZINC000284128867 385538314 /nfs/dbraw/zinc/53/83/14/385538314.db2.gz CUIIYILSWRCCRB-HEHGZKQESA-N 0 3 295.423 2.509 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC2(O)CCC2)c([O-])c1C ZINC000284386799 385549209 /nfs/dbraw/zinc/54/92/09/385549209.db2.gz OVVTWOMMXXPMMN-CYBMUJFWSA-N 0 3 263.381 2.965 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCC2(O)CCC2)c1[O-] ZINC000285082532 385551599 /nfs/dbraw/zinc/55/15/99/385551599.db2.gz MLBPROXXCUMOGD-UHFFFAOYSA-N 0 3 269.772 2.749 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](O)C(C)C)c([O-])c1 ZINC000285248831 385554383 /nfs/dbraw/zinc/55/43/83/385554383.db2.gz PWRVNIMNMIGZHI-OCCSQVGLSA-N 0 3 251.370 2.677 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000272813199 385623368 /nfs/dbraw/zinc/62/33/68/385623368.db2.gz DKOWJWSVVIRFLP-NHYWBVRUSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CN(C2CC2)C[C@H]1C)c1ccccc1[O-] ZINC000272824584 385624602 /nfs/dbraw/zinc/62/46/02/385624602.db2.gz GLEKJVDOQWZJSL-TYNCELHUSA-N 0 3 260.381 2.526 20 10 CFCDHN C[C@@]1([NH2+]Cc2cc(F)ccc2[O-])CCO[C@@H]1C1CC1 ZINC000273241079 385674887 /nfs/dbraw/zinc/67/48/87/385674887.db2.gz YTARCRYOKVVFKE-HUUCEWRRSA-N 0 3 265.328 2.579 20 10 CFCDHN COC(=O)N1CCC([NH2+][C@@H](C)c2cc(C)ccc2[O-])CC1 ZINC000273296540 385675649 /nfs/dbraw/zinc/67/56/49/385675649.db2.gz AGCCUUWTUJEDBO-LBPRGKRZSA-N 0 3 292.379 2.582 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@@H]2CCCc3c[nH]nc32)c1 ZINC000273343651 385677206 /nfs/dbraw/zinc/67/72/06/385677206.db2.gz ACJWRETWIDWYTQ-IINYFYTJSA-N 0 3 287.363 2.852 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@H]2CCCc3c[nH]nc32)c1 ZINC000273343653 385677312 /nfs/dbraw/zinc/67/73/12/385677312.db2.gz ACJWRETWIDWYTQ-YGRLFVJLSA-N 0 3 287.363 2.852 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1C ZINC000273306118 385677647 /nfs/dbraw/zinc/67/76/47/385677647.db2.gz CWUBEXZBBXBXBP-ZDUSSCGKSA-N 0 3 298.386 2.959 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCOc2ncccc2F)c1 ZINC000273452906 385685313 /nfs/dbraw/zinc/68/53/13/385685313.db2.gz GNVZGWJILHKHCR-LBPRGKRZSA-N 0 3 290.338 2.964 20 10 CFCDHN C[C@H](C[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2)N(C)C ZINC000273568668 385689045 /nfs/dbraw/zinc/68/90/45/385689045.db2.gz KDUSNTFEQWBCEO-CHWSQXEVSA-N 0 3 276.424 2.872 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@]2(N(C)C)CCSC2)c1 ZINC000273585276 385689981 /nfs/dbraw/zinc/68/99/81/385689981.db2.gz NSLMSSMIUBFAOH-XJKSGUPXSA-N 0 3 294.464 2.789 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@H](C)c2cc(C)ccc2[O-])o1 ZINC000273612086 385691810 /nfs/dbraw/zinc/69/18/10/385691810.db2.gz WFIUXZBNHPXIKH-IUODEOHRSA-N 0 3 275.348 2.986 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1c3ccccc3C[C@@H]1O)CC2 ZINC000296225337 285397664 /nfs/dbraw/zinc/39/76/64/285397664.db2.gz AHEAWXPBPQQZEN-HFTRVMKXSA-N 0 3 281.355 2.627 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CCCN1CCCCC1)CC2 ZINC000296086537 285396755 /nfs/dbraw/zinc/39/67/55/285396755.db2.gz SVUDZGGBWKRDTP-HNNXBMFYSA-N 0 3 274.408 2.845 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1[O-] ZINC000372470886 393449244 /nfs/dbraw/zinc/44/92/44/393449244.db2.gz GVEUYLRVLYDEAJ-KMFMINBZSA-N 0 3 291.391 2.771 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(OC)cc2[O-])C12CCC2 ZINC000372635872 393453953 /nfs/dbraw/zinc/45/39/53/393453953.db2.gz NVWDAOZXXPBVIX-JKSUJKDBSA-N 0 3 291.391 2.838 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1[O-] ZINC000374156485 393486241 /nfs/dbraw/zinc/48/62/41/393486241.db2.gz GLHCNNPVXFTHRB-WQVCFCJDSA-N 0 3 291.391 2.694 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@@H]([NH+]2CCCCC2)C1 ZINC000374893054 393503226 /nfs/dbraw/zinc/50/32/26/393503226.db2.gz IZCDVEWNZMJBSU-MRXNPFEDSA-N 0 3 292.398 2.982 20 10 CFCDHN CCSCC[C@H](C)[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000135292587 394216596 /nfs/dbraw/zinc/21/65/96/394216596.db2.gz ZUOLZPAWZUOCGF-JTQLQIEISA-N 0 3 283.393 2.742 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](C)CC(C)(C)O)c1 ZINC000296325692 394308103 /nfs/dbraw/zinc/30/81/03/394308103.db2.gz HARRCMAETKWENX-VXGBXAGGSA-N 0 3 251.370 2.901 20 10 CFCDHN CCOC(CC[NH2+][C@@H]1CCc2cccc([O-])c21)OCC ZINC000296454518 394309319 /nfs/dbraw/zinc/30/93/19/394309319.db2.gz NKORTMKQBGEBND-CYBMUJFWSA-N 0 3 279.380 2.758 20 10 CFCDHN CCOc1cccc(CNCc2cccnc2C)c1O ZINC000527792707 394407553 /nfs/dbraw/zinc/40/75/53/394407553.db2.gz VDFSQVSXXFOSTG-UHFFFAOYSA-N 0 3 272.348 2.784 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C1CCC3(CC1)OCCO3)CC2 ZINC000295957468 296592909 /nfs/dbraw/zinc/59/29/09/296592909.db2.gz LXISNRIRZIQJDK-CQSZACIVSA-N 0 3 289.375 2.655 20 10 CFCDHN C[C@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1ccccc1[O-] ZINC000020122209 171002956 /nfs/dbraw/zinc/00/29/56/171002956.db2.gz JTMWZKOOIZQYFU-GXTWGEPZSA-N 0 3 274.364 2.939 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)N(C)C)c1ccccc1[O-] ZINC000020125856 171009853 /nfs/dbraw/zinc/00/98/53/171009853.db2.gz JFYBPMGGNUPLDK-CYBMUJFWSA-N 0 3 250.386 2.773 20 10 CFCDHN CN(C)c1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000020146025 171031872 /nfs/dbraw/zinc/03/18/72/171031872.db2.gz ITRWGJPBQHVWIG-UHFFFAOYSA-N 0 3 256.349 2.748 20 10 CFCDHN CN(C)[C@H](C[NH2+]Cc1ccccc1[O-])c1cccs1 ZINC000020147583 171034270 /nfs/dbraw/zinc/03/42/70/171034270.db2.gz NHRKAGAPLAWFHC-CYBMUJFWSA-N 0 3 276.405 2.846 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]C2CCN(C(C)C)CC2)c1 ZINC000020189210 171054797 /nfs/dbraw/zinc/05/47/97/171054797.db2.gz GUYQEDYAIWXPDU-CYBMUJFWSA-N 0 3 292.423 2.924 20 10 CFCDHN CCN1CCC([NH2+][C@H](C)c2ccc(C)cc2[O-])CC1 ZINC000038098000 174111783 /nfs/dbraw/zinc/11/17/83/174111783.db2.gz YQADXACJZKINMF-CYBMUJFWSA-N 0 3 262.397 2.836 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCN2CCC[C@@H]2C1 ZINC000211615921 260021217 /nfs/dbraw/zinc/02/12/17/260021217.db2.gz SKQFNTHLHKWLDC-UKRRQHHQSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCN2CCC[C@@H]2C1 ZINC000211615921 260021218 /nfs/dbraw/zinc/02/12/18/260021218.db2.gz SKQFNTHLHKWLDC-UKRRQHHQSA-N 0 3 260.381 2.623 20 10 CFCDHN COc1ccc(O)c([C@H](C)N[C@H](C)c2cnn(C)c2C)c1 ZINC000037167669 260073037 /nfs/dbraw/zinc/07/30/37/260073037.db2.gz PPWOROGTYFTYLO-WDEREUQCSA-N 0 3 289.379 2.855 20 10 CFCDHN CCOc1cccc(CN2CCOCC3(CCC3)C2)c1O ZINC000363927202 262038142 /nfs/dbraw/zinc/03/81/42/262038142.db2.gz OCNMKRZQASZMDT-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1ccc(O)c(CN2CC(C)(C)O[C@@H]3CCC[C@H]32)c1 ZINC000367255959 266259591 /nfs/dbraw/zinc/25/95/91/266259591.db2.gz ZLRGVMBQADGBEY-GDBMZVCRSA-N 0 3 291.391 2.933 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@](F)(CO)C1 ZINC000367691080 267109419 /nfs/dbraw/zinc/10/94/19/267109419.db2.gz ZYLGXLVHOLPIGX-ZFWWWQNUSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@](F)(CO)C1 ZINC000367691080 267109422 /nfs/dbraw/zinc/10/94/22/267109422.db2.gz ZYLGXLVHOLPIGX-ZFWWWQNUSA-N 0 3 267.344 2.640 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@H]2OCC[C@H]2C1 ZINC000368043793 267141269 /nfs/dbraw/zinc/14/12/69/267141269.db2.gz XUECAHHRBYUUFG-JGGQBBKZSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@H]2OCC[C@H]2C1 ZINC000368043793 267141271 /nfs/dbraw/zinc/14/12/71/267141271.db2.gz XUECAHHRBYUUFG-JGGQBBKZSA-N 0 3 261.365 2.954 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000368667201 267196170 /nfs/dbraw/zinc/19/61/70/267196170.db2.gz QDGXCLZSISPYTE-GUYCJALGSA-N 0 3 293.407 2.802 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@](CO)(C(C)C)C2)c1 ZINC000368667201 267196171 /nfs/dbraw/zinc/19/61/71/267196171.db2.gz QDGXCLZSISPYTE-GUYCJALGSA-N 0 3 293.407 2.802 20 10 CFCDHN Cc1cc([O-])c(C[NH+]2CCC3(CCOC3=O)CC2)cc1C ZINC000370068285 267288016 /nfs/dbraw/zinc/28/80/16/267288016.db2.gz WOBJOFXMKRBZBE-UHFFFAOYSA-N 0 3 289.375 2.538 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c([O-])c1 ZINC000370394569 267315553 /nfs/dbraw/zinc/31/55/53/267315553.db2.gz FRPBQFCZYBQJPT-DGCLKSJQSA-N 0 3 271.364 2.632 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C1CCN(C3CC3)CC1)CC2 ZINC000295996563 275061750 /nfs/dbraw/zinc/06/17/50/275061750.db2.gz OADKQBCFTDOPNP-HNNXBMFYSA-N 0 3 272.392 2.596 20 10 CFCDHN CC[C@H](CO)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000184841595 287876797 /nfs/dbraw/zinc/87/67/97/287876797.db2.gz ZEQRCKWNBMNDLP-SMDDNHRTSA-N 0 3 263.381 2.693 20 10 CFCDHN CC[C@@H](C[NH2+][C@H](C)c1ccccc1[O-])N1CCCC1 ZINC000183410404 276526218 /nfs/dbraw/zinc/52/62/18/276526218.db2.gz BAHJXRKDCQAERW-KGLIPLIRSA-N 0 3 262.397 2.917 20 10 CFCDHN COC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1[O-])[C@@H]1CCCO1 ZINC000278832455 277263012 /nfs/dbraw/zinc/26/30/12/277263012.db2.gz OZYRPUQIZVHFAB-BPUTZDHNSA-N 0 3 293.407 2.854 20 10 CFCDHN CO[C@@H](C)CNCc1ccc(N(C)C)cc1C(F)(F)F ZINC000280468645 277276710 /nfs/dbraw/zinc/27/67/10/277276710.db2.gz CJXAZEVSASEBJH-JTQLQIEISA-N 0 3 290.329 2.896 20 10 CFCDHN CC[C@H]([NH2+]CC1([S@@](C)=O)CCC1)c1ccccc1[O-] ZINC000280959986 288038070 /nfs/dbraw/zinc/03/80/70/288038070.db2.gz HOCLGIWFYKJNAV-ORAYPTAESA-N 0 3 281.421 2.734 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCOC(C)(C)C1)c1ccccc1[O-] ZINC000186176255 288041659 /nfs/dbraw/zinc/04/16/59/288041659.db2.gz JYIRPVLDADCCAA-HNNXBMFYSA-N 0 3 292.423 2.544 20 10 CFCDHN Cn1cc2c(n1)CCC[C@@H]2[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296470100 279353863 /nfs/dbraw/zinc/35/38/63/279353863.db2.gz OJHCHLYFXLLAHQ-DZGCQCFKSA-N 0 3 283.375 2.780 20 10 CFCDHN Cc1cccc(C[N@H+](CCC(N)=O)Cc2ccccc2)c1[O-] ZINC000179629626 281215562 /nfs/dbraw/zinc/21/55/62/281215562.db2.gz MOOZCDXUCFTDIR-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN Cc1cccc(C[N@@H+](CCC(N)=O)Cc2ccccc2)c1[O-] ZINC000179629626 281215563 /nfs/dbraw/zinc/21/55/63/281215563.db2.gz MOOZCDXUCFTDIR-UHFFFAOYSA-N 0 3 298.386 2.578 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CC2(N(C)C)CCCC2)c1 ZINC000160672093 295168518 /nfs/dbraw/zinc/16/85/18/295168518.db2.gz VTYXOTCZMBZKHH-ZDUSSCGKSA-N 0 3 292.423 2.926 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000375260501 329002084 /nfs/dbraw/zinc/00/20/84/329002084.db2.gz OECTZHGBLJJMOV-OGHNNQOOSA-N 0 3 291.391 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC000375260501 329002085 /nfs/dbraw/zinc/00/20/85/329002085.db2.gz OECTZHGBLJJMOV-OGHNNQOOSA-N 0 3 291.391 2.963 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC000375257248 329002093 /nfs/dbraw/zinc/00/20/93/329002093.db2.gz XMPGUESRNJHAKX-PRCBLGNRSA-N 0 3 291.391 2.555 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC000375257248 329002094 /nfs/dbraw/zinc/00/20/94/329002094.db2.gz XMPGUESRNJHAKX-PRCBLGNRSA-N 0 3 291.391 2.555 20 10 CFCDHN COc1cccc([C@@H](C[NH2+]Cc2ccccc2[O-])OC)c1 ZINC000527737045 330278858 /nfs/dbraw/zinc/27/88/58/330278858.db2.gz MAHFOQCJGCDNIU-QGZVFWFLSA-N 0 3 287.359 2.878 20 10 CFCDHN CC(C)O[C@@]1(C)C[C@H]1NCc1ccc2c(c1)CCO2 ZINC000527799697 330284077 /nfs/dbraw/zinc/28/40/77/330284077.db2.gz MFJMLDZZWAMVRC-CVEARBPZSA-N 0 3 261.365 2.667 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]CC[C@@H]1CCCOC1)CC2 ZINC000527927042 330296719 /nfs/dbraw/zinc/29/67/19/330296719.db2.gz QRNDUDIBORPFEP-GXTWGEPZSA-N 0 3 261.365 2.786 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)CC2 ZINC000527998417 330299783 /nfs/dbraw/zinc/29/97/83/330299783.db2.gz CTUIXGQTCZGIKZ-HZPDHXFCSA-N 0 3 286.419 2.986 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)CC2 ZINC000527998416 330299795 /nfs/dbraw/zinc/29/97/95/330299795.db2.gz CTUIXGQTCZGIKZ-HOTGVXAUSA-N 0 3 286.419 2.986 20 10 CFCDHN CC(C)O[C@@]1(C)C[C@H]1[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000528004286 330300310 /nfs/dbraw/zinc/30/03/10/330300310.db2.gz DREIDUYDOHAJOW-XPKDYRNWSA-N 0 3 261.365 2.925 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000529667913 333504773 /nfs/dbraw/zinc/50/47/73/333504773.db2.gz BNCCZKFKUDNPPE-OAHLLOKOSA-N 0 3 278.371 2.638 20 10 CFCDHN CCC[N@H+](CCCN(C)C)Cc1cccc(C)c1[O-] ZINC000290421451 521653374 /nfs/dbraw/zinc/65/33/74/521653374.db2.gz KRUGWKJGGMJISW-UHFFFAOYSA-N 0 3 264.413 2.864 20 10 CFCDHN CCC[N@@H+](CCCN(C)C)Cc1cccc(C)c1[O-] ZINC000290421451 521653376 /nfs/dbraw/zinc/65/33/76/521653376.db2.gz KRUGWKJGGMJISW-UHFFFAOYSA-N 0 3 264.413 2.864 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CC2(C)C)c1[O-] ZINC000228671912 522539736 /nfs/dbraw/zinc/53/97/36/522539736.db2.gz DDIQBWGNKYEFCC-LLVKDONJSA-N 0 3 255.745 2.942 20 10 CFCDHN C=Cn1cc(CNCc2ccc3c(c2)CCCN3C)cn1 ZINC000194273970 519324026 /nfs/dbraw/zinc/32/40/26/519324026.db2.gz SQUZHBBFXJCCKO-UHFFFAOYSA-N 0 3 282.391 2.656 20 10 CFCDHN CC(C)(O)C[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000264769288 519361783 /nfs/dbraw/zinc/36/17/83/519361783.db2.gz QTRSSWRDLHAAGZ-UHFFFAOYSA-N 0 3 271.360 2.920 20 10 CFCDHN CC(C)N(CC[NH2+]Cc1cc(F)ccc1[O-])C(C)C ZINC000226581906 519648039 /nfs/dbraw/zinc/64/80/39/519648039.db2.gz KTYRPZFOKLAUHJ-UHFFFAOYSA-N 0 3 268.376 2.740 20 10 CFCDHN CC(C)[C@H](O)C[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000185463502 519823755 /nfs/dbraw/zinc/82/37/55/519823755.db2.gz KGTKXCLBZOFQKW-YVEFUNNKSA-N 0 3 277.408 2.939 20 10 CFCDHN CCN(CC)c1ccc(CNCc2cnn(C)c2C)cc1 ZINC000229804421 520908071 /nfs/dbraw/zinc/90/80/71/520908071.db2.gz WVLCHGRBAVJIKN-UHFFFAOYSA-N 0 3 286.423 2.865 20 10 CFCDHN CCC[C@H](CCO)C[NH2+]Cc1cc(C)ccc1[O-] ZINC000080524202 521095007 /nfs/dbraw/zinc/09/50/07/521095007.db2.gz PVKCLYFYNDWWRW-CYBMUJFWSA-N 0 3 251.370 2.589 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]C[C@@H](C)N(CC)CC)c1 ZINC000236868007 521150467 /nfs/dbraw/zinc/15/04/67/521150467.db2.gz DBTHNBJJXRNZTF-CYBMUJFWSA-N 0 3 280.412 2.611 20 10 CFCDHN CCC[C@H](O)C[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000280048401 521191047 /nfs/dbraw/zinc/19/10/47/521191047.db2.gz JKKMQZSBDREXLT-GXTWGEPZSA-N 0 3 251.370 2.902 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CCCn2ccnc2)c1[O-] ZINC000290521643 521329207 /nfs/dbraw/zinc/32/92/07/521329207.db2.gz QALJMFOFXNXIAT-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CCCn2ccnc2)c1[O-] ZINC000290521643 521329218 /nfs/dbraw/zinc/32/92/18/521329218.db2.gz QALJMFOFXNXIAT-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1cccc(C[NH2+]C2CC(F)(F)C2)c1[O-] ZINC000277774317 521358602 /nfs/dbraw/zinc/35/86/02/521358602.db2.gz YJBKANUYHWJENB-UHFFFAOYSA-N 0 3 257.280 2.678 20 10 CFCDHN CCOc1cccc(C[NH2+]CCN2CCC(C)CC2)c1[O-] ZINC000040771348 521363007 /nfs/dbraw/zinc/36/30/07/521363007.db2.gz MUWVJELFUHEITL-UHFFFAOYSA-N 0 3 292.423 2.612 20 10 CFCDHN CCOc1cccc(C[NH2+][C@@H](C)CN2CCCCC2)c1[O-] ZINC000037154025 521368644 /nfs/dbraw/zinc/36/86/44/521368644.db2.gz FWMBIHAEEQWETB-AWEZNQCLSA-N 0 3 292.423 2.755 20 10 CFCDHN CCOC(C)(C)C[NH2+]Cc1cc(Cl)cc(OC)c1[O-] ZINC000159230876 521625957 /nfs/dbraw/zinc/62/59/57/521625957.db2.gz APSBAYVVYUBGOD-UHFFFAOYSA-N 0 3 287.787 2.959 20 10 CFCDHN CC[C@H](C)[C@H](O)C[NH2+][C@@H](CC)c1ccccc1[O-] ZINC000155807666 521998542 /nfs/dbraw/zinc/99/85/42/521998542.db2.gz UEYUQJAPAOWACI-CORIIIEPSA-N 0 3 251.370 2.840 20 10 CFCDHN CN(C)c1ccc(CN[C@]2(C)CCO[C@@H]2C2CC2)cc1F ZINC000273044975 522214920 /nfs/dbraw/zinc/21/49/20/522214920.db2.gz BIOFSGWQARAFEM-IAGOWNOFSA-N 0 3 292.398 2.939 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC000279655606 522538350 /nfs/dbraw/zinc/53/83/50/522538350.db2.gz LDSGPBFQQMJVRP-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@](C)(O)CC2)c1[O-] ZINC000279655606 522538363 /nfs/dbraw/zinc/53/83/63/522538363.db2.gz LDSGPBFQQMJVRP-OAHLLOKOSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H](C)C2CC2)c1[O-] ZINC000228669837 522539507 /nfs/dbraw/zinc/53/95/07/522539507.db2.gz ZNTHFBIFJPNTET-QMMMGPOBSA-N 0 3 255.745 2.942 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H](C)OC)c1[O-] ZINC000291047540 522541582 /nfs/dbraw/zinc/54/15/82/522541582.db2.gz ZQJHOYAHWWVZKS-RKDXNWHRSA-N 0 3 273.760 2.567 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)CCO)c1ccc(C)cc1[O-] ZINC000279990637 522625672 /nfs/dbraw/zinc/62/56/72/522625672.db2.gz FINSVKJARQLLBI-OCCSQVGLSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@H]([NH2+]Cc1cnn(CC)c1)c1ccccc1[O-] ZINC000274920183 522667564 /nfs/dbraw/zinc/66/75/64/522667564.db2.gz OZFHGLNBFONEKJ-AWEZNQCLSA-N 0 3 259.353 2.850 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@@H]1CCCO1)c1ccccc1[O-] ZINC000278946035 522747106 /nfs/dbraw/zinc/74/71/06/522747106.db2.gz YUPFRDRZGYVUME-LZWOXQAQSA-N 0 3 279.380 2.627 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000159473652 522774986 /nfs/dbraw/zinc/77/49/86/522774986.db2.gz ZLGLDGLXOGHNAA-LLVKDONJSA-N 0 3 265.353 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCCC[C@H]2C)cc1OC ZINC000159473652 522774994 /nfs/dbraw/zinc/77/49/94/522774994.db2.gz ZLGLDGLXOGHNAA-LLVKDONJSA-N 0 3 265.353 2.784 20 10 CFCDHN CC[C@@H]([NH2+]CC1(O)Cc2ccccc2C1)c1ccccc1[O-] ZINC000363710443 522821493 /nfs/dbraw/zinc/82/14/93/522821493.db2.gz FJMLZEYQOSKTRS-QGZVFWFLSA-N 0 3 297.398 2.963 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)C1CCOCC1)c1ccc(C)cc1[O-] ZINC000280040327 522850032 /nfs/dbraw/zinc/85/00/32/522850032.db2.gz IUGADNPSAIUXSM-NVXWUHKLSA-N 0 3 293.407 2.529 20 10 CFCDHN COCC1(C[NH2+]Cc2cc(Cl)cc(OC)c2[O-])CCC1 ZINC000282250403 522900573 /nfs/dbraw/zinc/90/05/73/522900573.db2.gz CATXWUITQTUMCI-UHFFFAOYSA-N 0 3 299.798 2.961 20 10 CFCDHN CC[C@@H]([NH2+][C@H](CO)CC(C)C)c1ccccc1[O-] ZINC000040774183 522944299 /nfs/dbraw/zinc/94/42/99/522944299.db2.gz SJWADDJDPIMURU-GXTWGEPZSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@](C)(C(=O)OC)C1 ZINC000368795932 522953651 /nfs/dbraw/zinc/95/36/51/522953651.db2.gz HQCMNUNRXJJCAX-CZUORRHYSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@](C)(C(=O)OC)C1 ZINC000368795932 522953656 /nfs/dbraw/zinc/95/36/56/522953656.db2.gz HQCMNUNRXJJCAX-CZUORRHYSA-N 0 3 277.364 2.728 20 10 CFCDHN CC[C@@H](O)CC[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000280022394 522989433 /nfs/dbraw/zinc/98/94/33/522989433.db2.gz HNVVNDFVFFASLM-OCCSQVGLSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCS1 ZINC000160320566 523284869 /nfs/dbraw/zinc/28/48/69/523284869.db2.gz NIDCNEIHNTUFTM-LBPRGKRZSA-N 0 3 297.420 2.737 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)cc1F ZINC000264755137 523383352 /nfs/dbraw/zinc/38/33/52/523383352.db2.gz XOPMOAFUYZDXBW-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)c1ccc(F)cc1F ZINC000264755137 523383362 /nfs/dbraw/zinc/38/33/62/523383362.db2.gz XOPMOAFUYZDXBW-INIZCTEOSA-N 0 3 293.313 2.836 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+]Cc1cccc(C)c1[O-] ZINC000224698509 523921762 /nfs/dbraw/zinc/92/17/62/523921762.db2.gz CTGPKIWBKPWSPE-ZDUSSCGKSA-N 0 3 250.386 2.521 20 10 CFCDHN CN1Cc2ccccc2[C@@H]([NH2+]Cc2ccccc2[O-])C1 ZINC000361167216 524029717 /nfs/dbraw/zinc/02/97/17/524029717.db2.gz FJHMUKIAPBHHHX-INIZCTEOSA-N 0 3 268.360 2.669 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1OC ZINC000226582185 524072840 /nfs/dbraw/zinc/07/28/40/524072840.db2.gz XZVWQJIJMXHWFD-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN COc1ccc(N2CCN(CCCOC(C)C)CC2)cc1 ZINC000171497485 524423667 /nfs/dbraw/zinc/42/36/67/524423667.db2.gz OKVKGRXQVAWHBM-UHFFFAOYSA-N 0 3 292.423 2.632 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](C)CN(C)C(C)C)c1[O-] ZINC000291686624 524437681 /nfs/dbraw/zinc/43/76/81/524437681.db2.gz XTCPQYWGMKSGEL-CYBMUJFWSA-N 0 3 250.386 2.519 20 10 CFCDHN Cc1cccc(C[NH2+][C@H](CCO)C(C)(C)C)c1[O-] ZINC000231073731 524440131 /nfs/dbraw/zinc/44/01/31/524440131.db2.gz OHGKDPKUHJIQSO-CYBMUJFWSA-N 0 3 251.370 2.587 20 10 CFCDHN Cc1cccc(C[C@@H](CO)[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000191683630 524466187 /nfs/dbraw/zinc/46/61/87/524466187.db2.gz GCSISROOPOAQNN-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1[O-])CN1CCCC1 ZINC000062748557 524495828 /nfs/dbraw/zinc/49/58/28/524495828.db2.gz QPFCQIYJYHDKRH-OLZOCXBDSA-N 0 3 280.387 2.914 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCOc2ccccc2)c1 ZINC000042895023 524751147 /nfs/dbraw/zinc/75/11/47/524751147.db2.gz VIQIVCWYLSBNFF-UHFFFAOYSA-N 0 3 273.332 2.569 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H]2COc3c(C)cccc3C2)c1 ZINC000290960572 524754926 /nfs/dbraw/zinc/75/49/26/524754926.db2.gz ROQFUXKXOCRFNW-OAHLLOKOSA-N 0 3 299.370 2.803 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1 ZINC000245879997 524755479 /nfs/dbraw/zinc/75/54/79/524755479.db2.gz KQEFDHLZFSHDOW-FVQBIDKESA-N 0 3 291.391 2.694 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c1 ZINC000290416168 524755696 /nfs/dbraw/zinc/75/56/96/524755696.db2.gz KISOVDIGLIWPNE-BPQIPLTHSA-N 0 3 281.355 2.829 20 10 CFCDHN COc1ccc([O-])c(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)c1 ZINC000290059475 524755989 /nfs/dbraw/zinc/75/59/89/524755989.db2.gz FDAHPQKNUTXBHD-SJKOYZFVSA-N 0 3 287.359 2.613 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCOC2(C)C)c1 ZINC000294709397 524767405 /nfs/dbraw/zinc/76/74/05/524767405.db2.gz DQDMVFDIXWRMDF-QMTHXVAHSA-N 0 3 265.353 2.619 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](OC)C(C)C)c1 ZINC000273619292 524772513 /nfs/dbraw/zinc/77/25/13/524772513.db2.gz YNDVPUSGILEUFY-XHDPSFHLSA-N 0 3 267.369 2.722 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H]2CCOC2(C)C)c1 ZINC000294709396 524774151 /nfs/dbraw/zinc/77/41/51/524774151.db2.gz DQDMVFDIXWRMDF-IINYFYTJSA-N 0 3 265.353 2.619 20 10 CFCDHN C[C@@H](CO)[N@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000289415949 524785457 /nfs/dbraw/zinc/78/54/57/524785457.db2.gz IMFFXUYCQDKAJU-ZDUSSCGKSA-N 0 3 271.360 2.872 20 10 CFCDHN C[C@@H](CO)[N@@H+](C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000289415949 524785466 /nfs/dbraw/zinc/78/54/66/524785466.db2.gz IMFFXUYCQDKAJU-ZDUSSCGKSA-N 0 3 271.360 2.872 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](CCO)C2CCC2)c1[O-] ZINC000275916880 524860780 /nfs/dbraw/zinc/86/07/80/524860780.db2.gz FZUJVMROSQBFNW-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](CCO)C2CCC2)c1[O-] ZINC000275916880 524860792 /nfs/dbraw/zinc/86/07/92/524860792.db2.gz FZUJVMROSQBFNW-UHFFFAOYSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H]2CCOC[C@@H]2C)c1[O-] ZINC000277662623 524872267 /nfs/dbraw/zinc/87/22/67/524872267.db2.gz ZXPXDCWZNHGYTO-GXFFZTMASA-N 0 3 269.772 2.869 20 10 CFCDHN Cc1cccc2c1OC[C@H]([NH2+]Cc1ccccc1[O-])C2 ZINC000289587151 524961488 /nfs/dbraw/zinc/96/14/88/524961488.db2.gz MVANHSYMJGXGEZ-OAHLLOKOSA-N 0 3 269.344 2.794 20 10 CFCDHN C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCC1(F)F ZINC000291507504 524986126 /nfs/dbraw/zinc/98/61/26/524986126.db2.gz HZKMBPQAZGXOOY-SECBINFHSA-N 0 3 285.290 2.598 20 10 CFCDHN Cc1cc(O)c(CN2CCCN(CC(F)F)CC2)cc1C ZINC000159652317 525314661 /nfs/dbraw/zinc/31/46/61/525314661.db2.gz AZKODZIQHFTSTF-UHFFFAOYSA-N 0 3 298.377 2.782 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@]3(C2)CCCN(C)C3)cc1C ZINC000293527804 525319800 /nfs/dbraw/zinc/31/98/00/525319800.db2.gz BPCYHJIPMKBEGF-GOSISDBHSA-N 0 3 288.435 2.927 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@]3(C2)CCCN(C)C3)cc1C ZINC000293527804 525319809 /nfs/dbraw/zinc/31/98/09/525319809.db2.gz BPCYHJIPMKBEGF-GOSISDBHSA-N 0 3 288.435 2.927 20 10 CFCDHN C[C@H]([NH2+]CCCCO)c1cc2c(cc1[O-])CCCC2 ZINC000194216825 525336299 /nfs/dbraw/zinc/33/62/99/525336299.db2.gz XAJYZVPTKMRAAV-LBPRGKRZSA-N 0 3 263.381 2.694 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCN2CCC(C)CC2)c1 ZINC000071408299 525348426 /nfs/dbraw/zinc/34/84/26/525348426.db2.gz YIIHGHDDDNXSOW-UHFFFAOYSA-N 0 3 262.397 2.522 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@H](O)c2ccc(F)cc2)c1 ZINC000277665147 525350170 /nfs/dbraw/zinc/35/01/70/525350170.db2.gz HHYWVYBVNARILI-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(O)c(CN[C@]2(CO)CCc3ccccc32)c1 ZINC000305127540 525355253 /nfs/dbraw/zinc/35/52/53/525355253.db2.gz DGWHSHCINNNZOK-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@]2(CO)CCc3ccccc32)c1 ZINC000305127540 525355262 /nfs/dbraw/zinc/35/52/62/525355262.db2.gz DGWHSHCINNNZOK-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000273043593 525355292 /nfs/dbraw/zinc/35/52/92/525355292.db2.gz BBTLLRFITZDTOK-HZPDHXFCSA-N 0 3 261.365 2.748 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H]2CCc3nccn3C2)c1 ZINC000278854730 525358581 /nfs/dbraw/zinc/35/85/81/525358581.db2.gz ALJNMCLWLDLXDE-KGLIPLIRSA-N 0 3 285.391 2.810 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H]2CCc3nccn3C2)c1 ZINC000278854739 525361957 /nfs/dbraw/zinc/36/19/57/525361957.db2.gz ALJNMCLWLDLXDE-ZIAGYGMSSA-N 0 3 285.391 2.810 20 10 CFCDHN C[C@H]([NH2+]CCc1ccncc1)c1cc(F)ccc1[O-] ZINC000094617625 525370672 /nfs/dbraw/zinc/37/06/72/525370672.db2.gz KBDJDKCMDZHKNI-NSHDSACASA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1cc(F)ccc1[O-] ZINC000094617609 525390058 /nfs/dbraw/zinc/39/00/58/525390058.db2.gz ABRPQGHDDUTMEP-RYUDHWBXSA-N 0 3 278.371 2.666 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(F)cc1[O-] ZINC000062744775 525414937 /nfs/dbraw/zinc/41/49/37/525414937.db2.gz VBRNPYOEJMFTPM-LLVKDONJSA-N 0 3 268.376 2.770 20 10 CFCDHN C[C@@H]([NH2+]CCc1cn[nH]c1)c1cc2c(cc1[O-])CCCC2 ZINC000289890681 525467598 /nfs/dbraw/zinc/46/75/98/525467598.db2.gz SQGSBGUOGLTZRU-GFCCVEGCSA-N 0 3 285.391 2.887 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@H](O)c1ccccc1 ZINC000290242815 525513044 /nfs/dbraw/zinc/51/30/44/525513044.db2.gz UUNVGLDYJWYLDT-BZNIZROVSA-N 0 3 275.323 2.743 20 10 CFCDHN C[C@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(F)ccc1[O-] ZINC000279894018 525540451 /nfs/dbraw/zinc/54/04/51/525540451.db2.gz ADNHEENOQVJGCU-GXFFZTMASA-N 0 3 267.344 2.733 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cc(F)ccc1[O-] ZINC000273370960 525622450 /nfs/dbraw/zinc/62/24/50/525622450.db2.gz CJQZOMYEBDBKQT-VHSXEESVSA-N 0 3 263.316 2.677 20 10 CFCDHN CSC[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000292865414 525650639 /nfs/dbraw/zinc/65/06/39/525650639.db2.gz VUEKJNOFQHYRFN-GFCCVEGCSA-N 0 3 251.395 2.967 20 10 CFCDHN CSC[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000292865414 525650647 /nfs/dbraw/zinc/65/06/47/525650647.db2.gz VUEKJNOFQHYRFN-GFCCVEGCSA-N 0 3 251.395 2.967 20 10 CFCDHN COc1cccc(CN2CC(C)(C)[C@H]2[C@H]2CCCO2)c1O ZINC000291665685 525933520 /nfs/dbraw/zinc/93/35/20/525933520.db2.gz VSHZDKQTZYXCOQ-GDBMZVCRSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000289926607 525934258 /nfs/dbraw/zinc/93/42/58/525934258.db2.gz XSIRWFYHVBBRJF-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1cccc(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1[O-] ZINC000289926607 525934271 /nfs/dbraw/zinc/93/42/71/525934271.db2.gz XSIRWFYHVBBRJF-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN COc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000280583982 525935538 /nfs/dbraw/zinc/93/55/38/525935538.db2.gz WVUZQEUYHBQUDZ-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN COc1cccc(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1[O-] ZINC000280583982 525935545 /nfs/dbraw/zinc/93/55/45/525935545.db2.gz WVUZQEUYHBQUDZ-GXTWGEPZSA-N 0 3 279.380 2.526 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)CC(C)C)c([O-])c1 ZINC000040774953 525938629 /nfs/dbraw/zinc/93/86/29/525938629.db2.gz BRSGHCLYFQJBHA-QWHCGFSZSA-N 0 3 251.370 2.758 20 10 CFCDHN COc1cccc(CN[C@H](C)c2cccc(O)c2)c1O ZINC000037151487 526036743 /nfs/dbraw/zinc/03/67/43/526036743.db2.gz UWMQUPSKQZDVGM-LLVKDONJSA-N 0 3 273.332 2.957 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCOCC(F)(F)C(F)F ZINC000278399294 526349765 /nfs/dbraw/zinc/34/97/65/526349765.db2.gz NZIFEKFYMGNSCV-UHFFFAOYSA-N 0 3 299.239 2.538 20 10 CFCDHN [O-]c1ccccc1C[NH2+]CC[C@H](O)c1ccccc1 ZINC000289536228 526371653 /nfs/dbraw/zinc/37/16/53/526371653.db2.gz WLRIPIVYPANKAJ-INIZCTEOSA-N 0 3 257.333 2.606 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000366533847 526372934 /nfs/dbraw/zinc/37/29/34/526372934.db2.gz USEPCDLBMXELBK-HNNXBMFYSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000366533847 526372935 /nfs/dbraw/zinc/37/29/35/526372935.db2.gz USEPCDLBMXELBK-HNNXBMFYSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000365872090 526373677 /nfs/dbraw/zinc/37/36/77/526373677.db2.gz JVDVCIWYJLKTEA-OAHLLOKOSA-N 0 3 269.344 2.876 20 10 CFCDHN Cc1nc(F)ccc1CN(C)Cc1ccccc1O ZINC000278525932 526944543 /nfs/dbraw/zinc/94/45/43/526944543.db2.gz YXTVOFXVXHJQSQ-UHFFFAOYSA-N 0 3 260.312 2.867 20 10 CFCDHN O=C1CCCN1c1ccc(C[NH2+]Cc2ccccc2[O-])cc1 ZINC000074335635 526978220 /nfs/dbraw/zinc/97/82/20/526978220.db2.gz VBZDHVJBRMAUKY-UHFFFAOYSA-N 0 3 296.370 2.809 20 10 CFCDHN Cc1nccn1CCC[N@@H+](C)Cc1cc(C)ccc1[O-] ZINC000290590954 527410574 /nfs/dbraw/zinc/41/05/74/527410574.db2.gz VGJQRXLTNPVJNB-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN Cc1nccn1CCC[N@H+](C)Cc1cc(C)ccc1[O-] ZINC000290590954 527410579 /nfs/dbraw/zinc/41/05/79/527410579.db2.gz VGJQRXLTNPVJNB-UHFFFAOYSA-N 0 3 273.380 2.728 20 10 CFCDHN Cc1nccnc1CC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000294857965 527451555 /nfs/dbraw/zinc/45/15/55/527451555.db2.gz BULLOEOWDZQRTN-SNVBAGLBSA-N 0 3 275.327 2.523 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3[nH]cnc3c2)cc1 ZINC000727464504 574051160 /nfs/dbraw/zinc/05/11/60/574051160.db2.gz RTXVPXOLDIWJLE-UHFFFAOYSA-N 0 3 280.375 2.919 20 10 CFCDHN CN(C)c1ccc(CNCc2ccc3nc[nH]c3c2)cc1 ZINC000727464504 574051162 /nfs/dbraw/zinc/05/11/62/574051162.db2.gz RTXVPXOLDIWJLE-UHFFFAOYSA-N 0 3 280.375 2.919 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCCC(=O)OC(C)(C)C)c1 ZINC000744450396 574075242 /nfs/dbraw/zinc/07/52/42/574075242.db2.gz SLFIJNXSNPQXKV-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN COc1cc(CN2CC[C@H](OC)C2)c(O)c(C(C)(C)C)c1 ZINC000754736346 574117390 /nfs/dbraw/zinc/11/73/90/574117390.db2.gz JYLCSOXVQMNWOH-ZDUSSCGKSA-N 0 3 293.407 2.919 20 10 CFCDHN C[C@H]([NH2+]Cc1ccccc1CO)c1cc(F)ccc1[O-] ZINC000756457755 574118514 /nfs/dbraw/zinc/11/85/14/574118514.db2.gz KWNFXFWRUAQWIC-NSHDSACASA-N 0 3 275.323 2.874 20 10 CFCDHN CCCNC(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731847319 574130331 /nfs/dbraw/zinc/13/03/31/574130331.db2.gz IPHFSFPYXWDCGX-UHFFFAOYSA-N 0 3 290.407 2.663 20 10 CFCDHN CCCNC(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000731847319 574130334 /nfs/dbraw/zinc/13/03/34/574130334.db2.gz IPHFSFPYXWDCGX-UHFFFAOYSA-N 0 3 290.407 2.663 20 10 CFCDHN COC[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756342663 574226938 /nfs/dbraw/zinc/22/69/38/574226938.db2.gz UFUKQBYOYOBDTK-NEPJUHHUSA-N 0 3 263.381 2.957 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CCN2CCCC2)c2c1c(F)ccc2[O-] ZINC000756355588 574228789 /nfs/dbraw/zinc/22/87/89/574228789.db2.gz PLMVQGLYHLFRIR-YPMHNXCESA-N 0 3 278.371 2.765 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccco2)c([O-])c1 ZINC000756379732 574231459 /nfs/dbraw/zinc/23/14/59/574231459.db2.gz AVFFQPNHPVPKHD-FZMZJTMJSA-N 0 3 261.321 2.678 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(C)C2)c([O-])c1C ZINC000756443803 574238072 /nfs/dbraw/zinc/23/80/72/574238072.db2.gz IWSYQMXHVPLUHS-UONOGXRCSA-N 0 3 262.397 2.754 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC2(O)CCCC2)c2c1c(F)ccc2[O-] ZINC000756571739 574248671 /nfs/dbraw/zinc/24/86/71/574248671.db2.gz DQPOUGLLSORYCJ-PWSUYJOCSA-N 0 3 279.355 2.974 20 10 CFCDHN CSC[C@H](CCO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756603628 574251589 /nfs/dbraw/zinc/25/15/89/574251589.db2.gz JESAZDZQPOHDHH-JFGNBEQYSA-N 0 3 299.411 2.783 20 10 CFCDHN C[C@@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(F)ccc1[O-] ZINC000756617112 574252324 /nfs/dbraw/zinc/25/23/24/574252324.db2.gz MIRCJGKNNVDOPX-NWDGAFQWSA-N 0 3 266.360 2.666 20 10 CFCDHN CC(C)[C@@H](CO)[NH2+][C@@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756643983 574254769 /nfs/dbraw/zinc/25/47/69/574254769.db2.gz WVTCMZLCISKZBQ-YUSALJHKSA-N 0 3 267.344 2.686 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCNc2cnccn2)c([O-])c1C ZINC000756645703 574255322 /nfs/dbraw/zinc/25/53/22/574255322.db2.gz JGPHNRVQFFHSMP-CYBMUJFWSA-N 0 3 286.379 2.562 20 10 CFCDHN C[C@H](CCCO)[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756647969 574255450 /nfs/dbraw/zinc/25/54/50/574255450.db2.gz URGQMKOIEPTCST-FOGDFJRCSA-N 0 3 267.344 2.830 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)Cc2ccco2)c([O-])c1 ZINC000756661191 574256151 /nfs/dbraw/zinc/25/61/51/574256151.db2.gz PMINSCLLLRBTDY-ZIAGYGMSSA-N 0 3 289.375 2.795 20 10 CFCDHN Cc1ccc([C@H](C)NCC(=O)NC2CCCC2)c(O)c1C ZINC000756707055 574258295 /nfs/dbraw/zinc/25/82/95/574258295.db2.gz SLEACHSCVYAFBX-ZDUSSCGKSA-N 0 3 290.407 2.718 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H](CCO)C2CC2)c2c1c(F)ccc2[O-] ZINC000756740136 574260018 /nfs/dbraw/zinc/26/00/18/574260018.db2.gz PXHVFKJLHXZZIY-JIMOISOXSA-N 0 3 279.355 2.830 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756734408 574260248 /nfs/dbraw/zinc/26/02/48/574260248.db2.gz WOWHCQQEGJVXCF-GVXVVHGQSA-N 0 3 297.370 2.721 20 10 CFCDHN Cc1cccc(NCC[NH2+][C@@H](C)c2cc(F)ccc2[O-])n1 ZINC000756747569 574260518 /nfs/dbraw/zinc/26/05/18/574260518.db2.gz QSPCCGHZGMCCIR-LBPRGKRZSA-N 0 3 289.354 2.997 20 10 CFCDHN COc1cccc(C[NH2+]CC2=Cc3ccccc3OC2)c1[O-] ZINC000733900944 574260783 /nfs/dbraw/zinc/26/07/83/574260783.db2.gz RGZUKJAOGRLDHY-UHFFFAOYSA-N 0 3 297.354 2.966 20 10 CFCDHN CNC(=O)[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756773848 574261852 /nfs/dbraw/zinc/26/18/52/574261852.db2.gz CUPCCMBRBXXXOR-BPLDGKMQSA-N 0 3 290.407 2.574 20 10 CFCDHN Cc1cc(CN[C@@H]2C[C@H](C)c3c2c(O)ccc3F)ncn1 ZINC000756775432 574261872 /nfs/dbraw/zinc/26/18/72/574261872.db2.gz HKSATHZMGAAFAA-TVQRCGJNSA-N 0 3 287.338 2.968 20 10 CFCDHN CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1[O-])C(F)(F)F ZINC000756834740 574266937 /nfs/dbraw/zinc/26/69/37/574266937.db2.gz JGMJEPYVJVTFTR-SKDRFNHKSA-N 0 3 277.286 2.929 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cnn2ccccc12 ZINC000734508725 574290414 /nfs/dbraw/zinc/29/04/14/574290414.db2.gz CUXGVJINPSUEDM-UHFFFAOYSA-N 0 3 294.402 2.999 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CC[C@H]([C@H]3CCOC3)C1)CCC2 ZINC000749797989 574309720 /nfs/dbraw/zinc/30/97/20/574309720.db2.gz CXRGUVSACIIUEC-HOTGVXAUSA-N 0 3 287.403 2.739 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CC[C@H]([C@H]3CCOC3)C1)CCC2 ZINC000749797989 574309721 /nfs/dbraw/zinc/30/97/21/574309721.db2.gz CXRGUVSACIIUEC-HOTGVXAUSA-N 0 3 287.403 2.739 20 10 CFCDHN COc1cccc(CNCc2cc(F)cc(F)c2)c1O ZINC000725844457 574326415 /nfs/dbraw/zinc/32/64/15/574326415.db2.gz YFCTZHZSTVXWLM-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN CNC(=O)CCC[N@H+](C)Cc1cc(C(C)C)c(C)cc1[O-] ZINC000753807314 574410709 /nfs/dbraw/zinc/41/07/09/574410709.db2.gz WXBDSQABPJXMRA-UHFFFAOYSA-N 0 3 292.423 2.782 20 10 CFCDHN CNC(=O)CCC[N@@H+](C)Cc1cc(C(C)C)c(C)cc1[O-] ZINC000753807314 574410710 /nfs/dbraw/zinc/41/07/10/574410710.db2.gz WXBDSQABPJXMRA-UHFFFAOYSA-N 0 3 292.423 2.782 20 10 CFCDHN O=c1[nH]c2ccccc2cc1C[NH2+]Cc1ccccc1[O-] ZINC000076868330 617989134 /nfs/dbraw/zinc/98/91/34/617989134.db2.gz JZSLVISQBPCPNL-UHFFFAOYSA-N 0 3 280.327 2.524 20 10 CFCDHN COc1ccc(O)c(CNCc2ccc(F)c(F)c2)c1 ZINC000049577371 617614399 /nfs/dbraw/zinc/61/43/99/617614399.db2.gz KWBAPNWWSMXNOS-UHFFFAOYSA-N 0 3 279.286 2.969 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H]1C[C@@]1(C)Br ZINC000891714049 617724669 /nfs/dbraw/zinc/72/46/69/617724669.db2.gz PZGDLXXBBILMGV-DGCLKSJQSA-N 0 3 284.197 2.998 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H]1C[C@@]1(C)Br ZINC000891714049 617724672 /nfs/dbraw/zinc/72/46/72/617724672.db2.gz PZGDLXXBBILMGV-DGCLKSJQSA-N 0 3 284.197 2.998 20 10 CFCDHN C[C@H]([NH2+]CCOC(C)(C)C)c1cc(F)ccc1[O-] ZINC000308690305 617788019 /nfs/dbraw/zinc/78/80/19/617788019.db2.gz HKLNSMAUOBCJDP-JTQLQIEISA-N 0 3 255.333 2.997 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[O-])CCN1C ZINC000090721335 617793576 /nfs/dbraw/zinc/79/35/76/617793576.db2.gz CBBLCKFJKAFMDF-ZWNOBZJWSA-N 0 3 268.788 2.618 20 10 CFCDHN COc1cnccc1[C@@H](C)NCc1cc(F)ccc1O ZINC000189010911 618320369 /nfs/dbraw/zinc/32/03/69/618320369.db2.gz DJUADLRJAQAOKY-SNVBAGLBSA-N 0 3 276.311 2.786 20 10 CFCDHN CCOC(=O)CC[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179587262 618327026 /nfs/dbraw/zinc/32/70/26/618327026.db2.gz WGIIDXUJMSDWQJ-AWEZNQCLSA-N 0 3 291.391 2.948 20 10 CFCDHN CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179587262 618327034 /nfs/dbraw/zinc/32/70/34/618327034.db2.gz WGIIDXUJMSDWQJ-AWEZNQCLSA-N 0 3 291.391 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CCO)C2)c1[O-] ZINC000775681798 618331672 /nfs/dbraw/zinc/33/16/72/618331672.db2.gz TYACTGLSLIVTKC-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](CCO)C2)c1[O-] ZINC000775681798 618331684 /nfs/dbraw/zinc/33/16/84/618331684.db2.gz TYACTGLSLIVTKC-GFCCVEGCSA-N 0 3 283.799 2.948 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2SCCS2)c([O-])c1 ZINC000850401875 618634960 /nfs/dbraw/zinc/63/49/60/618634960.db2.gz YTDLTQSOXHKANO-UHFFFAOYSA-N 0 3 285.434 2.687 20 10 CFCDHN CCN(CC)C[C@H](C)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000311806223 618724009 /nfs/dbraw/zinc/72/40/09/618724009.db2.gz CCDYLGZCUWRRQT-JSGCOSHPSA-N 0 3 262.397 2.699 20 10 CFCDHN C[C@H]([NH2+]CCc1cn2ccccc2n1)c1ccccc1[O-] ZINC000183405287 618905809 /nfs/dbraw/zinc/90/58/09/618905809.db2.gz QZMBOSQQRTZSOB-ZDUSSCGKSA-N 0 3 281.359 2.933 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2)c([O-])c1 ZINC000184862308 618919982 /nfs/dbraw/zinc/91/99/82/618919982.db2.gz CEUJYRYEBJRPJW-LBPRGKRZSA-N 0 3 284.359 2.650 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2[O-])cn1 ZINC000094616969 619164864 /nfs/dbraw/zinc/16/48/64/619164864.db2.gz KEZLJNSYZPKZIC-JTQLQIEISA-N 0 3 276.311 2.786 20 10 CFCDHN Cc1cc(N(C)C)ccc1C[C@H](C)NCc1nccn1C ZINC000840975553 619202007 /nfs/dbraw/zinc/20/20/07/619202007.db2.gz IAQIBCCDLCXWPR-AWEZNQCLSA-N 0 3 286.423 2.515 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cnc3onc(C)c3c2)c([O-])c1 ZINC000894640032 619434150 /nfs/dbraw/zinc/43/41/50/619434150.db2.gz XYJWJGXBSXYAHE-UHFFFAOYSA-N 0 3 299.330 2.535 20 10 CFCDHN Cc1nc([C@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000894776465 619461528 /nfs/dbraw/zinc/46/15/28/619461528.db2.gz DSNIODGQGQQYSN-FYJFLYSWSA-N 0 3 285.395 2.543 20 10 CFCDHN Cc1nc([C@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000894776462 619461646 /nfs/dbraw/zinc/46/16/46/619461646.db2.gz DSNIODGQGQQYSN-FJOGCWAESA-N 0 3 285.395 2.543 20 10 CFCDHN Cc1nc([C@@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000894776458 619461783 /nfs/dbraw/zinc/46/17/83/619461783.db2.gz DSNIODGQGQQYSN-BTDICHCPSA-N 0 3 285.395 2.543 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1COCO1 ZINC000894871414 619492488 /nfs/dbraw/zinc/49/24/88/619492488.db2.gz DQCFNMVCAOCIRJ-MRXNPFEDSA-N 0 3 285.343 2.522 20 10 CFCDHN COc1cc(C)cc(CN2CC(CC(F)F)C2)c1O ZINC000895055364 619536524 /nfs/dbraw/zinc/53/65/24/619536524.db2.gz NWVQKXBDXRPHAL-UHFFFAOYSA-N 0 3 271.307 2.796 20 10 CFCDHN COc1ccc(O)c(CN[C@@]2(c3ccccc3)C[C@@H](O)C2)c1 ZINC000895513199 619544771 /nfs/dbraw/zinc/54/47/71/619544771.db2.gz WBLTUUGWTZYBQY-RHNCMZPLSA-N 0 3 299.370 2.541 20 10 CFCDHN COC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccccc1[O-])C2 ZINC000895601219 619564226 /nfs/dbraw/zinc/56/42/26/619564226.db2.gz MCGXRZKEPHQNMV-UHFFFAOYSA-N 0 3 297.354 2.737 20 10 CFCDHN COC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccccc1[O-])C2 ZINC000895601219 619564228 /nfs/dbraw/zinc/56/42/28/619564228.db2.gz MCGXRZKEPHQNMV-UHFFFAOYSA-N 0 3 297.354 2.737 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H]1CC[C@@]2(CO[C@H](C)C2)O1 ZINC000895820474 619614640 /nfs/dbraw/zinc/61/46/40/619614640.db2.gz OIYWZYRFGGPUDX-JKIFEVAISA-N 0 3 291.391 2.517 20 10 CFCDHN COc1cc2c(cc1O)CCN(Cc1cc(C)ccc1O)C2 ZINC000895888108 619628060 /nfs/dbraw/zinc/62/80/60/619628060.db2.gz IOOKWWSVSQDQRU-UHFFFAOYSA-N 0 3 299.370 2.973 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC(C)(C)CC[C@H]2CO)c([O-])c1 ZINC000895925544 619635871 /nfs/dbraw/zinc/63/58/71/619635871.db2.gz CSFVYRHUPRRVPC-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC(C)(C)CC[C@H]2CO)c([O-])c1 ZINC000895925544 619635873 /nfs/dbraw/zinc/63/58/73/619635873.db2.gz CSFVYRHUPRRVPC-AWEZNQCLSA-N 0 3 293.407 2.774 20 10 CFCDHN COCC1CN(Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC000895975276 619647896 /nfs/dbraw/zinc/64/78/96/619647896.db2.gz SUHQZENIICYDSW-UHFFFAOYSA-N 0 3 293.407 2.777 20 10 CFCDHN Cn1ccc(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)n1 ZINC000896497002 619749536 /nfs/dbraw/zinc/74/95/36/619749536.db2.gz WXUAZKVKYZUWHX-UHFFFAOYSA-N 0 3 289.354 2.644 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)CCc2ccccc2)c([O-])c1 ZINC000896526986 619756298 /nfs/dbraw/zinc/75/62/98/619756298.db2.gz HEOAMNMGFKHXQY-QGZVFWFLSA-N 0 3 285.387 2.784 20 10 CFCDHN Cc1nc(CC2CC[NH+](Cc3ccccc3[O-])CC2)no1 ZINC000896551730 619760669 /nfs/dbraw/zinc/76/06/69/619760669.db2.gz QZDQNOZZLGGICS-UHFFFAOYSA-N 0 3 287.363 2.538 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000896962677 619905393 /nfs/dbraw/zinc/90/53/93/619905393.db2.gz QAPHOHMNLLRTQJ-CQSZACIVSA-N 0 3 299.370 2.930 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000896962677 619905395 /nfs/dbraw/zinc/90/53/95/619905395.db2.gz QAPHOHMNLLRTQJ-CQSZACIVSA-N 0 3 299.370 2.930 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1COc3ccccc3O1)CC2 ZINC000321015477 620081296 /nfs/dbraw/zinc/08/12/96/620081296.db2.gz SPXQKKGZSLCJHC-UONOGXRCSA-N 0 3 297.354 2.809 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CC[C@H](C3CC3)O2)c([O-])c1 ZINC000897512349 620199848 /nfs/dbraw/zinc/19/98/48/620199848.db2.gz XZQMZYCNSCCYNC-DOTOQJQBSA-N 0 3 291.391 2.838 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C1CC2(C1)CO[C@@H](C)C2 ZINC000897776790 620280171 /nfs/dbraw/zinc/28/01/71/620280171.db2.gz XFIIVUGRQAPIAY-FUJMWEONSA-N 0 3 261.365 2.748 20 10 CFCDHN CCOc1ccc(C[NH2+]C2CC3(C2)CO[C@H](C)C3)c([O-])c1 ZINC000897780865 620283784 /nfs/dbraw/zinc/28/37/84/620283784.db2.gz JQCDEFIAYJKOPD-RFSCMCKOSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@@H]1CC2(CC([NH2+]Cc3cc(F)ccc3[O-])C2)CO1 ZINC000897780542 620283794 /nfs/dbraw/zinc/28/37/94/620283794.db2.gz XIRVBZWKBGXHOH-ZZJLNTIPSA-N 0 3 265.328 2.579 20 10 CFCDHN COc1ccc(CNCc2ccc3nonc3c2)cc1C ZINC000897994104 620314801 /nfs/dbraw/zinc/31/48/01/620314801.db2.gz MARMLVUZSJUFHA-UHFFFAOYSA-N 0 3 283.331 2.830 20 10 CFCDHN C[C@@H]1CC=CC[C@H]1[NH2+]Cc1cc2c(cc1[O-])OCO2 ZINC000898228535 620358863 /nfs/dbraw/zinc/35/88/63/620358863.db2.gz WXUMCVXOWNBKKY-ZYHUDNBSSA-N 0 3 261.321 2.565 20 10 CFCDHN C[C@@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1ccccc1[O-] ZINC000926964395 620433857 /nfs/dbraw/zinc/43/38/57/620433857.db2.gz RNESEZQWVUGPCU-ZWNOBZJWSA-N 0 3 290.329 2.925 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H]2CNC(=O)C2)c1[O-] ZINC000926980103 620435519 /nfs/dbraw/zinc/43/55/19/620435519.db2.gz OVNXJLFIYLONEP-QWRGUYRKSA-N 0 3 296.798 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C[C@H](CO)C2)c1[O-] ZINC000927146583 620492604 /nfs/dbraw/zinc/49/26/04/620492604.db2.gz FUBKHOKLMRJUPD-NHCYSSNCSA-N 0 3 269.772 2.776 20 10 CFCDHN C[C@H](N[C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1cc(Cl)ccc1[O-] ZINC000902478959 621088941 /nfs/dbraw/zinc/08/89/41/621088941.db2.gz ZECQONUXBCDLNK-YPWHJJHSSA-N 0 3 266.772 2.589 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H]1CC(=O)N(C)C1)c1ccc(C)cc1[O-] ZINC000903211010 621288745 /nfs/dbraw/zinc/28/87/45/621288745.db2.gz AGIVOSFMQJRAEH-HIFRSBDPSA-N 0 3 290.407 2.610 20 10 CFCDHN CO[C@@H]1CCOC[C@H]1[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000903296869 621312922 /nfs/dbraw/zinc/31/29/22/621312922.db2.gz OKWRJNOTIZLDHL-LERXQTSPSA-N 0 3 299.798 2.809 20 10 CFCDHN CC[C@@H](NCc1cn(C)nc1OC)c1ccc(C)cc1O ZINC000903338356 621333764 /nfs/dbraw/zinc/33/37/64/621333764.db2.gz QMCRWUQOENEEMC-CQSZACIVSA-N 0 3 289.379 2.684 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@]2(OC(C)C)CCOC2)c([O-])c1 ZINC000903358721 621347969 /nfs/dbraw/zinc/34/79/69/621347969.db2.gz YGFXQOAAVVSBSL-YOEHRIQHSA-N 0 3 293.407 2.935 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@]13C[C@H]1COC31CCC1)CC2 ZINC000903367555 621349147 /nfs/dbraw/zinc/34/91/47/621349147.db2.gz IWLRNDMFUUJSDJ-GRDNDAEWSA-N 0 3 285.387 2.928 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+][C@@H]2COC[C@@H]2C)c2c1c(F)ccc2[O-] ZINC000903397770 621350474 /nfs/dbraw/zinc/35/04/74/621350474.db2.gz ZISCDPAQVKFXBA-LLHIFLOGSA-N 0 3 265.328 2.704 20 10 CFCDHN CNC(=O)c1cccc(CC[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000183525199 625514662 /nfs/dbraw/zinc/51/46/62/625514662.db2.gz MBQJPWMJYREZRD-ZDUSSCGKSA-N 0 3 298.386 2.645 20 10 CFCDHN C[C@@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1cc([O-])cs1 ZINC000912651769 622755154 /nfs/dbraw/zinc/75/51/54/622755154.db2.gz ZDTFCDSGNMCWJO-NEPJUHHUSA-N 0 3 296.436 2.789 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000157651873 623043812 /nfs/dbraw/zinc/04/38/12/623043812.db2.gz VVICQYPDAIUQFK-NTZNESFSSA-N 0 3 266.360 2.665 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1ccccc1[O-] ZINC000157817341 623060856 /nfs/dbraw/zinc/06/08/56/623060856.db2.gz JPRVOMIVLCMHQA-NFAWXSAZSA-N 0 3 262.397 2.916 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1Cc2ccccc2O1 ZINC000226583865 623083765 /nfs/dbraw/zinc/08/37/65/623083765.db2.gz PVTWOLSPCXAXTC-CQSZACIVSA-N 0 3 273.307 2.625 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2cc(F)ccc2[O-])CCCS1 ZINC000226615129 623084443 /nfs/dbraw/zinc/08/44/43/623084443.db2.gz KSJNADSRNFQOMI-ZDUSSCGKSA-N 0 3 255.358 2.907 20 10 CFCDHN COCCOCCCC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000168750485 623102423 /nfs/dbraw/zinc/10/24/23/623102423.db2.gz RAZBGPDHKKMJLL-CQSZACIVSA-N 0 3 281.396 2.794 20 10 CFCDHN CC[C@H]([NH2+]CC1CCC(O)CC1)c1ccccc1[O-] ZINC000227656501 623116137 /nfs/dbraw/zinc/11/61/37/623116137.db2.gz PPDIKMFWPZSSLH-PIMMBPRGSA-N 0 3 263.381 2.984 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@@H+](C)C[C@H]32)c(Cl)c1 ZINC000822520696 623120979 /nfs/dbraw/zinc/12/09/79/623120979.db2.gz MHOSWYJUBMIEAI-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc([O-])c(CN2CCC[C@H]3C[N@H+](C)C[C@H]32)c(Cl)c1 ZINC000822520696 623120980 /nfs/dbraw/zinc/12/09/80/623120980.db2.gz MHOSWYJUBMIEAI-SWLSCSKDSA-N 0 3 294.826 2.880 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCC2CC2)c1[O-] ZINC000228675776 623156871 /nfs/dbraw/zinc/15/68/71/623156871.db2.gz JSWQIFHWZUBDAY-UHFFFAOYSA-N 0 3 255.745 2.944 20 10 CFCDHN Fc1cc(CN2CC[C@H]2C2CC2)ccc1N1CCOCC1 ZINC000824651034 623539880 /nfs/dbraw/zinc/53/98/80/623539880.db2.gz STRCWDHUGWIIIB-INIZCTEOSA-N 0 3 290.382 2.647 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824716382 623551145 /nfs/dbraw/zinc/55/11/45/623551145.db2.gz UBUYCEAVIHFUJE-FMKPAKJESA-N 0 3 279.355 2.657 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000824716382 623551153 /nfs/dbraw/zinc/55/11/53/623551153.db2.gz UBUYCEAVIHFUJE-FMKPAKJESA-N 0 3 279.355 2.657 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1CCCC1(F)F ZINC000824799417 623567908 /nfs/dbraw/zinc/56/79/08/623567908.db2.gz NHVRBEZDKUIDLT-SNVBAGLBSA-N 0 3 271.307 2.926 20 10 CFCDHN CCOC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[O-] ZINC000824861103 623580220 /nfs/dbraw/zinc/58/02/20/623580220.db2.gz HYJMJOPGIGXOFQ-KGLIPLIRSA-N 0 3 295.354 2.743 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000825133853 623637278 /nfs/dbraw/zinc/63/72/78/623637278.db2.gz NEWXGPQUVMUQII-HNNXBMFYSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000825133853 623637284 /nfs/dbraw/zinc/63/72/84/623637284.db2.gz NEWXGPQUVMUQII-HNNXBMFYSA-N 0 3 265.328 2.534 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@@H]2COC)c([O-])c1 ZINC000825294552 623665654 /nfs/dbraw/zinc/66/56/54/623665654.db2.gz TULIEFBGBNPLEX-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@@H]2COC)c([O-])c1 ZINC000825294552 623665658 /nfs/dbraw/zinc/66/56/58/623665658.db2.gz TULIEFBGBNPLEX-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCCn1nccc1CN[C@H](C)c1cc(OC)ccc1O ZINC000825935547 623771112 /nfs/dbraw/zinc/77/11/12/623771112.db2.gz XODCMELZIXYZKD-GFCCVEGCSA-N 0 3 289.379 2.858 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CCO[C@H]2CC2(F)F)c1[O-] ZINC000827072245 623935971 /nfs/dbraw/zinc/93/59/71/623935971.db2.gz HNXKAXWYDFFJAB-NSHDSACASA-N 0 3 291.725 2.868 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@@](O)(C3CC3)C2)c([O-])c1 ZINC000827151548 623954125 /nfs/dbraw/zinc/95/41/25/623954125.db2.gz FJBNEERJGGJHKY-KRWDZBQOSA-N 0 3 291.391 2.528 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@@](O)(C3CC3)C2)c([O-])c1 ZINC000827151548 623954129 /nfs/dbraw/zinc/95/41/29/623954129.db2.gz FJBNEERJGGJHKY-KRWDZBQOSA-N 0 3 291.391 2.528 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1[O-] ZINC000827151699 623954632 /nfs/dbraw/zinc/95/46/32/623954632.db2.gz IHIGHGKPGFIUFJ-MSRIBSCDSA-N 0 3 299.798 2.503 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1[O-] ZINC000827151699 623954634 /nfs/dbraw/zinc/95/46/34/623954634.db2.gz IHIGHGKPGFIUFJ-MSRIBSCDSA-N 0 3 299.798 2.503 20 10 CFCDHN COc1cc(Cl)cc(C[NH+]2C[C@@H](C)C(O)[C@H](C)C2)c1[O-] ZINC000827151700 623954713 /nfs/dbraw/zinc/95/47/13/623954713.db2.gz IHIGHGKPGFIUFJ-NXEZZACHSA-N 0 3 299.798 2.503 20 10 CFCDHN CN(C)c1ccc(CN(C)CC2=CCCOC2)cc1F ZINC000827185445 623962062 /nfs/dbraw/zinc/96/20/62/623962062.db2.gz SPNSBBILEHOLQF-UHFFFAOYSA-N 0 3 278.371 2.670 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000827537465 624025995 /nfs/dbraw/zinc/02/59/95/624025995.db2.gz CWBPFNSCAZGAGV-UHFFFAOYSA-N 0 3 273.376 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000827537465 624026004 /nfs/dbraw/zinc/02/60/04/624026004.db2.gz CWBPFNSCAZGAGV-UHFFFAOYSA-N 0 3 273.376 2.783 20 10 CFCDHN CC1CCC(O)(C[NH2+]Cc2cc(F)ccc2[O-])CC1 ZINC000232836098 624067165 /nfs/dbraw/zinc/06/71/65/624067165.db2.gz GPDRBAJUEAPBCE-UHFFFAOYSA-N 0 3 267.344 2.562 20 10 CFCDHN C[S@](=O)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000827813592 624099527 /nfs/dbraw/zinc/09/95/27/624099527.db2.gz VWWPEKOZDJZHBN-IBGZPJMESA-N 0 3 281.421 2.515 20 10 CFCDHN C[S@](=O)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000827813592 624099529 /nfs/dbraw/zinc/09/95/29/624099529.db2.gz VWWPEKOZDJZHBN-IBGZPJMESA-N 0 3 281.421 2.515 20 10 CFCDHN C[C@H](NCc1cccnc1N)c1ccc(N(C)C)cc1 ZINC000828958764 624341046 /nfs/dbraw/zinc/34/10/46/624341046.db2.gz DBYUCRQFFHCHHV-LBPRGKRZSA-N 0 3 270.380 2.581 20 10 CFCDHN CN(C)CC[N@H+](Cc1cc(F)ccc1[O-])C1CCCC1 ZINC000154627629 624411957 /nfs/dbraw/zinc/41/19/57/624411957.db2.gz PGUANLJVNTVLMU-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CN(C)CC[N@@H+](Cc1cc(F)ccc1[O-])C1CCCC1 ZINC000154627629 624411965 /nfs/dbraw/zinc/41/19/65/624411965.db2.gz PGUANLJVNTVLMU-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CN(Cc1cnn2ccccc12)Cc1ccccc1O ZINC000179804171 624978614 /nfs/dbraw/zinc/97/86/14/624978614.db2.gz LLFZPDSSLRVHGZ-UHFFFAOYSA-N 0 3 267.332 2.672 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@H]1CC[C@@H](CO)CC1)CC2 ZINC000834620743 625738431 /nfs/dbraw/zinc/73/84/31/625738431.db2.gz VNTMZHYZKMDOBA-KWCYVHTRSA-N 0 3 261.365 2.520 20 10 CFCDHN C[C@H](C[C@@H]1CCOC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000834624326 625741171 /nfs/dbraw/zinc/74/11/71/625741171.db2.gz JMNOSUUFOCXRPE-DYEKYZERSA-N 0 3 261.365 2.784 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CCC2(CO)CC2)c([O-])c1 ZINC000834896533 625913586 /nfs/dbraw/zinc/91/35/86/625913586.db2.gz KTTKMOIUZHVKMI-ZDUSSCGKSA-N 0 3 263.381 2.822 20 10 CFCDHN CCO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(N(C)CC)cc1 ZINC000834904856 625917126 /nfs/dbraw/zinc/91/71/26/625917126.db2.gz RZVNYXPSSLFUFL-KBRIMQKVSA-N 0 3 292.423 2.597 20 10 CFCDHN C[C@@H]([NH2+]CC(C)(C)N)c1ccc(Br)cc1[O-] ZINC000817960979 625964524 /nfs/dbraw/zinc/96/45/24/625964524.db2.gz VLBYKLKHUSLJJX-MRVPVSSYSA-N 0 3 287.201 2.543 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC000922429721 626287962 /nfs/dbraw/zinc/28/79/62/626287962.db2.gz SVVLDOIUQVBGQS-OLZOCXBDSA-N 0 3 261.365 2.927 20 10 CFCDHN COc1cccc(CNCc2nccc3c2CCCC3)c1O ZINC000922466738 626292756 /nfs/dbraw/zinc/29/27/56/626292756.db2.gz LUYFHFMHJLEDCD-UHFFFAOYSA-N 0 3 298.386 2.964 20 10 CFCDHN CCOc1ccc(CN2CC3(CC(F)C3)C2)c(O)c1 ZINC000839141094 626528454 /nfs/dbraw/zinc/52/84/54/626528454.db2.gz YLFIIZLVUJROHS-UHFFFAOYSA-N 0 3 265.328 2.725 20 10 CFCDHN CN(C)c1ccc(/C=C/CN2C[C@@H]3C[C@H]2CS3)cc1 ZINC000839190802 626530510 /nfs/dbraw/zinc/53/05/10/626530510.db2.gz CCUMLGGKXKDDNF-PIGHNIFASA-N 0 3 274.433 2.956 20 10 CFCDHN CO[C@@H]1COC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000839193027 626530845 /nfs/dbraw/zinc/53/08/45/626530845.db2.gz MQRGWGGGWXMQKL-FUHWJXTLSA-N 0 3 299.370 2.563 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C2COC(C)(C)OC2)c2c1c(F)ccc2[O-] ZINC000757698352 626558896 /nfs/dbraw/zinc/55/88/96/626558896.db2.gz PVDBPHANQISWDV-SKDRFNHKSA-N 0 3 295.354 2.821 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2cc(F)ccc2[O-])CCCCC1 ZINC000757801715 626563356 /nfs/dbraw/zinc/56/33/56/626563356.db2.gz WTBLQXGOTZZHSI-UHFFFAOYSA-N 0 3 295.354 2.887 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000757867809 626566015 /nfs/dbraw/zinc/56/60/15/626566015.db2.gz WFSSVNKTDRIAKK-DZGCQCFKSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000757867809 626566018 /nfs/dbraw/zinc/56/60/18/626566018.db2.gz WFSSVNKTDRIAKK-DZGCQCFKSA-N 0 3 293.407 2.630 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000760897089 626783016 /nfs/dbraw/zinc/78/30/16/626783016.db2.gz PDCYUBVVQRJOKW-GWCFXTLKSA-N 0 3 289.354 2.645 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CCO)C2)c1[O-] ZINC000761194333 626814522 /nfs/dbraw/zinc/81/45/22/626814522.db2.gz YUEWJABBOYPTCQ-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](CCO)C2)c1[O-] ZINC000761194333 626814523 /nfs/dbraw/zinc/81/45/23/626814523.db2.gz YUEWJABBOYPTCQ-NSHDSACASA-N 0 3 299.798 2.649 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@@H]2OC)c1[O-] ZINC000761216581 626816569 /nfs/dbraw/zinc/81/65/69/626816569.db2.gz SWRWIQSGAIVMMD-MFKMUULPSA-N 0 3 299.798 2.959 20 10 CFCDHN CCO[C@@H]1COCC[C@H]1[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000761223934 626817259 /nfs/dbraw/zinc/81/72/59/626817259.db2.gz VIZJQSBIXPXROI-ZIAGYGMSSA-N 0 3 299.798 2.638 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000762142164 626896493 /nfs/dbraw/zinc/89/64/93/626896493.db2.gz KAKVXKDRGRSOFX-IAQYHMDHSA-N 0 3 289.375 2.583 20 10 CFCDHN C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000762142164 626896497 /nfs/dbraw/zinc/89/64/97/626896497.db2.gz KAKVXKDRGRSOFX-IAQYHMDHSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000762619919 626927168 /nfs/dbraw/zinc/92/71/68/626927168.db2.gz XVOMRGKHHNGNIC-XBFCOCLRSA-N 0 3 281.446 2.861 20 10 CFCDHN CC[C@H](NCC(=O)N(CC)CC)c1ccc(N(C)C)cc1 ZINC000765333971 627131051 /nfs/dbraw/zinc/13/10/51/627131051.db2.gz OEIJWMNEXWEJLI-INIZCTEOSA-N 0 3 291.439 2.662 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1ccc(OCC)cc1[O-] ZINC000768240691 627327656 /nfs/dbraw/zinc/32/76/56/627327656.db2.gz CRIFRUWIRNMZFM-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1ccc(OCC)cc1[O-] ZINC000768240691 627327660 /nfs/dbraw/zinc/32/76/60/627327660.db2.gz CRIFRUWIRNMZFM-UHFFFAOYSA-N 0 3 281.396 2.775 20 10 CFCDHN CC(C)N(Cc1cn[nH]c1)Cc1ccc(N(C)C)cc1 ZINC000768357903 627336100 /nfs/dbraw/zinc/33/61/00/627336100.db2.gz QGHGJMJDZZZYTJ-UHFFFAOYSA-N 0 3 272.396 2.886 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H]1C1CCC1)[C@@H](O)CO2 ZINC000768448335 627343998 /nfs/dbraw/zinc/34/39/98/627343998.db2.gz BUAPTXTVJNDTSW-HOCLYGCPSA-N 0 3 289.375 2.583 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H]1C1CCC1)[C@@H](O)CO2 ZINC000768448335 627344001 /nfs/dbraw/zinc/34/40/01/627344001.db2.gz BUAPTXTVJNDTSW-HOCLYGCPSA-N 0 3 289.375 2.583 20 10 CFCDHN CC(C)C[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768465288 627344929 /nfs/dbraw/zinc/34/49/29/627344929.db2.gz FRDDXVLUXHDMTF-BLLLJJGKSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000768465288 627344933 /nfs/dbraw/zinc/34/49/33/627344933.db2.gz FRDDXVLUXHDMTF-BLLLJJGKSA-N 0 3 291.391 2.686 20 10 CFCDHN CCOc1ccc(C[N@H+](CCOC)CC(C)C)c([O-])c1 ZINC000768589787 627356302 /nfs/dbraw/zinc/35/63/02/627356302.db2.gz YBJRWVPUYYZCOH-UHFFFAOYSA-N 0 3 281.396 2.895 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCOC)CC(C)C)c([O-])c1 ZINC000768589787 627356309 /nfs/dbraw/zinc/35/63/09/627356309.db2.gz YBJRWVPUYYZCOH-UHFFFAOYSA-N 0 3 281.396 2.895 20 10 CFCDHN CC[N@H+](CCc1ccccn1)Cc1c([O-])cccc1OC ZINC000769034528 627397597 /nfs/dbraw/zinc/39/75/97/627397597.db2.gz RRRJSLGVGHUASQ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CC[N@@H+](CCc1ccccn1)Cc1c([O-])cccc1OC ZINC000769034528 627397602 /nfs/dbraw/zinc/39/76/02/627397602.db2.gz RRRJSLGVGHUASQ-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@H]1CSC ZINC000769513494 627449814 /nfs/dbraw/zinc/44/98/14/627449814.db2.gz AHSKJTTYLRCPHE-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@H]1CSC ZINC000769513494 627449815 /nfs/dbraw/zinc/44/98/15/627449815.db2.gz AHSKJTTYLRCPHE-NSHDSACASA-N 0 3 267.394 2.728 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000769519579 627451777 /nfs/dbraw/zinc/45/17/77/627451777.db2.gz SQXSGEPLCBSNDG-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000769519579 627451779 /nfs/dbraw/zinc/45/17/79/627451779.db2.gz SQXSGEPLCBSNDG-AWEZNQCLSA-N 0 3 291.391 2.649 20 10 CFCDHN CC[C@@H]1CN(Cc2ccc(N(CC)CC)c(F)c2)C[C@@H]1O ZINC000770384325 627517157 /nfs/dbraw/zinc/51/71/57/627517157.db2.gz XLWIACMUXHVHLN-PBHICJAKSA-N 0 3 294.414 2.875 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000770506178 627525899 /nfs/dbraw/zinc/52/58/99/627525899.db2.gz WVQWSRNRTKWXQW-UKRRQHHQSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000770506178 627525900 /nfs/dbraw/zinc/52/59/00/627525900.db2.gz WVQWSRNRTKWXQW-UKRRQHHQSA-N 0 3 261.365 2.641 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000770739820 627545241 /nfs/dbraw/zinc/54/52/41/627545241.db2.gz SKCJUIGGUWUSTD-OLZOCXBDSA-N 0 3 279.380 2.696 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H]1CCO[C@H](C(C)C)C1 ZINC000771894337 627644769 /nfs/dbraw/zinc/64/47/69/627644769.db2.gz WJTQGQYRIPNJFC-LRDDRELGSA-N 0 3 279.380 2.694 20 10 CFCDHN CCN(C)c1ccc(CN[C@H](CO)c2ccccc2)cc1 ZINC000773823159 627860766 /nfs/dbraw/zinc/86/07/66/627860766.db2.gz UVWFTIAXRLDCNR-GOSISDBHSA-N 0 3 284.403 2.966 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(OCC)cc1[O-] ZINC000775176232 627998192 /nfs/dbraw/zinc/99/81/92/627998192.db2.gz MJYSUPRHYNAZET-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1ccc(OCC)cc1[O-] ZINC000775176232 627998196 /nfs/dbraw/zinc/99/81/96/627998196.db2.gz MJYSUPRHYNAZET-KRWDZBQOSA-N 0 3 293.407 2.918 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@@H](CO)CC2CC2)c1[O-] ZINC000776252199 628122260 /nfs/dbraw/zinc/12/22/60/628122260.db2.gz PLYOAGFONHPIHY-CYBMUJFWSA-N 0 3 269.772 2.605 20 10 CFCDHN CC(C)[C@H]1C[C@@H](C[NH2+]Cc2ccccc2[O-])CCO1 ZINC000778630921 628321494 /nfs/dbraw/zinc/32/14/94/628321494.db2.gz GZCCWNQFBWEFPJ-XJKSGUPXSA-N 0 3 263.381 2.933 20 10 CFCDHN CC(C)(C)[N@@H+]1CCCN(Cc2cc(F)ccc2[O-])CC1 ZINC000779002584 628344524 /nfs/dbraw/zinc/34/45/24/628344524.db2.gz HXMDOMFAHKLDLO-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN CC(C)(C)[N@H+]1CCCN(Cc2cc(F)ccc2[O-])CC1 ZINC000779002584 628344528 /nfs/dbraw/zinc/34/45/28/628344528.db2.gz HXMDOMFAHKLDLO-UHFFFAOYSA-N 0 3 280.387 2.838 20 10 CFCDHN [O-]c1ccccc1C[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000779027397 628346813 /nfs/dbraw/zinc/34/68/13/628346813.db2.gz RXBFLFVBONIFHT-UHFFFAOYSA-N 0 3 279.343 2.868 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])c1ccncc1 ZINC000779088848 628351301 /nfs/dbraw/zinc/35/13/01/628351301.db2.gz WMYIRSPCYLLGSL-LLVKDONJSA-N 0 3 260.312 2.820 20 10 CFCDHN CC[C@]1(O)CC[N@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000779218563 628361013 /nfs/dbraw/zinc/36/10/13/628361013.db2.gz HBKALJAZTQWNRC-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN CC[C@]1(O)CC[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000779218563 628361017 /nfs/dbraw/zinc/36/10/17/628361017.db2.gz HBKALJAZTQWNRC-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN CC(C)[C@@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000780499807 628469414 /nfs/dbraw/zinc/46/94/14/628469414.db2.gz UAMRXMFPMYJHPM-MLGOLLRUSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000780499807 628469417 /nfs/dbraw/zinc/46/94/17/628469417.db2.gz UAMRXMFPMYJHPM-MLGOLLRUSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)c1ccccc1[O-] ZINC000783508230 628714741 /nfs/dbraw/zinc/71/47/41/628714741.db2.gz HQIJGSCVBXMZLN-GHMZBOCLSA-N 0 3 288.313 2.679 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000784667708 628835587 /nfs/dbraw/zinc/83/55/87/628835587.db2.gz KCSMGXYOBCWAMA-MRXNPFEDSA-N 0 3 291.391 2.792 20 10 CFCDHN CC[C@H]([NH2+]Cc1cccn(CC)c1=O)c1ccccc1[O-] ZINC000788605235 629085975 /nfs/dbraw/zinc/08/59/75/629085975.db2.gz NWEVTFOHVQGXEC-HNNXBMFYSA-N 0 3 286.375 2.815 20 10 CFCDHN C[C@H](O)CCC[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000789347508 629149090 /nfs/dbraw/zinc/14/90/90/629149090.db2.gz GHYVRTGFIYDWLO-HOCLYGCPSA-N 0 3 293.407 2.534 20 10 CFCDHN C[C@H](O)CCC[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1 ZINC000789347508 629149091 /nfs/dbraw/zinc/14/90/91/629149091.db2.gz GHYVRTGFIYDWLO-HOCLYGCPSA-N 0 3 293.407 2.534 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@]2(C)CO)c1[O-] ZINC000789556569 629166775 /nfs/dbraw/zinc/16/67/75/629166775.db2.gz CMXYHMFQBVBOGG-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@@]2(C)CO)c1[O-] ZINC000789556569 629166776 /nfs/dbraw/zinc/16/67/76/629166776.db2.gz CMXYHMFQBVBOGG-AWEZNQCLSA-N 0 3 269.772 2.701 20 10 CFCDHN CCOC(=O)CC1([NH2+]Cc2cc(F)ccc2[O-])CCCC1 ZINC000789778952 629187809 /nfs/dbraw/zinc/18/78/09/629187809.db2.gz NCGZNIMCXWOBRC-UHFFFAOYSA-N 0 3 295.354 2.887 20 10 CFCDHN CCc1cc(CNCC=Cc2ccc(N(C)C)cc2)[nH]n1 ZINC000835039657 629334087 /nfs/dbraw/zinc/33/40/87/629334087.db2.gz JSWRANOCUPCBDT-WAYWQWQTSA-N 0 3 284.407 2.841 20 10 CFCDHN CCc1cc(CNCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835039657 629334090 /nfs/dbraw/zinc/33/40/90/629334090.db2.gz JSWRANOCUPCBDT-WAYWQWQTSA-N 0 3 284.407 2.841 20 10 CFCDHN C[C@@H](NC/C=C\c1ccc(N(C)C)cc1)c1cn[nH]c1 ZINC000835041038 629334784 /nfs/dbraw/zinc/33/47/84/629334784.db2.gz IUBHEMKODZSRKT-DSYXLKISSA-N 0 3 270.380 2.840 20 10 CFCDHN Cc1c(CNC/C=C\c2ccc(N(C)C)cc2)cnn1C ZINC000835043792 629339782 /nfs/dbraw/zinc/33/97/82/629339782.db2.gz ZGVCPOIGKULRJA-WAYWQWQTSA-N 0 3 284.407 2.598 20 10 CFCDHN Cc1c(CNC/C=C/c2ccc(N(C)C)cc2)cnn1C ZINC000835043790 629340612 /nfs/dbraw/zinc/34/06/12/629340612.db2.gz ZGVCPOIGKULRJA-AATRIKPKSA-N 0 3 284.407 2.598 20 10 CFCDHN CC[C@H]1C[C@@H](C[NH2+]Cc2ccc(OC)cc2[O-])CCO1 ZINC000793388099 629536009 /nfs/dbraw/zinc/53/60/09/629536009.db2.gz LVKOMCDEWDIAHD-JSGCOSHPSA-N 0 3 279.380 2.696 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c([O-])c1 ZINC000793575137 629574023 /nfs/dbraw/zinc/57/40/23/629574023.db2.gz UGUIGELUEFBSBD-ZENOOKHLSA-N 0 3 295.423 2.509 20 10 CFCDHN CN1CC[N@H+](Cc2ccccc2[O-])C[C@H]1Cc1ccccc1 ZINC000793620045 629580034 /nfs/dbraw/zinc/58/00/34/629580034.db2.gz JWUAKWLQMPXSPY-GOSISDBHSA-N 0 3 296.414 2.751 20 10 CFCDHN CN1CC[N@@H+](Cc2ccccc2[O-])C[C@H]1Cc1ccccc1 ZINC000793620045 629580037 /nfs/dbraw/zinc/58/00/37/629580037.db2.gz JWUAKWLQMPXSPY-GOSISDBHSA-N 0 3 296.414 2.751 20 10 CFCDHN CCCNC(=O)CC[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000794797640 629686819 /nfs/dbraw/zinc/68/68/19/629686819.db2.gz OZJMSCGGQAPRKW-AWEZNQCLSA-N 0 3 278.396 2.658 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)C[S@@](C)=O)c1ccc(C)cc1[O-] ZINC000794813567 629689393 /nfs/dbraw/zinc/68/93/93/629689393.db2.gz AYMOZJXCLBODEJ-SUFBMKPHSA-N 0 3 269.410 2.508 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)C(C)(C)O)c1ccc(C)cc1[O-] ZINC000794814620 629689793 /nfs/dbraw/zinc/68/97/93/629689793.db2.gz RSOSCZDMXLDNEF-AAEUAGOBSA-N 0 3 251.370 2.901 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)CS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000794812221 629689801 /nfs/dbraw/zinc/68/98/01/629689801.db2.gz VJZYWYLQHJUBSJ-GXTWGEPZSA-N 0 3 299.436 2.565 20 10 CFCDHN COc1ccc(CNc2ccnc3ccccc32)c(O)c1 ZINC000795284162 629757316 /nfs/dbraw/zinc/75/73/16/629757316.db2.gz IZLQGZFZUMDVAF-UHFFFAOYSA-N 0 3 280.327 2.983 20 10 CFCDHN Cc1ccc([C@@H](O)[C@H](C)[NH2+]Cc2ccccc2[O-])cc1 ZINC000796484015 629925496 /nfs/dbraw/zinc/92/54/96/629925496.db2.gz MUCRTTPAVNPNCB-GUYCJALGSA-N 0 3 271.360 2.912 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1CCCc2n[nH]cc21 ZINC000796770110 629963523 /nfs/dbraw/zinc/96/35/23/629963523.db2.gz CHQHKFOCKXGISL-INIZCTEOSA-N 0 3 284.407 2.951 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H]1CCCc2n[nH]cc21 ZINC000796770112 629963588 /nfs/dbraw/zinc/96/35/88/629963588.db2.gz CHQHKFOCKXGISL-MRXNPFEDSA-N 0 3 284.407 2.951 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC000799736330 630342168 /nfs/dbraw/zinc/34/21/68/630342168.db2.gz NQZLQVYKXKOGMY-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](OC)C[C@H]2C)c([O-])c1 ZINC000799736330 630342169 /nfs/dbraw/zinc/34/21/69/630342169.db2.gz NQZLQVYKXKOGMY-OCCSQVGLSA-N 0 3 279.380 2.790 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000808431803 630990731 /nfs/dbraw/zinc/99/07/31/630990731.db2.gz ZJWJADYSPYGOCQ-AWEZNQCLSA-N 0 3 291.778 2.911 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1COc2ccccc21 ZINC000808450831 630994359 /nfs/dbraw/zinc/99/43/59/630994359.db2.gz BZQJNUVJHQOMAE-LBPRGKRZSA-N 0 3 285.343 2.667 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCN(C)C2)c1[O-] ZINC000808692242 631029088 /nfs/dbraw/zinc/02/90/88/631029088.db2.gz QLWNTIIONVJRQB-PWSUYJOCSA-N 0 3 268.788 2.709 20 10 CFCDHN CC[C@@H](N[C@@H](C)C(=O)NC(C)C)c1ccc(N(C)C)cc1 ZINC000840890425 631253009 /nfs/dbraw/zinc/25/30/09/631253009.db2.gz MLFYNIKCVFGMQX-XJKSGUPXSA-N 0 3 291.439 2.706 20 10 CFCDHN CC[C@H]([NH2+]CCCS(=O)(=O)CC)c1ccc(C)cc1[O-] ZINC000840888191 631253791 /nfs/dbraw/zinc/25/37/91/631253791.db2.gz CNGCIBFWGOGFKU-AWEZNQCLSA-N 0 3 299.436 2.566 20 10 CFCDHN C[C@@H](CO)[N@@H+](Cc1cc(F)ccc1[O-])CC1CCC1 ZINC000809664231 631259590 /nfs/dbraw/zinc/25/95/90/631259590.db2.gz CCUPWFWLUNHOOD-NSHDSACASA-N 0 3 267.344 2.514 20 10 CFCDHN C[C@@H](CO)[N@H+](Cc1cc(F)ccc1[O-])CC1CCC1 ZINC000809664231 631259595 /nfs/dbraw/zinc/25/95/95/631259595.db2.gz CCUPWFWLUNHOOD-NSHDSACASA-N 0 3 267.344 2.514 20 10 CFCDHN CCCN(Cc1ccc(C)nn1)Cc1ccccc1O ZINC000840913559 631263032 /nfs/dbraw/zinc/26/30/32/631263032.db2.gz XWQRLMSLGKBBBC-UHFFFAOYSA-N 0 3 271.364 2.903 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCCn2ccnc2)c([O-])c1 ZINC000809753276 631280862 /nfs/dbraw/zinc/28/08/62/631280862.db2.gz OVFGXPIFDUKQDG-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCCn2ccnc2)c([O-])c1 ZINC000809753276 631280866 /nfs/dbraw/zinc/28/08/66/631280866.db2.gz OVFGXPIFDUKQDG-UHFFFAOYSA-N 0 3 289.379 2.510 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@H]2CCN(C)C[C@@H]2C)c([O-])c1 ZINC000809765813 631282596 /nfs/dbraw/zinc/28/25/96/631282596.db2.gz QVIQZCQYDADGBI-BBRMVZONSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@H]2CCN(C)C[C@@H]2C)c([O-])c1 ZINC000809765813 631282601 /nfs/dbraw/zinc/28/26/01/631282601.db2.gz QVIQZCQYDADGBI-BBRMVZONSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H]2CCN(C)C[C@H]2C)c([O-])c1 ZINC000809765818 631283145 /nfs/dbraw/zinc/28/31/45/631283145.db2.gz QVIQZCQYDADGBI-CZUORRHYSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@H]2C)c([O-])c1 ZINC000809765818 631283149 /nfs/dbraw/zinc/28/31/49/631283149.db2.gz QVIQZCQYDADGBI-CZUORRHYSA-N 0 3 292.423 2.563 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@H](CO)CC(C)C)c([O-])c1 ZINC000809767188 631285190 /nfs/dbraw/zinc/28/51/90/631285190.db2.gz HAIVRNOZCPGTDD-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@H](CO)CC(C)C)c([O-])c1 ZINC000809767188 631285192 /nfs/dbraw/zinc/28/51/92/631285192.db2.gz HAIVRNOZCPGTDD-AWEZNQCLSA-N 0 3 281.396 2.630 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H](CO)c1ccc(F)cc1 ZINC000840964737 631287044 /nfs/dbraw/zinc/28/70/44/631287044.db2.gz ZYNZKRWTSASPHH-CYBMUJFWSA-N 0 3 293.313 2.536 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CC)[C@@H](O)C(C)C)c([O-])c1 ZINC000840967457 631287544 /nfs/dbraw/zinc/28/75/44/631287544.db2.gz NMEMZYMNKYRUKM-ZBFHGGJFSA-N 0 3 281.396 2.676 20 10 CFCDHN CC(C)(C)[C@H](C[NH3+])NCc1c([O-])ccc(Cl)c1F ZINC000841088102 631335458 /nfs/dbraw/zinc/33/54/58/631335458.db2.gz XIYLKBYAURRWGU-NSHDSACASA-N 0 3 274.767 2.648 20 10 CFCDHN CC(C)(C)[C@H](CN)[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000841088102 631335462 /nfs/dbraw/zinc/33/54/62/631335462.db2.gz XIYLKBYAURRWGU-NSHDSACASA-N 0 3 274.767 2.648 20 10 CFCDHN C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@@]1(C)C[NH3+] ZINC000841090851 631336922 /nfs/dbraw/zinc/33/69/22/631336922.db2.gz OBDPYAQLXCKDPH-YMTOWFKASA-N 0 3 286.778 2.601 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]Cc2ccc(CC(N)=O)cc2)c([O-])c1 ZINC000810242531 631348831 /nfs/dbraw/zinc/34/88/31/631348831.db2.gz RHZUZBUKAGRXCN-ZDUSSCGKSA-N 0 3 298.386 2.579 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CCOC)COC)c1ccc(C)cc1[O-] ZINC000810256486 631350741 /nfs/dbraw/zinc/35/07/41/631350741.db2.gz AORSVBLMRCDGGL-ZFWWWQNUSA-N 0 3 281.396 2.793 20 10 CFCDHN COc1cccc([O-])c1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841889078 631487708 /nfs/dbraw/zinc/48/77/08/631487708.db2.gz ZVTAJFISFVHEKH-UHFFFAOYSA-N 0 3 291.391 2.934 20 10 CFCDHN CC[C@@H](C[N@@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1)OC ZINC000842154145 631555267 /nfs/dbraw/zinc/55/52/67/631555267.db2.gz TYMGJGAGMRYARY-HOTGVXAUSA-N 0 3 293.407 2.798 20 10 CFCDHN CC[C@@H](C[N@H+](Cc1ccccc1[O-])C[C@@H]1CCCO1)OC ZINC000842154145 631555268 /nfs/dbraw/zinc/55/52/68/631555268.db2.gz TYMGJGAGMRYARY-HOTGVXAUSA-N 0 3 293.407 2.798 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000811512008 631574900 /nfs/dbraw/zinc/57/49/00/631574900.db2.gz BDCMLDOZDZGUFT-SNVBAGLBSA-N 0 3 271.307 2.878 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000811512008 631574903 /nfs/dbraw/zinc/57/49/03/631574903.db2.gz BDCMLDOZDZGUFT-SNVBAGLBSA-N 0 3 271.307 2.878 20 10 CFCDHN COc1cccc(O)c1CN1CCC(F)(F)[C@H](C)C1 ZINC000811512008 631574906 /nfs/dbraw/zinc/57/49/06/631574906.db2.gz BDCMLDOZDZGUFT-SNVBAGLBSA-N 0 3 271.307 2.878 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H](CO)C[C@@H](C)CC)c([O-])c1 ZINC000842753141 631728751 /nfs/dbraw/zinc/72/87/51/631728751.db2.gz CFBYUSLKARBPQA-JSGCOSHPSA-N 0 3 281.396 2.678 20 10 CFCDHN Cn1ncc2ccc(C[NH2+]Cc3cc(F)ccc3[O-])cc21 ZINC000812771559 631770521 /nfs/dbraw/zinc/77/05/21/631770521.db2.gz YZFUCAWZYHODSF-UHFFFAOYSA-N 0 3 285.322 2.708 20 10 CFCDHN COCC1(CC[NH2+][C@@H](C)c2cc(F)ccc2[O-])CC1 ZINC000842890143 631774748 /nfs/dbraw/zinc/77/47/48/631774748.db2.gz AJAYMCVZGGZABW-NSHDSACASA-N 0 3 267.344 2.999 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@@]2(O)CCOC2)c([O-])c1 ZINC000842918773 631781632 /nfs/dbraw/zinc/78/16/32/631781632.db2.gz IYBAWJWWFWSANP-CXAGYDPISA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)[C@@]1(O)CCOC1)c1ccccc1[O-] ZINC000842918248 631782059 /nfs/dbraw/zinc/78/20/59/631782059.db2.gz DXLYBDUIXQKHFM-RHSMWYFYSA-N 0 3 293.407 2.611 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H]3CCC[C@@H](C2)[NH2+]3)c(Cl)c1 ZINC000843104725 631836891 /nfs/dbraw/zinc/83/68/91/631836891.db2.gz ADMCCFJCVOZJAN-TXEJJXNPSA-N 0 3 280.799 2.680 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419713 631950288 /nfs/dbraw/zinc/95/02/88/631950288.db2.gz QLXCHMFZVLVOPA-AWEZNQCLSA-N 0 3 254.333 2.777 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000843419713 631950290 /nfs/dbraw/zinc/95/02/90/631950290.db2.gz QLXCHMFZVLVOPA-AWEZNQCLSA-N 0 3 254.333 2.777 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@@H](C(C)C)C2(CO)CCC2)c1 ZINC000814171684 632021675 /nfs/dbraw/zinc/02/16/75/632021675.db2.gz UOSZIHDSYQDDSW-INIZCTEOSA-N 0 3 277.408 2.977 20 10 CFCDHN Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)CO)c([O-])c1 ZINC000815597264 632294179 /nfs/dbraw/zinc/29/41/79/632294179.db2.gz RCMLIVVJBMUSQI-LBPRGKRZSA-N 0 3 251.370 2.678 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1CNc2ccccc2C1 ZINC000844904869 632331918 /nfs/dbraw/zinc/33/19/18/632331918.db2.gz DGZIQECKODMFSN-CQSZACIVSA-N 0 3 272.323 2.658 20 10 CFCDHN Oc1ccccc1CN1CCOC[C@@H]1CC1CCC1 ZINC000816667224 632508253 /nfs/dbraw/zinc/50/82/53/632508253.db2.gz HDDAZQUHZLTRHK-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOC[C@@H]1CC1CCC1 ZINC000816667224 632508254 /nfs/dbraw/zinc/50/82/54/632508254.db2.gz HDDAZQUHZLTRHK-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOC[C@@H]1CC1CCC1 ZINC000816667224 632508260 /nfs/dbraw/zinc/50/82/60/632508260.db2.gz HDDAZQUHZLTRHK-HNNXBMFYSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2c1c(F)ccc2[O-] ZINC000846189129 632657379 /nfs/dbraw/zinc/65/73/79/632657379.db2.gz KPERVXMKROBCRS-ORMWDYAWSA-N 0 3 277.339 2.989 20 10 CFCDHN C[C@@H](COCC1CC1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000846205006 632660000 /nfs/dbraw/zinc/66/00/00/632660000.db2.gz LYJNWLHVPVTMKI-FZMZJTMJSA-N 0 3 261.365 2.784 20 10 CFCDHN COC1([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2[O-])CCOCC1 ZINC000817589202 632672200 /nfs/dbraw/zinc/67/22/00/632672200.db2.gz VYSQRFFJMQKHCD-NEPJUHHUSA-N 0 3 297.370 2.766 20 10 CFCDHN CCCN1C[C@H](C[NH2+][C@H](C)c2ccc(C)cc2[O-])CC1=O ZINC000817590173 632672905 /nfs/dbraw/zinc/67/29/05/632672905.db2.gz VQZNCGYRNSUEQH-KGLIPLIRSA-N 0 3 290.407 2.610 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCNC1)c1ccc2ccccc2c1[O-] ZINC000817940092 632743969 /nfs/dbraw/zinc/74/39/69/632743969.db2.gz DTCJIDQULKBUQH-OCCSQVGLSA-N 0 3 270.376 2.948 20 10 CFCDHN CC[C@H](N[C@H]1CCC[NH2+]C1)c1cccc(Cl)c1[O-] ZINC000817940737 632744280 /nfs/dbraw/zinc/74/42/80/632744280.db2.gz KHOCFLAEJFIEOT-GWCFXTLKSA-N 0 3 268.788 2.838 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+]C1)c1ccc(C(F)(F)F)cc1[O-] ZINC000817944825 632747629 /nfs/dbraw/zinc/74/76/29/632747629.db2.gz NGQPXRBBNJKXSO-ZYHUDNBSSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@@H](CN)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817970477 632769906 /nfs/dbraw/zinc/76/99/06/632769906.db2.gz WXVLXGRDFFXDLO-BQBZGAKWSA-N 0 3 263.168 2.697 20 10 CFCDHN C[C@@H](N)C[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000817971728 632770626 /nfs/dbraw/zinc/77/06/26/632770626.db2.gz GOXGQJCBEHCAJY-RNFRBKRXSA-N 0 3 263.168 2.697 20 10 CFCDHN CCN[C@H](C)C[NH2+][C@@H](CC)c1ccc(F)cc1[O-] ZINC000817972802 632772372 /nfs/dbraw/zinc/77/23/72/632772372.db2.gz OTMPTMIOVWLVGE-MFKMUULPSA-N 0 3 254.349 2.570 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1[O-])[C@H](C)N ZINC000817977343 632775145 /nfs/dbraw/zinc/77/51/45/632775145.db2.gz HZYZETBETGBUEB-TUAOUCFPSA-N 0 3 258.365 2.932 20 10 CFCDHN C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1[O-] ZINC000817977999 632775439 /nfs/dbraw/zinc/77/54/39/632775439.db2.gz SUHSKYNDGKQXIA-CIUDSAMLSA-N 0 3 287.201 2.541 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@@H]2CNCCC2(F)F)cc1 ZINC000817981347 632778118 /nfs/dbraw/zinc/77/81/18/632778118.db2.gz RGAALVBJZGUMQV-IUODEOHRSA-N 0 3 297.393 2.791 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cc(F)cc(F)c1[O-] ZINC000818614997 632879667 /nfs/dbraw/zinc/87/96/67/632879667.db2.gz KHBNTEXPXZUCDQ-BZHVJNSISA-N 0 3 270.323 2.591 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)c1[O-] ZINC000857060691 635921779 /nfs/dbraw/zinc/92/17/79/635921779.db2.gz DZAHSYONVRGUOC-CMPLNLGQSA-N 0 3 299.798 2.505 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c1[O-] ZINC000857060691 635921781 /nfs/dbraw/zinc/92/17/81/635921781.db2.gz DZAHSYONVRGUOC-CMPLNLGQSA-N 0 3 299.798 2.505 20 10 CFCDHN C[C@@H](NCc1cnc(Cl)n1C)c1ccc(N(C)C)cc1 ZINC000848547512 633285992 /nfs/dbraw/zinc/28/59/92/633285992.db2.gz PSCWGBZWQWFRCV-LLVKDONJSA-N 0 3 292.814 2.990 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](C)N1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[O-] ZINC000848559455 633289192 /nfs/dbraw/zinc/28/91/92/633289192.db2.gz XAKXFLKDUUPIHG-APIJFGDWSA-N 0 3 292.423 2.541 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](C)N1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[O-] ZINC000848559456 633289273 /nfs/dbraw/zinc/28/92/73/633289273.db2.gz XAKXFLKDUUPIHG-BYNSBNAKSA-N 0 3 292.423 2.541 20 10 CFCDHN C[C@H](C[NH2+][C@@H](C)c1ccccc1[O-])N1C[C@@H](C)O[C@@H](C)C1 ZINC000848559457 633289410 /nfs/dbraw/zinc/28/94/10/633289410.db2.gz XAKXFLKDUUPIHG-KBXIAJHMSA-N 0 3 292.423 2.541 20 10 CFCDHN CCc1cccc(CN[C@@H]2CCCc3c[nH]nc32)c1O ZINC000848899230 633387978 /nfs/dbraw/zinc/38/79/78/633387978.db2.gz LKVJDPLVXUJSQO-CQSZACIVSA-N 0 3 271.364 2.845 20 10 CFCDHN CCc1cccc(C[NH2+]Cc2ccc(OC)cc2[O-])c1O ZINC000848907858 633393731 /nfs/dbraw/zinc/39/37/31/633393731.db2.gz JDAOBLNKJHCZSJ-UHFFFAOYSA-N 0 3 287.359 2.959 20 10 CFCDHN CCc1cccc(C[NH2+]C(CC)(CC)CCO)c1[O-] ZINC000848909602 633394927 /nfs/dbraw/zinc/39/49/27/633394927.db2.gz XNPGZLLSWIPMSB-UHFFFAOYSA-N 0 3 265.397 2.985 20 10 CFCDHN CCc1cccc(CN2CCOC[C@@H]2C2CCC2)c1O ZINC000848920130 633402960 /nfs/dbraw/zinc/40/29/60/633402960.db2.gz XXBKDWBKTNENOH-MRXNPFEDSA-N 0 3 275.392 2.956 20 10 CFCDHN COc1ccc(N2CC[C@@H](NCc3ccoc3C)C2)cc1 ZINC000850347159 633948454 /nfs/dbraw/zinc/94/84/54/633948454.db2.gz OVXRVOAFXQSCQS-OAHLLOKOSA-N 0 3 286.375 2.965 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CCC[C@@H](C)O2)c([O-])c1 ZINC000850379247 633966786 /nfs/dbraw/zinc/96/67/86/633966786.db2.gz IUUNPSBOHYCBGG-IUODEOHRSA-N 0 3 279.380 2.838 20 10 CFCDHN C[C@@H](O)[C@@H]([NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000850419479 633983883 /nfs/dbraw/zinc/98/38/83/633983883.db2.gz FQACUJDAJIPAFM-MLGOLLRUSA-N 0 3 257.333 2.604 20 10 CFCDHN C[C@@H](O)[C@H](NCc1ccc(N(C)C)cc1)c1ccccc1 ZINC000850421534 633985255 /nfs/dbraw/zinc/98/52/55/633985255.db2.gz YGQUETZTVPFZKI-KDOFPFPSSA-N 0 3 284.403 2.964 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])C1CCOCC1 ZINC000850494467 634017726 /nfs/dbraw/zinc/01/77/26/634017726.db2.gz RXTYCPQIYKCITR-ABAIWWIYSA-N 0 3 297.370 2.624 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@]13OCCC[C@H]1C3(F)F)CC2 ZINC000850532675 634038805 /nfs/dbraw/zinc/03/88/05/634038805.db2.gz NGVGBLWXFYYXNG-LNSITVRQSA-N 0 3 295.329 2.783 20 10 CFCDHN C[C@@H]([NH2+]C[C@]12OCCC[C@H]1C2(F)F)c1ccccc1[O-] ZINC000850533819 634040310 /nfs/dbraw/zinc/04/03/10/634040310.db2.gz FVRUNZRYXYIMKD-HONMWMINSA-N 0 3 283.318 2.857 20 10 CFCDHN CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000853605874 635048619 /nfs/dbraw/zinc/04/86/19/635048619.db2.gz NBPXVGOVPQLPKU-SWPIJICWSA-N 0 3 289.375 2.581 20 10 CFCDHN CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc2c(cc1[O-])OC[C@H]2O ZINC000853605874 635048621 /nfs/dbraw/zinc/04/86/21/635048621.db2.gz NBPXVGOVPQLPKU-SWPIJICWSA-N 0 3 289.375 2.581 20 10 CFCDHN [O-]c1cccc(Cl)c1C[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000113340028 651191787 /nfs/dbraw/zinc/19/17/87/651191787.db2.gz AISSWFYFPWDRFX-LBPRGKRZSA-N 0 3 280.799 2.620 20 10 CFCDHN CC[C@@H]([NH2+]CC1(N)CCCC1)c1ccc(F)cc1[O-] ZINC000854221982 635262685 /nfs/dbraw/zinc/26/26/85/635262685.db2.gz BGYOBGPAIGRYHS-CYBMUJFWSA-N 0 3 266.360 2.844 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)CNC)c1cccc(Cl)c1[O-] ZINC000854231644 635268210 /nfs/dbraw/zinc/26/82/10/635268210.db2.gz IJGLMDKEPUEEKJ-SKDRFNHKSA-N 0 3 256.777 2.694 20 10 CFCDHN CC[C@H](N[C@H](C)C[NH2+]C)c1cccc(Cl)c1[O-] ZINC000854231644 635268214 /nfs/dbraw/zinc/26/82/14/635268214.db2.gz IJGLMDKEPUEEKJ-SKDRFNHKSA-N 0 3 256.777 2.694 20 10 CFCDHN CCC(CC)(CO)NCc1cc(F)c(N(C)C)cc1F ZINC000858139613 636137182 /nfs/dbraw/zinc/13/71/82/636137182.db2.gz XDQVQURTOWDAFV-UHFFFAOYSA-N 0 3 286.366 2.672 20 10 CFCDHN CSC[C@H](C)NCc1cc(F)c(N(C)C)cc1F ZINC000858141299 636138044 /nfs/dbraw/zinc/13/80/44/636138044.db2.gz NJRHSAFTOOBXFA-VIFPVBQESA-N 0 3 274.380 2.872 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@@H]2CCC=CO2)cc1F ZINC000858158683 636142849 /nfs/dbraw/zinc/14/28/49/636142849.db2.gz OLYPKQIYQWXXGV-LBPRGKRZSA-N 0 3 282.334 2.813 20 10 CFCDHN CO[C@](C)(CNCc1cc(F)c(N(C)C)cc1F)C1CC1 ZINC000858166427 636146052 /nfs/dbraw/zinc/14/60/52/636146052.db2.gz NADDCEOHDJDMEY-MRXNPFEDSA-N 0 3 298.377 2.936 20 10 CFCDHN CC[C@](C)(CNCc1cc(F)c(N(C)C)cc1F)OC ZINC000858172951 636147390 /nfs/dbraw/zinc/14/73/90/636147390.db2.gz MDDLZCLMBWHXRQ-OAHLLOKOSA-N 0 3 286.366 2.936 20 10 CFCDHN CN(C)c1cc(F)c(CNCCc2ccoc2)cc1F ZINC000858193903 636152605 /nfs/dbraw/zinc/15/26/05/636152605.db2.gz OGKVNZBRPZVBRC-UHFFFAOYSA-N 0 3 280.318 2.956 20 10 CFCDHN Cc1cccc2c1C[C@H]([NH2+]Cc1ccccc1[O-])CO2 ZINC000858215648 636157461 /nfs/dbraw/zinc/15/74/61/636157461.db2.gz LBEZFCBSKKWWRI-AWEZNQCLSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1ccc(O)c(CNCc2ccnn2CC2CC2)c1 ZINC000858238582 636160557 /nfs/dbraw/zinc/16/05/57/636160557.db2.gz AOXTVRKHIUPGLA-UHFFFAOYSA-N 0 3 271.364 2.597 20 10 CFCDHN COC(=O)C1=CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000858475052 636262759 /nfs/dbraw/zinc/26/27/59/636262759.db2.gz XAWWLKYVDZGOQP-YPMHNXCESA-N 0 3 275.348 2.613 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCN1CC(F)F)c1ccccc1[O-] ZINC000858478986 636264351 /nfs/dbraw/zinc/26/43/51/636264351.db2.gz GLPPZLQKAHBUPF-NEPJUHHUSA-N 0 3 284.350 2.772 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CCCN1CC(F)F)c1ccccc1[O-] ZINC000858478989 636264961 /nfs/dbraw/zinc/26/49/61/636264961.db2.gz GLPPZLQKAHBUPF-VXGBXAGGSA-N 0 3 284.350 2.772 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCN2C)c2c1c(F)ccc2[O-] ZINC000858567343 636295242 /nfs/dbraw/zinc/29/52/42/636295242.db2.gz WJLUDNAROWTOHJ-GMXVVIOVSA-N 0 3 278.371 2.763 20 10 CFCDHN Oc1cc2c(cc1CN1CCN(C3CC3)CC1)CCCC2 ZINC000160063073 650291307 /nfs/dbraw/zinc/29/13/07/650291307.db2.gz XCPRINACDNVXRY-UHFFFAOYSA-N 0 3 286.419 2.551 20 10 CFCDHN CN(C)c1cc(F)c(CN(CCO)C2CCCC2)cc1F ZINC000862212750 637288218 /nfs/dbraw/zinc/28/82/18/637288218.db2.gz VTQNNPXJIZJUCA-UHFFFAOYSA-N 0 3 298.377 2.768 20 10 CFCDHN COc1ccc(O)c(CNCc2ccnc(F)c2C)c1 ZINC000862278763 637309279 /nfs/dbraw/zinc/30/92/79/637309279.db2.gz KEGROQOELKOFQT-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN COc1cccc(CNCc2ccnc(F)c2C)c1O ZINC000862367382 637338846 /nfs/dbraw/zinc/33/88/46/637338846.db2.gz GWMFNSAKTVLPCW-UHFFFAOYSA-N 0 3 276.311 2.533 20 10 CFCDHN COC(=O)[C@H]1CN(Cc2ccccc2O)Cc2ccccc21 ZINC000862536989 637411318 /nfs/dbraw/zinc/41/13/18/637411318.db2.gz PDCLYUDEXJFRFV-INIZCTEOSA-N 0 3 297.354 2.665 20 10 CFCDHN COC(=O)[C@H]1C[N@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000862536989 637411321 /nfs/dbraw/zinc/41/13/21/637411321.db2.gz PDCLYUDEXJFRFV-INIZCTEOSA-N 0 3 297.354 2.665 20 10 CFCDHN COC(=O)[C@H]1C[N@@H+](Cc2ccccc2[O-])Cc2ccccc21 ZINC000862536989 637411326 /nfs/dbraw/zinc/41/13/26/637411326.db2.gz PDCLYUDEXJFRFV-INIZCTEOSA-N 0 3 297.354 2.665 20 10 CFCDHN CC[C@H]([NH2+]CC1(N)CCOCC1)c1cc(Cl)ccc1[O-] ZINC000863541352 637688798 /nfs/dbraw/zinc/68/87/98/637688798.db2.gz LEWWULCTRNKVMA-ZDUSSCGKSA-N 0 3 298.814 2.594 20 10 CFCDHN CCC[N@H+](CCOCC(F)F)Cc1ccccc1[O-] ZINC000189480798 650384356 /nfs/dbraw/zinc/38/43/56/650384356.db2.gz MDZPMHNRYJIGKH-UHFFFAOYSA-N 0 3 273.323 2.886 20 10 CFCDHN CCC[N@@H+](CCOCC(F)F)Cc1ccccc1[O-] ZINC000189480798 650384358 /nfs/dbraw/zinc/38/43/58/650384358.db2.gz MDZPMHNRYJIGKH-UHFFFAOYSA-N 0 3 273.323 2.886 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@H]1c2ccccc2CN1C ZINC000865807561 638584724 /nfs/dbraw/zinc/58/47/24/638584724.db2.gz VLJDDGCJVRETFU-INIZCTEOSA-N 0 3 298.386 2.677 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]CC[C@@H](O)C(F)F)c2c1c(F)ccc2[O-] ZINC000866442480 638821865 /nfs/dbraw/zinc/82/18/65/638821865.db2.gz MNUKUNCKGHBHMS-POZPLHJXSA-N 0 3 289.297 2.685 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]CC[C@@H](O)C1CCCC1)CC2 ZINC000866638437 638859522 /nfs/dbraw/zinc/85/95/22/638859522.db2.gz HTESZALNKXEJFD-LSDHHAIUSA-N 0 3 275.392 2.910 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H](C)c1cnn(C)c1 ZINC000122721849 639369870 /nfs/dbraw/zinc/36/98/70/639369870.db2.gz AKPRNSVJHKNVPS-ZDUSSCGKSA-N 0 3 272.396 2.645 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CC[C@](O)(C(F)(F)F)C2)c1 ZINC000191437978 650498970 /nfs/dbraw/zinc/49/89/70/650498970.db2.gz LDOINZVIPAKFSU-CYBMUJFWSA-N 0 3 289.297 2.508 20 10 CFCDHN Cc1ccccc1C[C@H](CO)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000191570076 650511455 /nfs/dbraw/zinc/51/14/55/650511455.db2.gz PHQQELTWXYLPED-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN C[C@@H](NCc1ccc(N2CCCC2)cc1)c1ccnn1C ZINC000192661709 650582611 /nfs/dbraw/zinc/58/26/11/650582611.db2.gz ZUTDDJVDMLOUSE-CQSZACIVSA-N 0 3 284.407 2.871 20 10 CFCDHN Cc1nccnc1[C@H](C)N[C@H]1CCc2cccc(O)c21 ZINC000872132851 641660429 /nfs/dbraw/zinc/66/04/29/641660429.db2.gz IBFFCTFLCQTUPW-AAEUAGOBSA-N 0 3 269.348 2.829 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3C[C@@H]4COC[C@@H]4C3)c2c1 ZINC000872783757 641938139 /nfs/dbraw/zinc/93/81/39/641938139.db2.gz ALSKXUCJMXPMJG-OKILXGFUSA-N 0 3 299.370 2.632 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3C[C@@H]4COC[C@@H]4C3)c2c1 ZINC000872783757 641938143 /nfs/dbraw/zinc/93/81/43/641938143.db2.gz ALSKXUCJMXPMJG-OKILXGFUSA-N 0 3 299.370 2.632 20 10 CFCDHN C[C@H](C[NH2+]Cc1cccc(Cl)c1[O-])CN1CCCC1 ZINC000124715963 642303095 /nfs/dbraw/zinc/30/30/95/642303095.db2.gz ZCNVTOSXOBDMMX-GFCCVEGCSA-N 0 3 282.815 2.867 20 10 CFCDHN Cc1ccc(C[N@H+](C[C@H]2CCOC2)C2CC2)c([O-])c1 ZINC000876570872 642928599 /nfs/dbraw/zinc/92/85/99/642928599.db2.gz PGXTXWHQVDDKOF-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c([O-])c1 ZINC000876570872 642928603 /nfs/dbraw/zinc/92/86/03/642928603.db2.gz PGXTXWHQVDDKOF-CYBMUJFWSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)cc2)c([O-])c1 ZINC000876879909 643047698 /nfs/dbraw/zinc/04/76/98/643047698.db2.gz DWUSFCGHQHIKTK-MRXNPFEDSA-N 0 3 275.323 2.663 20 10 CFCDHN Cc1ccc(C[NH2+]CCCOCC(C)C)c([O-])c1 ZINC000876901959 643058037 /nfs/dbraw/zinc/05/80/37/643058037.db2.gz JARWIPYJSONMON-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)C1CCCCC1 ZINC000877003973 643100319 /nfs/dbraw/zinc/10/03/19/643100319.db2.gz DZVMIWOBJDPJKZ-MRXNPFEDSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCc1nc(C(C)C)no1 ZINC000877007271 643102587 /nfs/dbraw/zinc/10/25/87/643102587.db2.gz JXCPORVFSBLTJQ-UHFFFAOYSA-N 0 3 289.379 2.929 20 10 CFCDHN Cc1ccccc1[C@H](O)C[NH2+]Cc1c(C)cccc1[O-] ZINC000877027539 643110371 /nfs/dbraw/zinc/11/03/71/643110371.db2.gz OFKCWLKDYFEYJY-QGZVFWFLSA-N 0 3 271.360 2.832 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc3c(c2)CCO3)c([O-])c1 ZINC000877035286 643113595 /nfs/dbraw/zinc/11/35/95/643113595.db2.gz DJRFOVRQVNBGGQ-UHFFFAOYSA-N 0 3 283.371 2.968 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H](CCO)c2ccccc2)c([O-])c1 ZINC000877055127 643124414 /nfs/dbraw/zinc/12/44/14/643124414.db2.gz NIFYHHRBYJZWBA-MRXNPFEDSA-N 0 3 285.387 2.956 20 10 CFCDHN CCC1(C[NH2+]Cc2c(C)cccc2[O-])CCOCC1 ZINC000877069124 643133446 /nfs/dbraw/zinc/13/34/46/643133446.db2.gz XEDMEPZEJSQFDT-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](C)c1ccncc1 ZINC000877074628 643137566 /nfs/dbraw/zinc/13/75/66/643137566.db2.gz CKEIHWXLECJXDJ-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN Cc1ccc(C[NH2+]C2(CCO)CCCCC2)c([O-])c1 ZINC000877080558 643140448 /nfs/dbraw/zinc/14/04/48/643140448.db2.gz DIDFMVRMJHTIKV-UHFFFAOYSA-N 0 3 263.381 2.876 20 10 CFCDHN Cc1ccc(C[NH2+]CCCc2ccccn2)c([O-])c1 ZINC000877116030 643159160 /nfs/dbraw/zinc/15/91/60/643159160.db2.gz OYYVKMBPNDORDU-UHFFFAOYSA-N 0 3 256.349 2.818 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccncc2C)c([O-])c1 ZINC000877117570 643159798 /nfs/dbraw/zinc/15/97/98/643159798.db2.gz JFTIWEUVSXYRHV-UHFFFAOYSA-N 0 3 256.349 2.736 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1cnc(C2CC2)nc1 ZINC000877124261 643163181 /nfs/dbraw/zinc/16/31/81/643163181.db2.gz UUPXZXDSBWSJNM-UHFFFAOYSA-N 0 3 283.375 2.700 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)c([O-])c1 ZINC000877126507 643165072 /nfs/dbraw/zinc/16/50/72/643165072.db2.gz MITNBDDSFXTIQO-FVQBIDKESA-N 0 3 273.376 2.748 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CC1([C@@H](C)CCO)CCC1 ZINC000877138116 643172432 /nfs/dbraw/zinc/17/24/32/643172432.db2.gz PAWUPQYVYNPDPR-AWEZNQCLSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cccc(NCC[NH2+]Cc2c(C)cccc2[O-])n1 ZINC000877157948 643181797 /nfs/dbraw/zinc/18/17/97/643181797.db2.gz MBLIHXUESGSRFJ-UHFFFAOYSA-N 0 3 271.364 2.606 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+](C)C[C@H]1CCCC[C@H]1O ZINC000877166952 643184837 /nfs/dbraw/zinc/18/48/37/643184837.db2.gz JKBIRTVQRCFGEL-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+](C)C[C@H]1CCCC[C@H]1O ZINC000877166952 643184841 /nfs/dbraw/zinc/18/48/41/643184841.db2.gz JKBIRTVQRCFGEL-UKRRQHHQSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c([O-])c1 ZINC000877308941 643231251 /nfs/dbraw/zinc/23/12/51/643231251.db2.gz DRGBTPLJTZHXJK-ZIAGYGMSSA-N 0 3 263.381 2.995 20 10 CFCDHN COCCC(C)(C)C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877350881 643246891 /nfs/dbraw/zinc/24/68/91/643246891.db2.gz XQGFNPTUVGQQFY-UHFFFAOYSA-N 0 3 251.370 2.853 20 10 CFCDHN Cc1cccc(O)c1CN1CCc2ncsc2C1 ZINC000877462729 643282715 /nfs/dbraw/zinc/28/27/15/643282715.db2.gz WPZKOCPOJBVRPZ-UHFFFAOYSA-N 0 3 260.362 2.715 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H](C)NC(=O)OC(C)(C)C)c([O-])c1 ZINC000877486136 643302027 /nfs/dbraw/zinc/30/20/27/643302027.db2.gz FFRZNIPXEOPDKM-LBPRGKRZSA-N 0 3 294.395 2.703 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)c2cnc(C)nc2C)c([O-])c1 ZINC000877493680 643307705 /nfs/dbraw/zinc/30/77/05/643307705.db2.gz ORNBBIRMLOKUEV-JTQLQIEISA-N 0 3 287.363 2.658 20 10 CFCDHN Cc1ccc(C[N@@H+](CC2CCC2)[C@H](C)CO)c([O-])c1 ZINC000877505422 643315259 /nfs/dbraw/zinc/31/52/59/643315259.db2.gz CURVTKOOKMWNSR-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[N@H+](CC2CCC2)[C@H](C)CO)c([O-])c1 ZINC000877505422 643315260 /nfs/dbraw/zinc/31/52/60/643315260.db2.gz CURVTKOOKMWNSR-CYBMUJFWSA-N 0 3 263.381 2.684 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)c([O-])c1 ZINC000877540286 643342276 /nfs/dbraw/zinc/34/22/76/643342276.db2.gz VLAKWTDZTSNZIS-MJGOQNOKSA-N 0 3 297.398 2.956 20 10 CFCDHN COCC1(CC[NH2+]Cc2ccc(C)cc2[O-])CCC1 ZINC000877550862 643350511 /nfs/dbraw/zinc/35/05/11/643350511.db2.gz OILNWVUOXCWYMN-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c([O-])c1 ZINC000877553630 643353336 /nfs/dbraw/zinc/35/33/36/643353336.db2.gz WOGIUPQZVUGJRI-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@](CO)(C(C)C)C2)c([O-])c1 ZINC000877553630 643353341 /nfs/dbraw/zinc/35/33/41/643353341.db2.gz WOGIUPQZVUGJRI-KRWDZBQOSA-N 0 3 277.408 2.931 20 10 CFCDHN Cc1cccc(O)c1CN1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000877555172 643354919 /nfs/dbraw/zinc/35/49/19/643354919.db2.gz RTVBHSFEPLWVHG-IAGOWNOFSA-N 0 3 273.376 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@@H](O)Cc1cccc(F)c1 ZINC000877556874 643358516 /nfs/dbraw/zinc/35/85/16/643358516.db2.gz LNYQUBFPZCLUFB-HNNXBMFYSA-N 0 3 289.350 2.533 20 10 CFCDHN CC[C@@H](C)[C@H](C[NH2+]Cc1c(C)cccc1[O-])OC ZINC000877558300 643358710 /nfs/dbraw/zinc/35/87/10/643358710.db2.gz CJFDGLISJNIZKW-ABAIWWIYSA-N 0 3 251.370 2.851 20 10 CFCDHN CO[C@H](C[NH2+]Cc1ccc(C)cc1[O-])CC(C)C ZINC000877591961 643384947 /nfs/dbraw/zinc/38/49/47/643384947.db2.gz CGRPSEZZCFCLIE-AWEZNQCLSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000877616851 643402172 /nfs/dbraw/zinc/40/21/72/643402172.db2.gz OYDSEGQNAATSRM-CYBMUJFWSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000877616851 643402176 /nfs/dbraw/zinc/40/21/76/643402176.db2.gz OYDSEGQNAATSRM-CYBMUJFWSA-N 0 3 253.292 2.932 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@H]1CCCc2c1ccc(=O)n2C ZINC000877617055 643404124 /nfs/dbraw/zinc/40/41/24/643404124.db2.gz RPQYJVPAJKYTKE-HNNXBMFYSA-N 0 3 298.386 2.567 20 10 CFCDHN CCOC(=O)[C@]1(C)CCC[C@H]1[NH2+]Cc1c(C)cccc1[O-] ZINC000877639926 643424574 /nfs/dbraw/zinc/42/45/74/643424574.db2.gz SDTWRAAHLFXEHN-NVXWUHKLSA-N 0 3 291.391 2.912 20 10 CFCDHN CCC[C@@H](C[NH2+]Cc1c(C)cccc1[O-])OCC ZINC000877649942 643431129 /nfs/dbraw/zinc/43/11/29/643431129.db2.gz LZWVRHVFTXDQDW-ZDUSSCGKSA-N 0 3 251.370 2.995 20 10 CFCDHN COC(=O)c1oc(CNCc2c(C)cccc2O)cc1C ZINC000877693775 643459481 /nfs/dbraw/zinc/45/94/81/643459481.db2.gz QRHJPVPBYHQGNH-UHFFFAOYSA-N 0 3 289.331 2.678 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877736350 643495177 /nfs/dbraw/zinc/49/51/77/643495177.db2.gz WASIYRFIGNWHEX-UONOGXRCSA-N 0 3 263.406 2.886 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]3CSC[C@H]3C2)c([O-])c1 ZINC000877736350 643495180 /nfs/dbraw/zinc/49/51/80/643495180.db2.gz WASIYRFIGNWHEX-UONOGXRCSA-N 0 3 263.406 2.886 20 10 CFCDHN CN(C)c1ccc(CN2CCC(C(C)(C)O)CC2)cc1F ZINC000877753872 643532231 /nfs/dbraw/zinc/53/22/31/643532231.db2.gz NPASQACLOHIYGT-UHFFFAOYSA-N 0 3 294.414 2.875 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2[O-])[C@@H]1SC ZINC000877756008 643535976 /nfs/dbraw/zinc/53/59/76/643535976.db2.gz YHMIDDJEMIHARF-BQPHKTIFSA-N 0 3 281.421 2.952 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc(Cl)n1C)c1ccccc1[O-] ZINC000877758067 643538548 /nfs/dbraw/zinc/53/85/48/643538548.db2.gz HRXMARXHAYOXHE-VIFPVBQESA-N 0 3 265.744 2.630 20 10 CFCDHN CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[O-])[C@H]1SC ZINC000877758398 643539130 /nfs/dbraw/zinc/53/91/30/643539130.db2.gz YHMIDDJEMIHARF-OBCWZRDOSA-N 0 3 281.421 2.952 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)c([O-])c1 ZINC000877807177 643569011 /nfs/dbraw/zinc/56/90/11/643569011.db2.gz VIHNVRDXKLIKNM-INWMFGNUSA-N 0 3 261.365 2.748 20 10 CFCDHN CCC[N@H+](CCc1cnccn1)Cc1ccccc1[O-] ZINC000878151163 643762141 /nfs/dbraw/zinc/76/21/41/643762141.db2.gz MTEWGZTYKHGNKX-UHFFFAOYSA-N 0 3 271.364 2.637 20 10 CFCDHN CCC[N@@H+](CCc1cnccn1)Cc1ccccc1[O-] ZINC000878151163 643762143 /nfs/dbraw/zinc/76/21/43/643762143.db2.gz MTEWGZTYKHGNKX-UHFFFAOYSA-N 0 3 271.364 2.637 20 10 CFCDHN CC(C)CNC(=O)CCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649171 644363157 /nfs/dbraw/zinc/36/31/57/644363157.db2.gz KIPKRFOSINFGMY-CYBMUJFWSA-N 0 3 278.396 2.595 20 10 CFCDHN C[C@H]([NH2+]CCCCCCCO)c1ccccc1[O-] ZINC000879651364 644364148 /nfs/dbraw/zinc/36/41/48/644364148.db2.gz SEUZHAMSIFGARF-ZDUSSCGKSA-N 0 3 251.370 2.986 20 10 CFCDHN CC(C)CC[C@@H](O)C[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879650537 644364607 /nfs/dbraw/zinc/36/46/07/644364607.db2.gz GOVCINZVSKVSAZ-QWHCGFSZSA-N 0 3 251.370 2.840 20 10 CFCDHN CC[C@H](C)[C@@H](O)C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000248493590 650936376 /nfs/dbraw/zinc/93/63/76/650936376.db2.gz KDLBLLPUBFJICM-ZOWXZIJZSA-N 0 3 251.370 2.758 20 10 CFCDHN CN(C)c1ccc(CN2CCc3ccccc3[C@@H]2CO)cc1 ZINC000093455174 650939932 /nfs/dbraw/zinc/93/99/32/650939932.db2.gz OHNVRSPUWUULQW-IBGZPJMESA-N 0 3 296.414 2.844 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCOC3(CCC3)C2)c1 ZINC000129628447 645296254 /nfs/dbraw/zinc/29/62/54/645296254.db2.gz RTBANCBDEWYFAN-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN C[C@H](C[NH2+]Cc1cc(F)cc(F)c1[O-])CN1CCCCC1 ZINC000882905178 645503675 /nfs/dbraw/zinc/50/36/75/645503675.db2.gz VSEFNZRLSHDVIM-GFCCVEGCSA-N 0 3 298.377 2.882 20 10 CFCDHN CCC[N@H+](C)CC(C)(C)NCc1cc(F)cc(F)c1[O-] ZINC000883182281 645646032 /nfs/dbraw/zinc/64/60/32/645646032.db2.gz YFJTUIAZIYFTPS-UHFFFAOYSA-N 0 3 286.366 2.880 20 10 CFCDHN CCC[N@@H+](C)CC(C)(C)NCc1cc(F)cc(F)c1[O-] ZINC000883182281 645646035 /nfs/dbraw/zinc/64/60/35/645646035.db2.gz YFJTUIAZIYFTPS-UHFFFAOYSA-N 0 3 286.366 2.880 20 10 CFCDHN CCN1CC[C@@H]1C[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000883354929 645759909 /nfs/dbraw/zinc/75/99/09/645759909.db2.gz FMARDRWERWHEBR-LOWVWBTDSA-N 0 3 278.371 2.763 20 10 CFCDHN COc1ccc(C[NH2+]Cc2ccccc2[O-])cc1F ZINC000134226059 646308530 /nfs/dbraw/zinc/30/85/30/646308530.db2.gz FYBMTCFEIQUNLR-UHFFFAOYSA-N 0 3 261.296 2.830 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC000886282544 646951619 /nfs/dbraw/zinc/95/16/19/646951619.db2.gz MOCMJVDZTXRWAX-RVMXOQNASA-N 0 3 261.365 2.783 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@H]2CC3(CCC3)CO2)c([O-])c1 ZINC000886289019 646955756 /nfs/dbraw/zinc/95/57/56/646955756.db2.gz MICMBWDVMDZDFR-OAHLLOKOSA-N 0 3 291.391 2.840 20 10 CFCDHN CC[C@H]([NH2+][C@@H](CO)C[C@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000886670676 647101740 /nfs/dbraw/zinc/10/17/40/647101740.db2.gz UFVRFMMKHMCGGL-FMKPAKJESA-N 0 3 293.407 2.671 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@]13CCC[C@H]1OCC3)CC2 ZINC000926917373 648657296 /nfs/dbraw/zinc/65/72/96/648657296.db2.gz ZXKAUBSITUYYOX-YSVLISHTSA-N 0 3 273.376 2.928 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2CC3(C2)OCCO3)c([O-])c1 ZINC000927004309 648680326 /nfs/dbraw/zinc/68/03/26/648680326.db2.gz RKLKFTHNWUGMRE-LBPRGKRZSA-N 0 3 277.364 2.504 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1cc(F)ccc1[O-] ZINC000927061690 648693861 /nfs/dbraw/zinc/69/38/61/648693861.db2.gz VUCYJJDNMJYIFQ-LHAJWOIZSA-N 0 3 295.354 2.864 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@H]2CCc3cccc([O-])c32)nc1 ZINC000927071669 648697878 /nfs/dbraw/zinc/69/78/78/648697878.db2.gz VCCRLYOMAWZRGZ-AWEZNQCLSA-N 0 3 283.375 2.785 20 10 CFCDHN CCC[N@H+](C/C(C)=C\C(=O)OC)Cc1ccccc1[O-] ZINC000929752903 649112141 /nfs/dbraw/zinc/11/21/41/649112141.db2.gz HTMIGJPURPBOQA-RAXLEYEMSA-N 0 3 277.364 2.724 20 10 CFCDHN CCC[N@@H+](C/C(C)=C\C(=O)OC)Cc1ccccc1[O-] ZINC000929752903 649112144 /nfs/dbraw/zinc/11/21/44/649112144.db2.gz HTMIGJPURPBOQA-RAXLEYEMSA-N 0 3 277.364 2.724 20 10 CFCDHN Cn1nc(CC[NH2+]Cc2cc(F)ccc2[O-])c2ccccc21 ZINC000187449476 649694963 /nfs/dbraw/zinc/69/49/63/649694963.db2.gz HBYKOLICEDWBQA-UHFFFAOYSA-N 0 3 299.349 2.750 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CC[C@@H](CO)CC2)c1[O-] ZINC000305802936 651082744 /nfs/dbraw/zinc/08/27/44/651082744.db2.gz YEFDCIRODFZXJV-VDISTLRHSA-N 0 3 283.799 2.995 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCO[C@@H]2CC2(F)F)c([O-])c1 ZINC000690730722 770806017 /nfs/dbraw/zinc/80/60/17/770806017.db2.gz KJYRQQMKBVHTOH-ZWNOBZJWSA-N 0 3 271.307 2.775 20 10 CFCDHN CCCC(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 ZINC001276991492 775255438 /nfs/dbraw/zinc/25/54/38/775255438.db2.gz JENPCIPCVXNUPR-UHFFFAOYSA-N 0 3 290.407 2.542 20 10 CFCDHN C[C@H](Cc1ccccn1)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000694086818 775360349 /nfs/dbraw/zinc/36/03/49/775360349.db2.gz ZZFCQGGAHQGDCI-DOMZBBRYSA-N 0 3 268.360 2.995 20 10 CFCDHN CN(C)c1ccc(CN2CCCC[C@H](O)C2)c(Cl)c1 ZINC001140922317 775650914 /nfs/dbraw/zinc/65/09/14/775650914.db2.gz NXFYQDLYRLQGMR-AWEZNQCLSA-N 0 3 282.815 2.753 20 10 CFCDHN C[C@@H]1[C@H](CO)CCN1Cc1ccc(N(C)C)cc1Cl ZINC001140921517 775651206 /nfs/dbraw/zinc/65/12/06/775651206.db2.gz GTQDWENQHMSQCE-YPMHNXCESA-N 0 3 282.815 2.609 20 10 CFCDHN CC(C)(C)OCCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000695264281 775754015 /nfs/dbraw/zinc/75/40/15/775754015.db2.gz YTLPEVMYEVROFZ-UHFFFAOYSA-N 0 3 255.333 2.826 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CC[C@H](C3CC3)O1)CC2 ZINC000722328698 776473657 /nfs/dbraw/zinc/47/36/57/776473657.db2.gz LDWQYTRBXNRWGA-IIAWOOMASA-N 0 3 273.376 2.927 20 10 CFCDHN C[N@H+](Cc1c[nH]c2cccnc12)Cc1ccccc1[O-] ZINC001231491785 777238290 /nfs/dbraw/zinc/23/82/90/777238290.db2.gz DVLIDNYROOUCQL-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN C[N@@H+](Cc1c[nH]c2cccnc12)Cc1ccccc1[O-] ZINC001231491785 777238297 /nfs/dbraw/zinc/23/82/97/777238297.db2.gz DVLIDNYROOUCQL-UHFFFAOYSA-N 0 3 267.332 2.901 20 10 CFCDHN CCCO[C@H]1CCN(Cc2ccc(N(C)C)cc2OC)C1 ZINC001231851742 777351992 /nfs/dbraw/zinc/35/19/92/777351992.db2.gz HBFRPMMTUXZGEI-INIZCTEOSA-N 0 3 292.423 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1CN1CC([NH+]2CCC(F)CC2)C1 ZINC001231912772 777380869 /nfs/dbraw/zinc/38/08/69/777380869.db2.gz YYIVSDCOWQRUGN-UHFFFAOYSA-N 0 3 298.789 2.664 20 10 CFCDHN CCN(Cc1c2ccccc2n(C)c1C(=O)OC)C1CC1 ZINC001232402483 777549485 /nfs/dbraw/zinc/54/94/85/777549485.db2.gz OGSNVIIVYFTPAG-UHFFFAOYSA-N 0 3 286.375 2.949 20 10 CFCDHN CN(CCc1ccc(F)cc1)Cc1cc(O)c(O)c(O)c1 ZINC001233013730 777763896 /nfs/dbraw/zinc/76/38/96/777763896.db2.gz SSJOTJUXAURJTR-UHFFFAOYSA-N 0 3 291.322 2.617 20 10 CFCDHN Oc1cc(CN2CCC[C@H]3CCC[C@H]32)cc(O)c1O ZINC001233017029 777765601 /nfs/dbraw/zinc/76/56/01/777765601.db2.gz QOHPKNJPDPUZLP-VXGBXAGGSA-N 0 3 263.337 2.568 20 10 CFCDHN CCN(Cc1cc(O)c(O)c(O)c1)Cc1ccccc1O ZINC001233016717 777766942 /nfs/dbraw/zinc/76/69/42/777766942.db2.gz LXWQZSBVYOIQGF-UHFFFAOYSA-N 0 3 289.331 2.531 20 10 CFCDHN Oc1cccc2c1CN(Cc1cnn3ccccc13)CC2 ZINC001233239687 777840763 /nfs/dbraw/zinc/84/07/63/777840763.db2.gz ONDOHHYPKJYPIU-UHFFFAOYSA-N 0 3 279.343 2.598 20 10 CFCDHN COc1cc(Cl)cc(C[NH+]2CCC3(COC3)CC2)c1[O-] ZINC001233287385 777867160 /nfs/dbraw/zinc/86/71/60/777867160.db2.gz NZYXMJHIXXLHJT-UHFFFAOYSA-N 0 3 297.782 2.667 20 10 CFCDHN CCN(Cc1ccc(F)cc1)Cc1cc(O)c(O)cc1O ZINC001233486449 777963883 /nfs/dbraw/zinc/96/38/83/777963883.db2.gz NKTFTIMRSUKGBZ-UHFFFAOYSA-N 0 3 291.322 2.965 20 10 CFCDHN C[C@@H]1Cc2ccccc2CN1Cc1cc(O)c(O)cc1O ZINC001233486384 777964276 /nfs/dbraw/zinc/96/42/76/777964276.db2.gz LIRJDSCWUZRSJL-LLVKDONJSA-N 0 3 285.343 2.750 20 10 CFCDHN CCc1cccc(CN(C)Cc2cccc(=O)[nH]2)c1O ZINC000897391036 778177862 /nfs/dbraw/zinc/17/78/62/778177862.db2.gz CBNCTPLAAFVQBV-UHFFFAOYSA-N 0 3 272.348 2.687 20 10 CFCDHN COc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccccc1[O-])C2 ZINC001168232313 778262735 /nfs/dbraw/zinc/26/27/35/778262735.db2.gz UCBVWPWATQVPBP-HNNXBMFYSA-N 0 3 269.344 2.658 20 10 CFCDHN CC[C@H](COC)Oc1ccc(N2CCN(CC)CC2)cc1 ZINC001234658089 778280046 /nfs/dbraw/zinc/28/00/46/778280046.db2.gz TXIXWXICEJLOQE-MRXNPFEDSA-N 0 3 292.423 2.632 20 10 CFCDHN CCOC(=O)c1cc(CN(C)Cc2ccccc2O)c[nH]1 ZINC001234948329 778337568 /nfs/dbraw/zinc/33/75/68/778337568.db2.gz BXCRPBBEMJRIKY-UHFFFAOYSA-N 0 3 288.347 2.529 20 10 CFCDHN [O-]c1c(CN2CCC[C@H]3[NH2+]C[C@@H]32)cccc1-c1ccccc1 ZINC001235303291 778450270 /nfs/dbraw/zinc/45/02/70/778450270.db2.gz KMJLCXOHCVIDJF-MSOLQXFVSA-N 0 3 294.398 2.995 20 10 CFCDHN Cc1cc([O-])c(CN2C[C@H](C)[NH2+]C[C@H]2C)cc1Cl ZINC001235450702 778493883 /nfs/dbraw/zinc/49/38/83/778493883.db2.gz UYZUYYMTJKMOAO-WDEREUQCSA-N 0 3 268.788 2.536 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@](C)(O)C2)c([O-])c1 ZINC001235674589 778532495 /nfs/dbraw/zinc/53/24/95/778532495.db2.gz GWQMEFMSTBHPCU-INIZCTEOSA-N 0 3 263.381 2.646 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@](C)(O)C2)c([O-])c1 ZINC001235674589 778532498 /nfs/dbraw/zinc/53/24/98/778532498.db2.gz GWQMEFMSTBHPCU-INIZCTEOSA-N 0 3 263.381 2.646 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1O ZINC001235676859 778533716 /nfs/dbraw/zinc/53/37/16/778533716.db2.gz WSYVVIUKJBXKNM-WBMJQRKESA-N 0 3 277.408 2.892 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2[O-])C[C@@H]1O ZINC001235676859 778533718 /nfs/dbraw/zinc/53/37/18/778533718.db2.gz WSYVVIUKJBXKNM-WBMJQRKESA-N 0 3 277.408 2.892 20 10 CFCDHN CCN(Cc1ccc(C(C)(C)C)cc1O)C1CN(C)C1 ZINC001235680139 778534344 /nfs/dbraw/zinc/53/43/44/778534344.db2.gz IUURHNGOJWJJDK-UHFFFAOYSA-N 0 3 276.424 2.826 20 10 CFCDHN CC(C)C[C@H]1CN(Cc2cc(Cl)ccc2[O-])CC[NH2+]1 ZINC001235877943 778587765 /nfs/dbraw/zinc/58/77/65/778587765.db2.gz FOPWKHWKYPXSKL-AWEZNQCLSA-N 0 3 282.815 2.866 20 10 CFCDHN Cc1cc([O-])c(CN(C2CC2)[C@@H]2CC[NH2+]C2)cc1Cl ZINC001236528933 778862748 /nfs/dbraw/zinc/86/27/48/778862748.db2.gz MTNWWMXPBKIDDG-CYBMUJFWSA-N 0 3 280.799 2.680 20 10 CFCDHN CC[C@H]([NH2+]CCO[C@@H]1CC1(F)F)c1ccccc1[O-] ZINC000690732698 778921957 /nfs/dbraw/zinc/92/19/57/778921957.db2.gz SNKCFQHOXORJSR-WCQYABFASA-N 0 3 271.307 2.857 20 10 CFCDHN CC[N@H+](C)Cc1cc(OC)c(Br)cc1[O-] ZINC001236744427 778927682 /nfs/dbraw/zinc/92/76/82/778927682.db2.gz BTPMTBXPPRVZBI-UHFFFAOYSA-N 0 3 274.158 2.615 20 10 CFCDHN CC[N@@H+](C)Cc1cc(OC)c(Br)cc1[O-] ZINC001236744427 778927685 /nfs/dbraw/zinc/92/76/85/778927685.db2.gz BTPMTBXPPRVZBI-UHFFFAOYSA-N 0 3 274.158 2.615 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@H](C)[C@@](C)(O)C2)c([O-])c1 ZINC001236784412 778935712 /nfs/dbraw/zinc/93/57/12/778935712.db2.gz WRWXUDGZRSWSHQ-WBMJQRKESA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@H](C)[C@@](C)(O)C2)c([O-])c1 ZINC001236784412 778935717 /nfs/dbraw/zinc/93/57/17/778935717.db2.gz WRWXUDGZRSWSHQ-WBMJQRKESA-N 0 3 263.381 2.547 20 10 CFCDHN CCc1ccc(C[N@H+](C)[C@@H]2CCC3(C2)OCCO3)c([O-])c1 ZINC001236786711 778936707 /nfs/dbraw/zinc/93/67/07/778936707.db2.gz DSSSGRBWBVBFGK-OAHLLOKOSA-N 0 3 291.391 2.682 20 10 CFCDHN CCc1ccc(C[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c([O-])c1 ZINC001236786711 778936710 /nfs/dbraw/zinc/93/67/10/778936710.db2.gz DSSSGRBWBVBFGK-OAHLLOKOSA-N 0 3 291.391 2.682 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@]3(CCC(=O)O3)C2)c([O-])c1 ZINC001236791742 778937500 /nfs/dbraw/zinc/93/75/00/778937500.db2.gz JNRDULUBGWYTQP-KRWDZBQOSA-N 0 3 289.375 2.626 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@]3(CCC(=O)O3)C2)c([O-])c1 ZINC001236791742 778937505 /nfs/dbraw/zinc/93/75/05/778937505.db2.gz JNRDULUBGWYTQP-KRWDZBQOSA-N 0 3 289.375 2.626 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C(=O)OC)[C@@H]2C)c([O-])c1 ZINC001236794239 778939881 /nfs/dbraw/zinc/93/98/81/778939881.db2.gz JYTIBKYEILUETG-SWLSCSKDSA-N 0 3 291.391 2.728 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C(=O)OC)[C@@H]2C)c([O-])c1 ZINC001236794239 778939883 /nfs/dbraw/zinc/93/98/83/778939883.db2.gz JYTIBKYEILUETG-SWLSCSKDSA-N 0 3 291.391 2.728 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+]1Cc1c(C)cc(OC)cc1[O-] ZINC001236808414 778948121 /nfs/dbraw/zinc/94/81/21/778948121.db2.gz PBFFSVCGJOURBZ-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN COC[C@@H]1CCCC[N@H+]1Cc1c(C)cc(OC)cc1[O-] ZINC001236808414 778948122 /nfs/dbraw/zinc/94/81/22/778948122.db2.gz PBFFSVCGJOURBZ-ZDUSSCGKSA-N 0 3 279.380 2.710 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001236808084 778949250 /nfs/dbraw/zinc/94/92/50/778949250.db2.gz LYTIXPIDTNMWFA-KRWDZBQOSA-N 0 3 293.407 2.694 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CCC[C@](C)(CO)CC2)c([O-])c1 ZINC001236808084 778949258 /nfs/dbraw/zinc/94/92/58/778949258.db2.gz LYTIXPIDTNMWFA-KRWDZBQOSA-N 0 3 293.407 2.694 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[NH+]1CC2(C1)CCOC2 ZINC001236826173 778955312 /nfs/dbraw/zinc/95/53/12/778955312.db2.gz HRDKWHVZLDPOAW-UHFFFAOYSA-N 0 3 269.344 2.768 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC[C@@H](O)C1 ZINC001236828085 778956564 /nfs/dbraw/zinc/95/65/64/778956564.db2.gz ZTFNLDGKBZTHOF-MRXNPFEDSA-N 0 3 271.360 2.892 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC[C@@H](O)C1 ZINC001236828085 778956566 /nfs/dbraw/zinc/95/65/66/778956566.db2.gz ZTFNLDGKBZTHOF-MRXNPFEDSA-N 0 3 271.360 2.892 20 10 CFCDHN C[C@]1(O)CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236828054 778956954 /nfs/dbraw/zinc/95/69/54/778956954.db2.gz ZCNQXTUHSSFHCR-INIZCTEOSA-N 0 3 257.333 2.502 20 10 CFCDHN C[C@]1(O)CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236828054 778956963 /nfs/dbraw/zinc/95/69/63/778956963.db2.gz ZCNQXTUHSSFHCR-INIZCTEOSA-N 0 3 257.333 2.502 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CCCC12COC2 ZINC001236839383 778961753 /nfs/dbraw/zinc/96/17/53/778961753.db2.gz FWQVEKNGSDCTBM-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CCCC12COC2 ZINC001236839383 778961758 /nfs/dbraw/zinc/96/17/58/778961758.db2.gz FWQVEKNGSDCTBM-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN Oc1cc2ccccc2cc1CN1CCCC12COC2 ZINC001236839383 778961765 /nfs/dbraw/zinc/96/17/65/778961765.db2.gz FWQVEKNGSDCTBM-UHFFFAOYSA-N 0 3 269.344 2.910 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001237044325 778996982 /nfs/dbraw/zinc/99/69/82/778996982.db2.gz BULCWISMWLTTKD-GJZGRUSLSA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001237044325 778996985 /nfs/dbraw/zinc/99/69/85/778996985.db2.gz BULCWISMWLTTKD-GJZGRUSLSA-N 0 3 281.371 2.810 20 10 CFCDHN CCOc1ccc(C[NH+]2CCC3(CCOC3)CC2)c([O-])c1 ZINC001237043857 778997538 /nfs/dbraw/zinc/99/75/38/778997538.db2.gz JVCLUWWKEIZOLH-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@@H](O)CC2)c([O-])c1 ZINC001237044324 778997600 /nfs/dbraw/zinc/99/76/00/778997600.db2.gz BULCWISMWLTTKD-CABCVRRESA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@@H](F)[C@@H](O)CC2)c([O-])c1 ZINC001237044324 778997602 /nfs/dbraw/zinc/99/76/02/778997602.db2.gz BULCWISMWLTTKD-CABCVRRESA-N 0 3 281.371 2.810 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCO[C@@H]3C2)c([O-])c1 ZINC001237048965 778998505 /nfs/dbraw/zinc/99/85/05/778998505.db2.gz KHXWSEFPCBKQOJ-GOEBONIOSA-N 0 3 261.365 2.736 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2C[C@@H]3CCO[C@@H]3C2)c([O-])c1 ZINC001237048965 778998511 /nfs/dbraw/zinc/99/85/11/778998511.db2.gz KHXWSEFPCBKQOJ-GOEBONIOSA-N 0 3 261.365 2.736 20 10 CFCDHN COC(=O)C1CC[NH+](Cc2ccc(C(C)C)cc2[O-])CC1 ZINC001237052733 779001095 /nfs/dbraw/zinc/00/10/95/779001095.db2.gz ZFEDCXKSYMMTDG-UHFFFAOYSA-N 0 3 291.391 2.901 20 10 CFCDHN CCN(Cc1ccc(C(C)C)cc1O)C1CN(C)C1 ZINC001237054544 779001704 /nfs/dbraw/zinc/00/17/04/779001704.db2.gz CHUTVCBQJJWMBM-UHFFFAOYSA-N 0 3 262.397 2.652 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@@H](O)C1 ZINC001237135306 779023597 /nfs/dbraw/zinc/02/35/97/779023597.db2.gz HPYGSMORZRIXKX-GFCCVEGCSA-N 0 3 289.297 2.758 20 10 CFCDHN [O-]c1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@@H](O)C1 ZINC001237135306 779023601 /nfs/dbraw/zinc/02/36/01/779023601.db2.gz HPYGSMORZRIXKX-GFCCVEGCSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@]1(O)CCCN(Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237141522 779024966 /nfs/dbraw/zinc/02/49/66/779024966.db2.gz YAGSIZHIBAZGTP-ZDUSSCGKSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@]1(O)CCC[N@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237141522 779024974 /nfs/dbraw/zinc/02/49/74/779024974.db2.gz YAGSIZHIBAZGTP-ZDUSSCGKSA-N 0 3 289.297 2.758 20 10 CFCDHN C[C@]1(O)CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2[O-])C1 ZINC001237141522 779024983 /nfs/dbraw/zinc/02/49/83/779024983.db2.gz YAGSIZHIBAZGTP-ZDUSSCGKSA-N 0 3 289.297 2.758 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@H]2O[C@@H](C)C[C@H]2C1 ZINC001237486178 779118083 /nfs/dbraw/zinc/11/80/83/779118083.db2.gz OXTNBIKCXOPVOI-HEHGZKQESA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@H]2O[C@@H](C)C[C@H]2C1 ZINC001237486178 779118087 /nfs/dbraw/zinc/11/80/87/779118087.db2.gz OXTNBIKCXOPVOI-HEHGZKQESA-N 0 3 261.365 2.700 20 10 CFCDHN Cc1cccc(O)c1C[N@@H+]1CCc2cccc([O-])c2C1 ZINC001237491215 779118847 /nfs/dbraw/zinc/11/88/47/779118847.db2.gz JENMZOCVWUDWMA-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN Cc1cccc(O)c1C[N@H+]1CCc2cccc([O-])c2C1 ZINC001237491215 779118849 /nfs/dbraw/zinc/11/88/49/779118849.db2.gz JENMZOCVWUDWMA-UHFFFAOYSA-N 0 3 269.344 2.965 20 10 CFCDHN COC(=O)Cc1cccc(C[N@H+](C)Cc2ccccc2[O-])c1 ZINC001237489101 779119012 /nfs/dbraw/zinc/11/90/12/779119012.db2.gz YVAFBJYRRRRZAJ-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN COC(=O)Cc1cccc(C[N@@H+](C)Cc2ccccc2[O-])c1 ZINC001237489101 779119016 /nfs/dbraw/zinc/11/90/16/779119016.db2.gz YVAFBJYRRRRZAJ-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN CCCCOC(=O)[C@H]1CC[N@H+](Cc2c(C)cccc2[O-])C1 ZINC001237494777 779120583 /nfs/dbraw/zinc/12/05/83/779120583.db2.gz LKAFBQGYZKRYSS-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN CCCCOC(=O)[C@H]1CC[N@@H+](Cc2c(C)cccc2[O-])C1 ZINC001237494777 779120584 /nfs/dbraw/zinc/12/05/84/779120584.db2.gz LKAFBQGYZKRYSS-AWEZNQCLSA-N 0 3 291.391 2.866 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H](O)C2)c1[O-] ZINC001237680766 779159938 /nfs/dbraw/zinc/15/99/38/779159938.db2.gz HDGHMDOXNZPIEW-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H](O)C2)c1[O-] ZINC001237680766 779159941 /nfs/dbraw/zinc/15/99/41/779159941.db2.gz HDGHMDOXNZPIEW-CYBMUJFWSA-N 0 3 269.772 2.701 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(CCOC3)CC2)c1[O-] ZINC001238055708 779240977 /nfs/dbraw/zinc/24/09/77/779240977.db2.gz CGZAVYHEFDRHFZ-UHFFFAOYSA-N 0 3 279.355 2.842 20 10 CFCDHN CC[N@H+](Cc1cc(F)cc(C)c1[O-])C1CCOCC1 ZINC001238062954 779242567 /nfs/dbraw/zinc/24/25/67/779242567.db2.gz VAWUIESAUYWJIQ-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN CC[N@@H+](Cc1cc(F)cc(C)c1[O-])C1CCOCC1 ZINC001238062954 779242571 /nfs/dbraw/zinc/24/25/71/779242571.db2.gz VAWUIESAUYWJIQ-UHFFFAOYSA-N 0 3 267.344 2.841 20 10 CFCDHN CC(=O)[C@@H]1CCCN(Cc2cc(F)cc(C)c2O)C1 ZINC001238070040 779245131 /nfs/dbraw/zinc/24/51/31/779245131.db2.gz MHFJVVWJFWDYGR-GFCCVEGCSA-N 0 3 265.328 2.641 20 10 CFCDHN C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccccc1[O-] ZINC000690299831 779821977 /nfs/dbraw/zinc/82/19/77/779821977.db2.gz NXWMOMPDSFRQNQ-STQMWFEESA-N 0 3 262.397 2.916 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2nnc3ccccn32)c([O-])c1 ZINC000387049260 779942459 /nfs/dbraw/zinc/94/24/59/779942459.db2.gz NECSEWPYCPZNKE-CYBMUJFWSA-N 0 3 296.374 2.637 20 10 CFCDHN Cn1ccc2ccc(-c3cccnc3OC3CNC3)cc21 ZINC001240576638 780267557 /nfs/dbraw/zinc/26/75/57/780267557.db2.gz UUHXISBUSUOVLH-UHFFFAOYSA-N 0 3 279.343 2.591 20 10 CFCDHN CC(C)(C)c1cccc(CN2CC3(CC(O)C3)C2)c1O ZINC001143103604 780386286 /nfs/dbraw/zinc/38/62/86/780386286.db2.gz GVMCLONSZKOSSJ-UHFFFAOYSA-N 0 3 275.392 2.646 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2C=CCC2)c1[O-] ZINC000700587415 780701547 /nfs/dbraw/zinc/70/15/47/780701547.db2.gz SBZORZZZXYZAFE-NSHDSACASA-N 0 3 253.729 2.862 20 10 CFCDHN [O-]c1cccc(F)c1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001137837459 781139866 /nfs/dbraw/zinc/13/98/66/781139866.db2.gz HWAKWHTWMXQDDO-AWEZNQCLSA-N 0 3 273.311 2.658 20 10 CFCDHN [O-]c1cccc(F)c1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001137837459 781139870 /nfs/dbraw/zinc/13/98/70/781139870.db2.gz HWAKWHTWMXQDDO-AWEZNQCLSA-N 0 3 273.311 2.658 20 10 CFCDHN Oc1cccc(F)c1CN1CCC[C@H]1c1cnccn1 ZINC001137837459 781139872 /nfs/dbraw/zinc/13/98/72/781139872.db2.gz HWAKWHTWMXQDDO-AWEZNQCLSA-N 0 3 273.311 2.658 20 10 CFCDHN CO[C@H]1C[C@@H](C[NH2+][C@H](C)c2cc(F)ccc2[O-])C1 ZINC000708695540 781277412 /nfs/dbraw/zinc/27/74/12/781277412.db2.gz CAVBILPZOFMRTD-FOGDFJRCSA-N 0 3 253.317 2.607 20 10 CFCDHN C[C@H]([NH2+]CCc1ccns1)c1cc(F)ccc1[O-] ZINC000710028447 781326489 /nfs/dbraw/zinc/32/64/89/781326489.db2.gz UWVVMJGXVQOUFO-VIFPVBQESA-N 0 3 266.341 2.881 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H](C2CCC2)[C@H]2CCOC2)c1 ZINC000711869012 781482919 /nfs/dbraw/zinc/48/29/19/781482919.db2.gz JDJZRHDGMLEARP-WMLDXEAASA-N 0 3 275.392 2.995 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297504922 282261722 /nfs/dbraw/zinc/26/17/22/282261722.db2.gz CFEXUEOUYNVTGE-CQSZACIVSA-N 0 3 271.364 2.520 20 10 CFCDHN CO[C@H](CNCc1ccc(N(C)C)c(F)c1)C(C)C ZINC000072924815 346949339 /nfs/dbraw/zinc/94/93/39/346949339.db2.gz XTLICQWAHUKCHW-OAHLLOKOSA-N 0 3 268.376 2.652 20 10 CFCDHN CCOc1cccc(C[NH2+]CCc2scnc2C)c1[O-] ZINC000295080221 199334064 /nfs/dbraw/zinc/33/40/64/199334064.db2.gz RWWBHOYBWCTAAB-UHFFFAOYSA-N 0 3 292.404 2.888 20 10 CFCDHN COc1cccc(CN(C)[C@@H](CO)c2ccccc2)c1O ZINC000295086376 199338058 /nfs/dbraw/zinc/33/80/58/199338058.db2.gz RBFANWYKZAYIQU-HNNXBMFYSA-N 0 3 287.359 2.566 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]CC[C@H](C)CCO)c1[O-] ZINC000295122762 199357485 /nfs/dbraw/zinc/35/74/85/199357485.db2.gz NLTPCFVQOTTXBA-JTQLQIEISA-N 0 3 271.788 2.852 20 10 CFCDHN CCN(C(=O)c1cccc2c1CCNC2)c1ccccc1 ZINC000124101605 539524141 /nfs/dbraw/zinc/52/41/41/539524141.db2.gz LWRAFPKLPRULNU-UHFFFAOYSA-N 0 3 280.371 2.999 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CC[C@@H](C)CCO)cc1C ZINC000295127471 199358965 /nfs/dbraw/zinc/35/89/65/199358965.db2.gz OARGAGNLTKSPGF-LLVKDONJSA-N 0 3 251.370 2.507 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CCCO)CC(C)(C)C)c1 ZINC000093146312 347663095 /nfs/dbraw/zinc/66/30/95/347663095.db2.gz FTXUBIXUNPFNNN-UHFFFAOYSA-N 0 3 265.397 2.931 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CCCO)CC(C)(C)C)c1 ZINC000093146312 347663097 /nfs/dbraw/zinc/66/30/97/347663097.db2.gz FTXUBIXUNPFNNN-UHFFFAOYSA-N 0 3 265.397 2.931 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1 ZINC000294703755 199142471 /nfs/dbraw/zinc/14/24/71/199142471.db2.gz BADJWPWWUKRLAH-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c1 ZINC000294703755 199142472 /nfs/dbraw/zinc/14/24/72/199142472.db2.gz BADJWPWWUKRLAH-CQSZACIVSA-N 0 3 293.407 2.774 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@@H](C)CCCO)c1[O-] ZINC000294915816 199245791 /nfs/dbraw/zinc/24/57/91/199245791.db2.gz YJHCKSLBPWCTAJ-JTQLQIEISA-N 0 3 271.788 2.852 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@H](O)C(F)F ZINC000296329425 199856683 /nfs/dbraw/zinc/85/66/83/199856683.db2.gz HEXYBGPQQKPGLR-VHRDEZTHSA-N 0 3 277.286 2.587 20 10 CFCDHN C[C@@](O)(C[NH2+][C@H]1CCc2cccc([O-])c21)c1ccccc1 ZINC000297583642 200233977 /nfs/dbraw/zinc/23/39/77/200233977.db2.gz HGCVTJJUYHEIJH-MAUKXSAKSA-N 0 3 283.371 2.877 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297645799 200251162 /nfs/dbraw/zinc/25/11/62/200251162.db2.gz JYIPDYGRTHYCNK-JSGCOSHPSA-N 0 3 263.381 2.768 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCc2ccccn2)c([O-])c1 ZINC000020089271 372227214 /nfs/dbraw/zinc/22/72/14/372227214.db2.gz RYJJJKBBJXOIOS-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCc2ccccc2)c1 ZINC000020089870 372228256 /nfs/dbraw/zinc/22/82/56/372228256.db2.gz IYNDLTSFUONEAB-UHFFFAOYSA-N 0 3 257.333 2.733 20 10 CFCDHN C[C@H](CN1CCCCC1)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000037154259 372657801 /nfs/dbraw/zinc/65/78/01/372657801.db2.gz BMHHXGBJBXNVIP-KGLIPLIRSA-N 0 3 262.397 2.917 20 10 CFCDHN CCN(CC)CCC[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000062744885 373765125 /nfs/dbraw/zinc/76/51/25/373765125.db2.gz WGQKDNRQHBAELM-GFCCVEGCSA-N 0 3 268.376 2.914 20 10 CFCDHN CC[NH+](CC)CCCN[C@H](C)c1ccc(F)cc1[O-] ZINC000062744885 373765133 /nfs/dbraw/zinc/76/51/33/373765133.db2.gz WGQKDNRQHBAELM-GFCCVEGCSA-N 0 3 268.376 2.914 20 10 CFCDHN CCCCOCCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000083410762 374742493 /nfs/dbraw/zinc/74/24/93/374742493.db2.gz ULLNUGQGEPVKSS-UHFFFAOYSA-N 0 3 255.333 2.828 20 10 CFCDHN Cc1cccc(C[NH2+]CCc2ccc(O)cc2)c1[O-] ZINC000083422086 374743950 /nfs/dbraw/zinc/74/39/50/374743950.db2.gz FNQOCKOHICVUDH-UHFFFAOYSA-N 0 3 257.333 2.739 20 10 CFCDHN COc1ccc(C[NH2+]Cc2cccc(C)c2[O-])cc1 ZINC000083422071 374744201 /nfs/dbraw/zinc/74/42/01/374744201.db2.gz ICGFDAAUKLZQAS-UHFFFAOYSA-N 0 3 257.333 2.999 20 10 CFCDHN CCOc1ccc(O)c(CN(C)C[C@@H]2CCCCO2)c1 ZINC000092428650 375112437 /nfs/dbraw/zinc/11/24/37/375112437.db2.gz NHQUXEPKKIVHQE-HNNXBMFYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[NH+]2CCC(COC)CC2)c1 ZINC000093103777 375189863 /nfs/dbraw/zinc/18/98/63/375189863.db2.gz RUEUBIQMHZIVPJ-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@H](COC)C2)c1 ZINC000093338033 375215118 /nfs/dbraw/zinc/21/51/18/375215118.db2.gz WEKRQGBYWDCJIZ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@H](COC)C2)c1 ZINC000093338033 375215122 /nfs/dbraw/zinc/21/51/22/375215122.db2.gz WEKRQGBYWDCJIZ-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](CCC(=O)OC)C(C)C)c1 ZINC000093384064 375226432 /nfs/dbraw/zinc/22/64/32/375226432.db2.gz DFUSRYOFHMRPPU-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](CCC(=O)OC)C(C)C)c1 ZINC000093384064 375226440 /nfs/dbraw/zinc/22/64/40/375226440.db2.gz DFUSRYOFHMRPPU-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CN(C)c1ccc(CN[C@H](CCO)c2ccccc2)cc1 ZINC000124453337 377052877 /nfs/dbraw/zinc/05/28/77/377052877.db2.gz OWDCEGVRRSHFMH-GOSISDBHSA-N 0 3 284.403 2.966 20 10 CFCDHN Cc1cnn(CCN[C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000123948792 376999731 /nfs/dbraw/zinc/99/97/31/376999731.db2.gz OCAVTJXWWLZFOZ-AWEZNQCLSA-N 0 3 272.396 2.608 20 10 CFCDHN Oc1cc2c(cc1CN1CCC[C@@H]1c1ccc[nH]1)OCO2 ZINC000127502531 377286455 /nfs/dbraw/zinc/28/64/55/377286455.db2.gz AOWYCILCQBMQIA-CYBMUJFWSA-N 0 3 286.331 2.786 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@H]2CCCO2)c1[O-] ZINC000132668972 377865427 /nfs/dbraw/zinc/86/54/27/377865427.db2.gz RQFFFHIGXZRQQW-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@H]2CCCO2)c1[O-] ZINC000132668972 377865431 /nfs/dbraw/zinc/86/54/31/377865431.db2.gz RQFFFHIGXZRQQW-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000134625639 378039388 /nfs/dbraw/zinc/03/93/88/378039388.db2.gz ZRVBQGYRWVCDLM-IJEWVQPXSA-N 0 3 274.408 2.730 20 10 CFCDHN CC[C@H]([NH2+]CCNC(=O)c1ccccc1)c1ccccc1[O-] ZINC000155399750 378625301 /nfs/dbraw/zinc/62/53/01/378625301.db2.gz HQVJEARPBNQHMX-INIZCTEOSA-N 0 3 298.386 2.863 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CC[C@H]2CCCOC2)c1[O-] ZINC000529637069 383739364 /nfs/dbraw/zinc/73/93/64/383739364.db2.gz NIAYJPKSENAWPP-LLVKDONJSA-N 0 3 299.798 2.961 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC3(CCCC3)C1)OCO2 ZINC000173439948 379738741 /nfs/dbraw/zinc/73/87/41/379738741.db2.gz FZOSKXLSSPTJCQ-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC3(CCCC3)C1)OCO2 ZINC000173439948 379738747 /nfs/dbraw/zinc/73/87/47/379738747.db2.gz FZOSKXLSSPTJCQ-UHFFFAOYSA-N 0 3 275.348 2.887 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CCOC2)c1[O-] ZINC000180624880 380683467 /nfs/dbraw/zinc/68/34/67/380683467.db2.gz DRIKKRBAEZFLKQ-NSHDSACASA-N 0 3 269.772 2.822 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H]2CCOC2)c1[O-] ZINC000180624880 380683474 /nfs/dbraw/zinc/68/34/74/380683474.db2.gz DRIKKRBAEZFLKQ-NSHDSACASA-N 0 3 269.772 2.822 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccc(F)cc1 ZINC000180900343 380710354 /nfs/dbraw/zinc/71/03/54/380710354.db2.gz SWZYRVJZSUCFOR-INIZCTEOSA-N 0 3 293.313 2.668 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1ccsc1 ZINC000180774745 380697315 /nfs/dbraw/zinc/69/73/15/380697315.db2.gz PAADLFWSIOQNGC-AWEZNQCLSA-N 0 3 281.352 2.590 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1cc(F)ccc1[O-])c1cccs1 ZINC000180772672 380697530 /nfs/dbraw/zinc/69/75/30/380697530.db2.gz ZCGVUXQEABETSD-CQSZACIVSA-N 0 3 281.352 2.590 20 10 CFCDHN Cc1ccc(C[N@H+](CCO)Cc2cc(F)ccc2[O-])cc1 ZINC000180845622 380706152 /nfs/dbraw/zinc/70/61/52/380706152.db2.gz UAYYHFIZYRLTMK-UHFFFAOYSA-N 0 3 289.350 2.834 20 10 CFCDHN Cc1ccc(C[N@@H+](CCO)Cc2cc(F)ccc2[O-])cc1 ZINC000180845622 380706157 /nfs/dbraw/zinc/70/61/57/380706157.db2.gz UAYYHFIZYRLTMK-UHFFFAOYSA-N 0 3 289.350 2.834 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC=C(c3ccnn3C)CC2)c1 ZINC000289110113 381024658 /nfs/dbraw/zinc/02/46/58/381024658.db2.gz CTBFQDISRCPRNI-UHFFFAOYSA-N 0 3 283.375 2.723 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC=C(c3ccnn3C)CC2)c1 ZINC000289110113 381024667 /nfs/dbraw/zinc/02/46/67/381024667.db2.gz CTBFQDISRCPRNI-UHFFFAOYSA-N 0 3 283.375 2.723 20 10 CFCDHN Cc1ccc(O)c(CN2CC=C(c3ccnn3C)CC2)c1 ZINC000289110113 381024675 /nfs/dbraw/zinc/02/46/75/381024675.db2.gz CTBFQDISRCPRNI-UHFFFAOYSA-N 0 3 283.375 2.723 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCOC[C@@H]2C)c1[O-] ZINC000289207561 381028477 /nfs/dbraw/zinc/02/84/77/381028477.db2.gz BTQPBAVPFGQBEP-WDEREUQCSA-N 0 3 299.798 2.816 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCOC[C@H]2C)c1[O-] ZINC000289207553 381028818 /nfs/dbraw/zinc/02/88/18/381028818.db2.gz BTQPBAVPFGQBEP-GHMZBOCLSA-N 0 3 299.798 2.816 20 10 CFCDHN C[N@@H+]1CC[C@]2(CCN(Cc3cc(Cl)ccc3[O-])C2)C1 ZINC000368318455 380990336 /nfs/dbraw/zinc/99/03/36/380990336.db2.gz SGXNPNMAUIDJPF-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN C[N@H+]1CC[C@]2(CCN(Cc3cc(Cl)ccc3[O-])C2)C1 ZINC000368318455 380990342 /nfs/dbraw/zinc/99/03/42/380990342.db2.gz SGXNPNMAUIDJPF-HNNXBMFYSA-N 0 3 280.799 2.573 20 10 CFCDHN COc1cc([O-])c(C[NH2+][C@@H](C)CC(C)(C)OC)cc1OC ZINC000182478157 381096132 /nfs/dbraw/zinc/09/61/32/381096132.db2.gz FYQWHKLKUPIXEL-NSHDSACASA-N 0 3 297.395 2.703 20 10 CFCDHN Cc1n[nH]cc1CCC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000295861585 381122915 /nfs/dbraw/zinc/12/29/15/381122915.db2.gz GOHMIDODKWTGBM-CQSZACIVSA-N 0 3 271.364 2.633 20 10 CFCDHN Cc1ncccc1O[C@@H]1CC[N@H+](Cc2ccccc2[O-])C1 ZINC000368977817 381171882 /nfs/dbraw/zinc/17/18/82/381171882.db2.gz KRCIIUXKZKCLAS-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ncccc1O[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C1 ZINC000368977817 381171888 /nfs/dbraw/zinc/17/18/88/381171888.db2.gz KRCIIUXKZKCLAS-OAHLLOKOSA-N 0 3 284.359 2.749 20 10 CFCDHN CCN(CC)C(=O)CCC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000296095513 381253098 /nfs/dbraw/zinc/25/30/98/381253098.db2.gz UCVKTKUGYYTNEO-AWEZNQCLSA-N 0 3 290.407 2.618 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)c1ccccc1[O-] ZINC000183628792 381296591 /nfs/dbraw/zinc/29/65/91/381296591.db2.gz HZLWTVWHFVZOPA-ZIAGYGMSSA-N 0 3 283.375 2.717 20 10 CFCDHN COc1ccccc1[C@@H](O)C[NH2+][C@H](C)c1ccccc1[O-] ZINC000183436241 381271277 /nfs/dbraw/zinc/27/12/77/381271277.db2.gz AGQIBNCQEWRLKN-WBMJQRKESA-N 0 3 287.359 2.785 20 10 CFCDHN C[C@H]([NH2+]CCC(=O)NC1CCCCC1)c1ccccc1[O-] ZINC000183434950 381271427 /nfs/dbraw/zinc/27/14/27/381271427.db2.gz OKENFFRTNMNBIZ-ZDUSSCGKSA-N 0 3 290.407 2.882 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1ccccc1[O-] ZINC000183484925 381276719 /nfs/dbraw/zinc/27/67/19/381276719.db2.gz FTILQOTUKNTJDM-STQMWFEESA-N 0 3 250.386 2.773 20 10 CFCDHN Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000183492767 381279892 /nfs/dbraw/zinc/27/98/92/381279892.db2.gz FOWIYIPRJNHEEN-MNOVXSKESA-N 0 3 259.353 2.846 20 10 CFCDHN C[C@@H]([NH2+]CCCNc1ccccn1)c1ccccc1[O-] ZINC000183546537 381285142 /nfs/dbraw/zinc/28/51/42/381285142.db2.gz YWILPMFFENPWIA-CYBMUJFWSA-N 0 3 271.364 2.940 20 10 CFCDHN C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)c1ccccc1[O-] ZINC000183549123 381285409 /nfs/dbraw/zinc/28/54/09/381285409.db2.gz NMIGXHKNLQPSPP-FRRDWIJNSA-N 0 3 260.381 2.668 20 10 CFCDHN CCOc1cccc(C[N@H+](C)CCc2ccncc2)c1[O-] ZINC000183756860 381315030 /nfs/dbraw/zinc/31/50/30/381315030.db2.gz KSLVFABQJJSFIY-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCOc1cccc(C[N@@H+](C)CCc2ccncc2)c1[O-] ZINC000183756860 381315036 /nfs/dbraw/zinc/31/50/36/381315036.db2.gz KSLVFABQJJSFIY-UHFFFAOYSA-N 0 3 286.375 2.860 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000296329479 381349311 /nfs/dbraw/zinc/34/93/11/381349311.db2.gz GFTCSGHFCABNHX-CYBMUJFWSA-N 0 3 263.381 2.910 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCOC[C@H](C)C2)c([O-])c1 ZINC000370052516 381373739 /nfs/dbraw/zinc/37/37/39/381373739.db2.gz HSBILGILWHPPBE-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCOC[C@H](C)C2)c([O-])c1 ZINC000370052516 381373747 /nfs/dbraw/zinc/37/37/47/381373747.db2.gz HSBILGILWHPPBE-CYBMUJFWSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCCN(c3ccccn3)CC2)c1[O-] ZINC000184806298 381479303 /nfs/dbraw/zinc/47/93/03/381479303.db2.gz QAGGLRJZGZTWHE-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN Cc1cccc(C[N@H+]2CCCN(c3ccccn3)CC2)c1[O-] ZINC000184806298 381479309 /nfs/dbraw/zinc/47/93/09/381479309.db2.gz QAGGLRJZGZTWHE-UHFFFAOYSA-N 0 3 297.402 2.808 20 10 CFCDHN CCOC[C@H]1CC[N@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184701183 381462715 /nfs/dbraw/zinc/46/27/15/381462715.db2.gz IIPFDVBUMYCOBN-NSHDSACASA-N 0 3 299.798 2.913 20 10 CFCDHN CCOC[C@H]1CC[N@@H+](Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000184701183 381462720 /nfs/dbraw/zinc/46/27/20/381462720.db2.gz IIPFDVBUMYCOBN-NSHDSACASA-N 0 3 299.798 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000184695438 381463086 /nfs/dbraw/zinc/46/30/86/381463086.db2.gz URFCIHLHQOTLLU-MFKMUULPSA-N 0 3 299.798 2.790 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c1[O-] ZINC000184695438 381463091 /nfs/dbraw/zinc/46/30/91/381463091.db2.gz URFCIHLHQOTLLU-MFKMUULPSA-N 0 3 299.798 2.790 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2[O-])c1 ZINC000185150453 381547771 /nfs/dbraw/zinc/54/77/71/381547771.db2.gz JCBKTDRGRRQUCX-ZDUSSCGKSA-N 0 3 298.386 2.911 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)[nH]n1 ZINC000296979592 381548189 /nfs/dbraw/zinc/54/81/89/381548189.db2.gz RVWIEQJAGRBBEV-HZMBPMFUSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cc(C[C@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)n[nH]1 ZINC000296979592 381548199 /nfs/dbraw/zinc/54/81/99/381548199.db2.gz RVWIEQJAGRBBEV-HZMBPMFUSA-N 0 3 271.364 2.632 20 10 CFCDHN CCOCCCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185071707 381527582 /nfs/dbraw/zinc/52/75/82/381527582.db2.gz DQXOHAAXJWQFEF-NSHDSACASA-N 0 3 255.333 2.999 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCNC(=O)OC(C)(C)C)c1 ZINC000185266914 381582571 /nfs/dbraw/zinc/58/25/71/381582571.db2.gz KJTCYSXFEXLAOM-LBPRGKRZSA-N 0 3 294.395 2.876 20 10 CFCDHN CCN(CC[NH2+][C@H](C)c1cc(OC)ccc1[O-])C1CC1 ZINC000185308003 381593197 /nfs/dbraw/zinc/59/31/97/381593197.db2.gz QWYGEFNEKPKMIJ-GFCCVEGCSA-N 0 3 278.396 2.536 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000185316574 381596206 /nfs/dbraw/zinc/59/62/06/381596206.db2.gz IGISQLVQNSBZNA-RYUDHWBXSA-N 0 3 268.376 2.912 20 10 CFCDHN CCCC(=O)N1CCCN(Cc2cc(C)ccc2O)CC1 ZINC000371410954 381618417 /nfs/dbraw/zinc/61/84/17/381618417.db2.gz JXSLFCQPTCMCFT-UHFFFAOYSA-N 0 3 290.407 2.535 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCO[C@@H]2CCOC2)c1 ZINC000185702209 381710086 /nfs/dbraw/zinc/71/00/86/381710086.db2.gz AWJXEIGQPGRVKN-ZIAGYGMSSA-N 0 3 279.380 2.547 20 10 CFCDHN COc1cccc(CN2CC[C@@H](O)c3ccccc3C2)c1O ZINC000371876470 381716299 /nfs/dbraw/zinc/71/62/99/381716299.db2.gz MMNSMSZHDJDGRY-MRXNPFEDSA-N 0 3 299.370 2.840 20 10 CFCDHN CCCN(CC)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000185631773 381687577 /nfs/dbraw/zinc/68/75/77/381687577.db2.gz LEGXRDMYZQPKIB-ZDUSSCGKSA-N 0 3 280.412 2.783 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000185672051 381699603 /nfs/dbraw/zinc/69/96/03/381699603.db2.gz JULNFZHBOKVGFW-IHRRRGAJSA-N 0 3 274.408 2.976 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@H](CO)CC(C)(C)C)c1 ZINC000186143475 381833735 /nfs/dbraw/zinc/83/37/35/381833735.db2.gz ROADPXQPXUMCJD-NEPJUHHUSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@H]([NH2+]CCCCCCO)c1cc(F)ccc1[O-] ZINC000186231613 381860211 /nfs/dbraw/zinc/86/02/11/381860211.db2.gz JCSOMIAIBNEMLC-NSHDSACASA-N 0 3 255.333 2.735 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@@](O)(C2CC2)C1 ZINC000373322847 381980837 /nfs/dbraw/zinc/98/08/37/381980837.db2.gz JVZHFWJZMINGFY-SFHVURJKSA-N 0 3 283.371 2.892 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@@](O)(C2CC2)C1 ZINC000373322847 381980842 /nfs/dbraw/zinc/98/08/42/381980842.db2.gz JVZHFWJZMINGFY-SFHVURJKSA-N 0 3 283.371 2.892 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000375407443 382083698 /nfs/dbraw/zinc/08/36/98/382083698.db2.gz XAEPTACIDHMPEN-CYBMUJFWSA-N 0 3 285.347 2.642 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000375407443 382083705 /nfs/dbraw/zinc/08/37/05/382083705.db2.gz XAEPTACIDHMPEN-CYBMUJFWSA-N 0 3 285.347 2.642 20 10 CFCDHN Cc1cn2c(n1)CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1[O-])C2 ZINC000363854649 382249362 /nfs/dbraw/zinc/24/93/62/382249362.db2.gz MLHJXMVRKLOKQX-KGLIPLIRSA-N 0 3 285.391 2.871 20 10 CFCDHN CCOC1CC(CC[NH2+]Cc2cccc(C)c2[O-])C1 ZINC000187978771 382314703 /nfs/dbraw/zinc/31/47/03/382314703.db2.gz PARQENBQBWEYOL-UHFFFAOYSA-N 0 3 263.381 2.995 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000364637106 382345172 /nfs/dbraw/zinc/34/51/72/382345172.db2.gz NYQMFFMYEVKOPR-BFHYXJOUSA-N 0 3 291.391 2.820 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000364637106 382345179 /nfs/dbraw/zinc/34/51/79/382345179.db2.gz NYQMFFMYEVKOPR-BFHYXJOUSA-N 0 3 291.391 2.820 20 10 CFCDHN Oc1ccccc1CN1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000294014643 382378110 /nfs/dbraw/zinc/37/81/10/382378110.db2.gz NCLUVZBNPXWKEU-JKSUJKDBSA-N 0 3 259.349 2.536 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1C[C@H]3CCCCC[C@H]31)OCO2 ZINC000378345173 382440347 /nfs/dbraw/zinc/44/03/47/382440347.db2.gz HWMUSBRSGOYVHS-DGCLKSJQSA-N 0 3 275.348 2.885 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1C[C@H]3CCCCC[C@H]31)OCO2 ZINC000378345173 382440352 /nfs/dbraw/zinc/44/03/52/382440352.db2.gz HWMUSBRSGOYVHS-DGCLKSJQSA-N 0 3 275.348 2.885 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCCC[C@H](CO)C2)cc1C ZINC000378344947 382440966 /nfs/dbraw/zinc/44/09/66/382440966.db2.gz FLHJGPZPCMBFCS-AWEZNQCLSA-N 0 3 263.381 2.603 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCCC[C@H](CO)C2)cc1C ZINC000378344947 382440968 /nfs/dbraw/zinc/44/09/68/382440968.db2.gz FLHJGPZPCMBFCS-AWEZNQCLSA-N 0 3 263.381 2.603 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCOCC(F)F)c([O-])c1 ZINC000188743404 382468974 /nfs/dbraw/zinc/46/89/74/382468974.db2.gz HBUJEHLVMCMXTH-JTQLQIEISA-N 0 3 259.296 2.633 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@@H](OC)CC2)c1[O-] ZINC000378629874 382494489 /nfs/dbraw/zinc/49/44/89/382494489.db2.gz DXKKZYUIINLYMW-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@@H](OC)CC2)c1[O-] ZINC000378629874 382494494 /nfs/dbraw/zinc/49/44/94/382494494.db2.gz DXKKZYUIINLYMW-CQSZACIVSA-N 0 3 279.380 2.792 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cccc(OC)c1[O-])OC ZINC000294241773 382474535 /nfs/dbraw/zinc/47/45/35/382474535.db2.gz PGEJEHKGYVDSEP-FZMZJTMJSA-N 0 3 267.369 2.552 20 10 CFCDHN CCCOc1ccc(C[NH+]2CC([C@@H]3CCOC3)C2)c([O-])c1 ZINC000366243195 382490582 /nfs/dbraw/zinc/49/05/82/382490582.db2.gz DFIWOZSCQDEUPD-CQSZACIVSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1noc(CCC[NH2+][C@H](C)c2c(C)cc(C)cc2[O-])n1 ZINC000294669981 382524060 /nfs/dbraw/zinc/52/40/60/382524060.db2.gz HQWZNYGCLGSWCI-GFCCVEGCSA-N 0 3 289.379 2.984 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ncccc2C)c1 ZINC000294928171 382544563 /nfs/dbraw/zinc/54/45/63/382544563.db2.gz GBCITMMPLFWJBR-CYBMUJFWSA-N 0 3 286.375 2.998 20 10 CFCDHN CCN(Cc1cc(C)c(C)cc1O)C[C@H](O)C(F)(F)F ZINC000189872377 382643655 /nfs/dbraw/zinc/64/36/55/382643655.db2.gz YESSYSLBESDJTK-ZDUSSCGKSA-N 0 3 291.313 2.754 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]2CCO)c([O-])c1 ZINC000189968423 382647666 /nfs/dbraw/zinc/64/76/66/382647666.db2.gz YAACVJFCGWKEDH-CZUORRHYSA-N 0 3 293.407 2.822 20 10 CFCDHN CC[C@H]([NH2+]CC1(C)OCCCO1)c1ccccc1[O-] ZINC000190639837 382675909 /nfs/dbraw/zinc/67/59/09/382675909.db2.gz VWIDWNRKYHOUNM-ZDUSSCGKSA-N 0 3 265.353 2.586 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(C)OCCCO2)c([O-])c1 ZINC000190644416 382676094 /nfs/dbraw/zinc/67/60/94/382676094.db2.gz IYFVTHNJJNFYSE-GFCCVEGCSA-N 0 3 265.353 2.504 20 10 CFCDHN C[C@@H]1CSCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190839964 382681735 /nfs/dbraw/zinc/68/17/35/382681735.db2.gz ZSPANGNFRWLOCJ-JTQLQIEISA-N 0 3 255.358 2.716 20 10 CFCDHN C[C@@H]1CSCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000190839964 382681737 /nfs/dbraw/zinc/68/17/37/382681737.db2.gz ZSPANGNFRWLOCJ-JTQLQIEISA-N 0 3 255.358 2.716 20 10 CFCDHN COc1cccc(C[N@@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190845994 382682147 /nfs/dbraw/zinc/68/21/47/382682147.db2.gz AOKIAEDSTLOJJH-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN COc1cccc(C[N@H+]2CCSC[C@H](C)C2)c1[O-] ZINC000190845994 382682150 /nfs/dbraw/zinc/68/21/50/382682150.db2.gz AOKIAEDSTLOJJH-LLVKDONJSA-N 0 3 267.394 2.586 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000252743428 383432578 /nfs/dbraw/zinc/43/25/78/383432578.db2.gz PMXMBPVGVNZNBF-OLZOCXBDSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000252743428 383432581 /nfs/dbraw/zinc/43/25/81/383432581.db2.gz PMXMBPVGVNZNBF-OLZOCXBDSA-N 0 3 280.799 2.762 20 10 CFCDHN C[C@@H](N[C@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1[O-] ZINC000530216074 383768410 /nfs/dbraw/zinc/76/84/10/383768410.db2.gz MHVMHLNUPKELPO-YGRLFVJLSA-N 0 3 280.799 2.981 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](CCO)C2CCCCC2)c1 ZINC000269374825 384751537 /nfs/dbraw/zinc/75/15/37/384751537.db2.gz VJGPIUTZAGHEDA-UHFFFAOYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](CCO)C2CCCCC2)c1 ZINC000269374825 384751543 /nfs/dbraw/zinc/75/15/43/384751543.db2.gz VJGPIUTZAGHEDA-UHFFFAOYSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1cc([O-])c(C[NH2+]CCC[C@H](C)CO)cc1C ZINC000270243925 385028711 /nfs/dbraw/zinc/02/87/11/385028711.db2.gz DIKKLUYKTOHDIC-NSHDSACASA-N 0 3 251.370 2.507 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H](C)c2cn[nH]c2)c([O-])c1 ZINC000270261604 385035455 /nfs/dbraw/zinc/03/54/55/385035455.db2.gz WEMFNMIGLRECBI-LLVKDONJSA-N 0 3 275.352 2.755 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)=O)C1)c1ccccc1[O-] ZINC000281260551 385186410 /nfs/dbraw/zinc/18/64/10/385186410.db2.gz WMHFUWCENNCZRK-GOEBONIOSA-N 0 3 290.407 2.691 20 10 CFCDHN CCN(CC)c1ccc(CN2CCC(CO)CC2)cc1F ZINC000271052265 385321057 /nfs/dbraw/zinc/32/10/57/385321057.db2.gz WQEQVNDTXDQXCY-UHFFFAOYSA-N 0 3 294.414 2.876 20 10 CFCDHN O[C@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1 ZINC000270984792 385291670 /nfs/dbraw/zinc/29/16/70/385291670.db2.gz FOBWFIHSWSPERM-KRWDZBQOSA-N 0 3 274.408 2.634 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)c1[O-] ZINC000282367599 385295619 /nfs/dbraw/zinc/29/56/19/385295619.db2.gz QCVKUIVTXUMPOX-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C)c1[O-] ZINC000282367599 385295622 /nfs/dbraw/zinc/29/56/22/385295622.db2.gz QCVKUIVTXUMPOX-GXTWGEPZSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c1[O-] ZINC000282367602 385295687 /nfs/dbraw/zinc/29/56/87/385295687.db2.gz QCVKUIVTXUMPOX-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@@H](OC)C[C@H]2C)c1[O-] ZINC000282367602 385295689 /nfs/dbraw/zinc/29/56/89/385295689.db2.gz QCVKUIVTXUMPOX-TZMCWYRMSA-N 0 3 279.380 2.790 20 10 CFCDHN CCC[N@H+](Cc1cc(C)ccc1[O-])CC(C)(C)O ZINC000271173445 385362143 /nfs/dbraw/zinc/36/21/43/385362143.db2.gz RSDAEOPMXTVKGG-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CCC[N@@H+](Cc1cc(C)ccc1[O-])CC(C)(C)O ZINC000271173445 385362145 /nfs/dbraw/zinc/36/21/45/385362145.db2.gz RSDAEOPMXTVKGG-UHFFFAOYSA-N 0 3 251.370 2.684 20 10 CFCDHN CN(C)c1ccc(CNC[C@H]2COC3(CCCC3)O2)cc1 ZINC000271411660 385381957 /nfs/dbraw/zinc/38/19/57/385381957.db2.gz KFYONHNMTMNMRP-INIZCTEOSA-N 0 3 290.407 2.528 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H]2CCOC2)c1[O-] ZINC000271766327 385390902 /nfs/dbraw/zinc/39/09/02/385390902.db2.gz AIISFYMJLBDMAT-GHMZBOCLSA-N 0 3 269.772 2.869 20 10 CFCDHN COc1cccc(C[NH2+]CC2([C@H](C)CCO)CCC2)c1[O-] ZINC000271767577 385391509 /nfs/dbraw/zinc/39/15/09/385391509.db2.gz ASVSAFKZJBPILD-CYBMUJFWSA-N 0 3 293.407 2.679 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCC3(CCOCC3)C2)c1 ZINC000271836299 385393903 /nfs/dbraw/zinc/39/39/03/385393903.db2.gz POVZSWWWCXFVGB-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCC3(CCOCC3)C2)c1 ZINC000271836299 385393907 /nfs/dbraw/zinc/39/39/07/385393907.db2.gz POVZSWWWCXFVGB-UHFFFAOYSA-N 0 3 291.391 2.793 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1O ZINC000271820791 385394306 /nfs/dbraw/zinc/39/43/06/385394306.db2.gz KNTNFKXMMTVCNA-ZWNOBZJWSA-N 0 3 269.772 2.557 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2[O-])C[C@H]1O ZINC000271820791 385394311 /nfs/dbraw/zinc/39/43/11/385394311.db2.gz KNTNFKXMMTVCNA-ZWNOBZJWSA-N 0 3 269.772 2.557 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]C[C@](C)(O)c2ccco2)c1[O-] ZINC000271871986 385395241 /nfs/dbraw/zinc/39/52/41/385395241.db2.gz XYVUKEGBIAUNRS-HNNXBMFYSA-N 0 3 295.766 2.944 20 10 CFCDHN Cc1cc(O)c(CN[C@@H]2CCCc3nn(C)cc32)cc1C ZINC000282920141 385411391 /nfs/dbraw/zinc/41/13/91/385411391.db2.gz HEEFWLKYFLHSFC-OAHLLOKOSA-N 0 3 285.391 2.910 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCCc3nn(C)cc32)cc1C ZINC000282920141 385411396 /nfs/dbraw/zinc/41/13/96/385411396.db2.gz HEEFWLKYFLHSFC-OAHLLOKOSA-N 0 3 285.391 2.910 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000272243424 385485780 /nfs/dbraw/zinc/48/57/80/385485780.db2.gz GYIUFXVNGLDEJF-LLVKDONJSA-N 0 3 275.327 2.634 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000272243424 385485783 /nfs/dbraw/zinc/48/57/83/385485783.db2.gz GYIUFXVNGLDEJF-LLVKDONJSA-N 0 3 275.327 2.634 20 10 CFCDHN CC1(C2CC[NH+](Cc3cc(F)ccc3[O-])CC2)OCCO1 ZINC000272331499 385512758 /nfs/dbraw/zinc/51/27/58/385512758.db2.gz WQMKGVKVPSHHIP-UHFFFAOYSA-N 0 3 295.354 2.506 20 10 CFCDHN COC(=O)C(C)(C)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000284278434 385547221 /nfs/dbraw/zinc/54/72/21/385547221.db2.gz FHCNYKJUVRIQMW-NSHDSACASA-N 0 3 295.379 2.641 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284301570 385547314 /nfs/dbraw/zinc/54/73/14/385547314.db2.gz BORBAIMIUCYXFG-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000284301570 385547320 /nfs/dbraw/zinc/54/73/20/385547320.db2.gz BORBAIMIUCYXFG-ZBFHGGJFSA-N 0 3 261.365 2.844 20 10 CFCDHN CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1cccc(C)c1[O-] ZINC000285159621 385552960 /nfs/dbraw/zinc/55/29/60/385552960.db2.gz PHHXJUPVZNAIRY-OAHLLOKOSA-N 0 3 290.407 2.581 20 10 CFCDHN CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cccc(C)c1[O-] ZINC000285159621 385552964 /nfs/dbraw/zinc/55/29/64/385552964.db2.gz PHHXJUPVZNAIRY-OAHLLOKOSA-N 0 3 290.407 2.581 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CC2([S@](C)=O)CC2)c([O-])c1 ZINC000285298388 385553847 /nfs/dbraw/zinc/55/38/47/385553847.db2.gz RXSAPPWXEMBWIE-BLVKFPJESA-N 0 3 281.421 2.571 20 10 CFCDHN CCc1ccc([C@H](O)C[NH2+]Cc2ccccc2[O-])cc1 ZINC000285672921 385557045 /nfs/dbraw/zinc/55/70/45/385557045.db2.gz UJYGQPIOQJFITH-QGZVFWFLSA-N 0 3 271.360 2.778 20 10 CFCDHN CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2[O-])CCO1 ZINC000272682452 385588486 /nfs/dbraw/zinc/58/84/86/385588486.db2.gz VQJSZNZGMXNJIY-ZFWWWQNUSA-N 0 3 267.344 2.825 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC[C@H](C(=O)N(C)C)C1)c1ccccc1[O-] ZINC000272843566 385631662 /nfs/dbraw/zinc/63/16/62/385631662.db2.gz JWHBCDWVSRHFOK-MELADBBJSA-N 0 3 290.407 2.690 20 10 CFCDHN C[C@@H]([NH2+][C@@H](CO)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000272892145 385644275 /nfs/dbraw/zinc/64/42/75/385644275.db2.gz SSTIMZLATRCNTF-IUODEOHRSA-N 0 3 289.350 2.786 20 10 CFCDHN C[C@H]([NH2+][C@H](CO)Cc1ccc(F)cc1)c1ccccc1[O-] ZINC000272892149 385644385 /nfs/dbraw/zinc/64/43/85/385644385.db2.gz SSTIMZLATRCNTF-WFASDCNBSA-N 0 3 289.350 2.786 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCc2cnn(C)c2)c([O-])c1C ZINC000273386960 385680959 /nfs/dbraw/zinc/68/09/59/385680959.db2.gz JSJBSVLMKWMXET-ZDUSSCGKSA-N 0 3 273.380 2.636 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCCSCC2)c1 ZINC000273402391 385681164 /nfs/dbraw/zinc/68/11/64/385681164.db2.gz MMZGWXGLACCQSX-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCCSCC2)c1 ZINC000273402391 385681172 /nfs/dbraw/zinc/68/11/72/385681172.db2.gz MMZGWXGLACCQSX-UHFFFAOYSA-N 0 3 267.394 2.730 20 10 CFCDHN CCn1cc(C[NH2+][C@H](C)c2cc(F)ccc2[O-])cn1 ZINC000273456520 385684658 /nfs/dbraw/zinc/68/46/58/385684658.db2.gz HCBWYRPIBJJZGU-SNVBAGLBSA-N 0 3 263.316 2.599 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@H]2CCN(C(C)C)C2=O)c(O)c1C ZINC000273519157 385686163 /nfs/dbraw/zinc/68/61/63/385686163.db2.gz TVEKDIMYIOUGRD-HIFRSBDPSA-N 0 3 290.407 2.669 20 10 CFCDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(C)ccc2[O-])[C@]12CCCO2 ZINC000273609487 385690819 /nfs/dbraw/zinc/69/08/19/385690819.db2.gz OBIKUWYUKGGDHW-BRWVUGGUSA-N 0 3 291.391 2.517 20 10 CFCDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)NC(C)(C)C)c(O)c1C ZINC000273615749 385691309 /nfs/dbraw/zinc/69/13/09/385691309.db2.gz XHONCCVLFPJALF-CHWSQXEVSA-N 0 3 292.423 2.963 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]Cc2ccn(C)c2)c1 ZINC000273595960 385691794 /nfs/dbraw/zinc/69/17/94/385691794.db2.gz QQWWYPOTCYAHLF-LLVKDONJSA-N 0 3 260.337 2.590 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1[O-] ZINC000374156482 393485867 /nfs/dbraw/zinc/48/58/67/393485867.db2.gz GLHCNNPVXFTHRB-DAXOMENPSA-N 0 3 291.391 2.694 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CC(=O)N3CCCC[C@@H]23)c([O-])c1 ZINC000374504879 393498202 /nfs/dbraw/zinc/49/82/02/393498202.db2.gz MLOXYYZMBOVMRI-CFVMTHIKSA-N 0 3 288.391 2.505 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CC(=O)N3CCCC[C@@H]23)c([O-])c1 ZINC000374504882 393498217 /nfs/dbraw/zinc/49/82/17/393498217.db2.gz MLOXYYZMBOVMRI-QEJZJMRPSA-N 0 3 288.391 2.505 20 10 CFCDHN [O-]c1ccc(F)cc1CN1CCC[C@H]([NH+]2CCCCC2)C1 ZINC000374893052 393503020 /nfs/dbraw/zinc/50/30/20/393503020.db2.gz IZCDVEWNZMJBSU-INIZCTEOSA-N 0 3 292.398 2.982 20 10 CFCDHN Oc1cccc2c1CC[C@H]2NCc1cc2c(cc1O)OCO2 ZINC000105486557 393863497 /nfs/dbraw/zinc/86/34/97/393863497.db2.gz VNBWTVOSMMKCCB-CYBMUJFWSA-N 0 3 299.326 2.604 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(C3(C)OCCO3)CC2)c1[O-] ZINC000271745569 394022871 /nfs/dbraw/zinc/02/28/71/394022871.db2.gz SJQVUCKPNNEPNR-UHFFFAOYSA-N 0 3 291.391 2.676 20 10 CFCDHN CSC1(C[NH2+][C@@H]2CCc3cccc([O-])c32)CCOCC1 ZINC000297076616 394313560 /nfs/dbraw/zinc/31/35/60/394313560.db2.gz WPJCOLMHJTURHH-CYBMUJFWSA-N 0 3 293.432 2.881 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1[O-] ZINC000529668160 394418579 /nfs/dbraw/zinc/41/85/79/394418579.db2.gz DMBRFBAPABTOOP-QSDJMHMYSA-N 0 3 299.798 2.956 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+][C@H]1CCC[C@H]1CCO)CC2 ZINC000296438450 296547804 /nfs/dbraw/zinc/54/78/04/296547804.db2.gz MMVJMTKCMHTAME-UBHSHLNASA-N 0 3 261.365 2.520 20 10 CFCDHN COc1cc([O-])c(C[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000159473767 286238806 /nfs/dbraw/zinc/23/88/06/286238806.db2.gz ZLGLDGLXOGHNAA-NSHDSACASA-N 0 3 265.353 2.784 20 10 CFCDHN COc1cc([O-])c(C[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000159473767 286238810 /nfs/dbraw/zinc/23/88/10/286238810.db2.gz ZLGLDGLXOGHNAA-NSHDSACASA-N 0 3 265.353 2.784 20 10 CFCDHN CC[C@H]([NH2+]CC(C)(C)N(C)C)c1ccccc1[O-] ZINC000020125857 171009481 /nfs/dbraw/zinc/00/94/81/171009481.db2.gz JFYBPMGGNUPLDK-ZDUSSCGKSA-N 0 3 250.386 2.773 20 10 CFCDHN COc1ccc(O)c([C@@H](C)N[C@@H](C)c2cnn(C)c2C)c1 ZINC000037167672 260072995 /nfs/dbraw/zinc/07/29/95/260072995.db2.gz PPWOROGTYFTYLO-MNOVXSKESA-N 0 3 289.379 2.855 20 10 CFCDHN CN(C)[C@@H](CNCc1ccc2c(c1)CCO2)c1ccco1 ZINC000037362745 260094750 /nfs/dbraw/zinc/09/47/50/260094750.db2.gz AJRBCHROJNGFQP-HNNXBMFYSA-N 0 3 286.375 2.607 20 10 CFCDHN CCN(CC)CC[NH2+][C@@H](C)c1cc(C)ccc1[O-] ZINC000035628637 260151894 /nfs/dbraw/zinc/15/18/94/260151894.db2.gz KYOUDLGWWHSTQI-ZDUSSCGKSA-N 0 3 250.386 2.693 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@H](O)C[C@@H]2C)c1[O-] ZINC000292718798 263134202 /nfs/dbraw/zinc/13/42/02/263134202.db2.gz FBAPLRKQFVUODX-GWCFXTLKSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c1[O-] ZINC000292718798 263134203 /nfs/dbraw/zinc/13/42/03/263134203.db2.gz FBAPLRKQFVUODX-GWCFXTLKSA-N 0 3 269.772 2.699 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCN2CCC1CC2 ZINC000367690600 267109898 /nfs/dbraw/zinc/10/98/98/267109898.db2.gz ULADCNIRMGMJNU-OAHLLOKOSA-N 0 3 260.381 2.623 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCN2CCC1CC2 ZINC000367690600 267109899 /nfs/dbraw/zinc/10/98/99/267109899.db2.gz ULADCNIRMGMJNU-OAHLLOKOSA-N 0 3 260.381 2.623 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(n3cccn3)CC2)c1[O-] ZINC000367722409 267112849 /nfs/dbraw/zinc/11/28/49/267112849.db2.gz LPEYNSJBBTYRMS-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H](CO)C1 ZINC000367723891 267112904 /nfs/dbraw/zinc/11/29/04/267112904.db2.gz ULVSFAKATKDIBH-MSOLQXFVSA-N 0 3 297.398 2.990 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](c2ccccc2)[C@@H](CO)C1 ZINC000367723891 267112907 /nfs/dbraw/zinc/11/29/07/267112907.db2.gz ULVSFAKATKDIBH-MSOLQXFVSA-N 0 3 297.398 2.990 20 10 CFCDHN CC[C@@H]1C[N@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000369875598 267273164 /nfs/dbraw/zinc/27/31/64/267273164.db2.gz VVZSFIJIPKGMAH-NVXWUHKLSA-N 0 3 291.391 2.552 20 10 CFCDHN CC[C@@H]1C[N@@H+](Cc2ccccc2[O-])C[C@@]2(CCCOC2)O1 ZINC000369875598 267273168 /nfs/dbraw/zinc/27/31/68/267273168.db2.gz VVZSFIJIPKGMAH-NVXWUHKLSA-N 0 3 291.391 2.552 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@]3(CCOC3)C2)c([O-])c1 ZINC000369902197 267275166 /nfs/dbraw/zinc/27/51/66/267275166.db2.gz LCRIKMDAFQPLDJ-VBQJREDUSA-N 0 3 291.391 2.689 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000369930663 267277051 /nfs/dbraw/zinc/27/70/51/267277051.db2.gz NUXZRSTVBBGRQI-ZBFHGGJFSA-N 0 3 261.365 2.954 20 10 CFCDHN CC[C@H](c1ccccc1[O-])[N@H+]1CCO[C@H](C2CC2)C1 ZINC000369930663 267277053 /nfs/dbraw/zinc/27/70/53/267277053.db2.gz NUXZRSTVBBGRQI-ZBFHGGJFSA-N 0 3 261.365 2.954 20 10 CFCDHN C[C@@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000370397279 267317091 /nfs/dbraw/zinc/31/70/91/267317091.db2.gz MNQIGOHMPXPXQJ-BXKDBHETSA-N 0 3 291.782 2.977 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@@]1(O)CCc3ccccc31)CC2 ZINC000297050639 275061608 /nfs/dbraw/zinc/06/16/08/275061608.db2.gz VOVZWRCIVKOXOV-APWZRJJASA-N 0 3 295.382 2.803 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1[O-])[C@@H]1CCCO1 ZINC000278952727 277263627 /nfs/dbraw/zinc/26/36/27/277263627.db2.gz ZNLPITDMALDRJC-INWMFGNUSA-N 0 3 279.380 2.545 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCc2cccc([O-])c21)C1CCOCC1 ZINC000296652301 278387295 /nfs/dbraw/zinc/38/72/95/278387295.db2.gz DLYVQYBRSRQHBL-RISCZKNCSA-N 0 3 261.365 2.784 20 10 CFCDHN CCN1CCCC[C@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297962737 279282419 /nfs/dbraw/zinc/28/24/19/279282419.db2.gz ZIQMTUBUBLRFNX-LSDHHAIUSA-N 0 3 274.408 2.844 20 10 CFCDHN COC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCO1 ZINC000278623327 293166368 /nfs/dbraw/zinc/16/63/68/293166368.db2.gz CGOIIRWZCWZTSA-COXVUDFISA-N 0 3 292.423 2.597 20 10 CFCDHN COc1cccc(C[NH2+][C@@H]2CCc3ccccc3OC2)c1[O-] ZINC000374544424 328993472 /nfs/dbraw/zinc/99/34/72/328993472.db2.gz RJTCKHWNKUDIGT-OAHLLOKOSA-N 0 3 299.370 2.884 20 10 CFCDHN C[C@@]1(C[NH2+]Cc2ccccc2[O-])COc2ccccc2O1 ZINC000527735545 330278770 /nfs/dbraw/zinc/27/87/70/330278770.db2.gz OCAMFFXTKAERMJ-QGZVFWFLSA-N 0 3 285.343 2.712 20 10 CFCDHN COC[C@]1([NH2+]Cc2ccccc2[O-])COc2ccccc2C1 ZINC000527802214 330284249 /nfs/dbraw/zinc/28/42/49/330284249.db2.gz WHUQZGWZFVUEMQ-SFHVURJKSA-N 0 3 299.370 2.502 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc1C ZINC000527804650 330284425 /nfs/dbraw/zinc/28/44/25/330284425.db2.gz RCNZKYPPEIOKMG-QCQGSNGOSA-N 0 3 263.381 2.911 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1c2ccccc2C(=O)N1C)c1ccccc1[O-] ZINC000528008726 330303785 /nfs/dbraw/zinc/30/37/85/330303785.db2.gz XBLKSHCIMUMRLS-WBMJQRKESA-N 0 3 296.370 2.870 20 10 CFCDHN Cn1cncc1CNCc1ccc(N2CCCCC2)cc1 ZINC000263836535 334674552 /nfs/dbraw/zinc/67/45/52/334674552.db2.gz CJBBHSMYGKJJME-UHFFFAOYSA-N 0 3 284.407 2.700 20 10 CFCDHN CC(C)N(C)C[C@@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000290041459 519628541 /nfs/dbraw/zinc/62/85/41/519628541.db2.gz DMOGAWGCYGAQJL-CHWSQXEVSA-N 0 3 250.386 2.772 20 10 CFCDHN CC(C)C[C@H](CO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094617832 519362590 /nfs/dbraw/zinc/36/25/90/519362590.db2.gz FDWGJIBHCIXGNC-CMPLNLGQSA-N 0 3 255.333 2.589 20 10 CFCDHN CC(C)N(C)c1ccc(C[NH2+]Cc2ccccc2[O-])cn1 ZINC000276951640 519633489 /nfs/dbraw/zinc/63/34/89/519633489.db2.gz JWZIVUYCWGHMKD-UHFFFAOYSA-N 0 3 285.391 2.922 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2cc(C)ccc2[O-])CC1 ZINC000159094998 520614669 /nfs/dbraw/zinc/61/46/69/520614669.db2.gz YSXPOHFPUVAVGY-UHFFFAOYSA-N 0 3 291.391 2.866 20 10 CFCDHN CCCCOCC[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000094617803 520782379 /nfs/dbraw/zinc/78/23/79/520782379.db2.gz IZASNXOFSRNDFO-NSHDSACASA-N 0 3 255.333 2.999 20 10 CFCDHN CCN(CC)c1ccc(CNC[C@@H](O)C2CC2)cc1F ZINC000265813721 520905099 /nfs/dbraw/zinc/90/50/99/520905099.db2.gz WKPBNHUSCRLTRV-MRXNPFEDSA-N 0 3 280.387 2.532 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+](C(C)C)[C@@H]2CCOC2)c1 ZINC000291343606 521140859 /nfs/dbraw/zinc/14/08/59/521140859.db2.gz WHJCPVBCNXAXMY-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+](C(C)C)[C@@H]2CCOC2)c1 ZINC000291343606 521140869 /nfs/dbraw/zinc/14/08/69/521140869.db2.gz WHJCPVBCNXAXMY-CQSZACIVSA-N 0 3 279.380 2.790 20 10 CFCDHN CCOc1ccc([O-])c(C[N@@H+]2CCC[C@](C)(OC)C2)c1 ZINC000280724865 521143974 /nfs/dbraw/zinc/14/39/74/521143974.db2.gz YIXRSXREVVTJSZ-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[N@H+]2CCC[C@](C)(OC)C2)c1 ZINC000280724865 521143982 /nfs/dbraw/zinc/14/39/82/521143982.db2.gz YIXRSXREVVTJSZ-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+]CC2(SC)CC2)c1 ZINC000193658541 521151213 /nfs/dbraw/zinc/15/12/13/521151213.db2.gz JJQYNLNBIIYVQH-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN CCOc1cccc(C[N@H+](CC2CCC2)[C@H](C)CO)c1[O-] ZINC000289371870 521333766 /nfs/dbraw/zinc/33/37/66/521333766.db2.gz LNOBROVOCJIXSF-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC2CCC2)[C@H](C)CO)c1[O-] ZINC000289371870 521333775 /nfs/dbraw/zinc/33/37/75/521333775.db2.gz LNOBROVOCJIXSF-CYBMUJFWSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1cccc(C[NH2+]C2CCN(C3CC3)CC2)c1[O-] ZINC000037140978 521359473 /nfs/dbraw/zinc/35/94/73/521359473.db2.gz FIPMFOINOURIAD-UHFFFAOYSA-N 0 3 290.407 2.507 20 10 CFCDHN CCOc1cccc(C[NH2+]CC(C)(C)CCCO)c1[O-] ZINC000221390878 521361482 /nfs/dbraw/zinc/36/14/82/521361482.db2.gz OREHGHPVJUYHLU-UHFFFAOYSA-N 0 3 281.396 2.679 20 10 CFCDHN CCC(CC)(CO)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000186170483 521455579 /nfs/dbraw/zinc/45/55/79/521455579.db2.gz FAKQNYJPRVWTOV-GFCCVEGCSA-N 0 3 281.396 2.850 20 10 CFCDHN CCC(O)(CC)CC[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000276621948 521652827 /nfs/dbraw/zinc/65/28/27/521652827.db2.gz ICOZOSWOVMVTLT-LBPRGKRZSA-N 0 3 281.396 2.993 20 10 CFCDHN CCC(O)(CC)C[NH2+][C@H](C)c1cc(OC)ccc1[O-] ZINC000087015296 521657150 /nfs/dbraw/zinc/65/71/50/521657150.db2.gz WNLCUUCOTSSCEF-LLVKDONJSA-N 0 3 267.369 2.603 20 10 CFCDHN CCNC(=O)C1(C[NH2+][C@@H](C)c2cc(C)ccc2[O-])CCC1 ZINC000277372175 521733543 /nfs/dbraw/zinc/73/35/43/521733543.db2.gz XAVJKOPSRZHDRJ-ZDUSSCGKSA-N 0 3 290.407 2.658 20 10 CFCDHN CC[C@H](C)[C@H](C[NH2+]Cc1cc(OC)ccc1[O-])OC ZINC000294269905 521941027 /nfs/dbraw/zinc/94/10/27/521941027.db2.gz RSQWYKRPVKZGCX-NHYWBVRUSA-N 0 3 267.369 2.552 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC[C@@H]2O)c1[O-] ZINC000228675055 522540322 /nfs/dbraw/zinc/54/03/22/522540322.db2.gz MUNDOULEHBCCEJ-MFKMUULPSA-N 0 3 299.798 2.695 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@@H]2CCOC[C@@H]2C)c1[O-] ZINC000277523747 522540369 /nfs/dbraw/zinc/54/03/69/522540369.db2.gz PJPDGRYOJONONE-JOYOIKCWSA-N 0 3 285.771 2.569 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H](C)C2CC2)c1[O-] ZINC000228669848 522540455 /nfs/dbraw/zinc/54/04/55/522540455.db2.gz ZNTHFBIFJPNTET-MRVPVSSYSA-N 0 3 255.745 2.942 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@@H](OC)C(C)C)c1[O-] ZINC000273729894 522541022 /nfs/dbraw/zinc/54/10/22/522541022.db2.gz KAZWUQWCMWMZAV-CYBMUJFWSA-N 0 3 287.787 2.815 20 10 CFCDHN CC[C@H]([NH2+]CCC(C)(C)O)c1ccc(C)cc1[O-] ZINC000279998018 522577620 /nfs/dbraw/zinc/57/76/20/522577620.db2.gz FTFLIIYIVRLYQI-ZDUSSCGKSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H](CSC)[NH2+]Cc1cc(OC)ccc1[O-] ZINC000164790470 522612580 /nfs/dbraw/zinc/61/25/80/522612580.db2.gz OYCSCJKKBRUIRP-NSHDSACASA-N 0 3 255.383 2.632 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)[C@@H](C)N1CCOCC1)c1ccccc1[O-] ZINC000155706335 522735247 /nfs/dbraw/zinc/73/52/47/522735247.db2.gz JHBRJQXTODFPOM-FMKPAKJESA-N 0 3 292.423 2.542 20 10 CFCDHN CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1[O-])C(C)(C)O ZINC000295060006 522738498 /nfs/dbraw/zinc/73/84/98/522738498.db2.gz RBDNFTWGMDCJDP-YGRLFVJLSA-N 0 3 267.369 2.601 20 10 CFCDHN CC[C@H]([NH2+][C@H](COC)[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000280069843 522748221 /nfs/dbraw/zinc/74/82/21/522748221.db2.gz KYWCSVVZEUCGOV-UXLLHSPISA-N 0 3 293.407 2.935 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000280022390 522803987 /nfs/dbraw/zinc/80/39/87/522803987.db2.gz HNVVNDFVFFASLM-JSGCOSHPSA-N 0 3 251.370 2.902 20 10 CFCDHN CC[C@@H]([NH2+]CCCC(=O)N(C)C)c1ccc(C)cc1[O-] ZINC000280003433 522824458 /nfs/dbraw/zinc/82/44/58/522824458.db2.gz GDXIBUJWUOCWSK-CQSZACIVSA-N 0 3 278.396 2.610 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](C)CCO)c1ccc(C)cc1[O-] ZINC000279990640 522859694 /nfs/dbraw/zinc/85/96/94/522859694.db2.gz FINSVKJARQLLBI-TZMCWYRMSA-N 0 3 251.370 2.760 20 10 CFCDHN CC[C@@H]([NH2+]C[C@]1(O)CCSC1)c1ccc(C)cc1[O-] ZINC000279957421 522868439 /nfs/dbraw/zinc/86/84/39/522868439.db2.gz CDTANZMUWPHWSR-UKRRQHHQSA-N 0 3 281.421 2.609 20 10 CFCDHN CC[C@@H](NCc1ccc(OC)c(C)c1)[C@H](O)C(F)(F)F ZINC000270864479 522877225 /nfs/dbraw/zinc/87/72/25/522877225.db2.gz FAPZZNBYJNYOIO-YPMHNXCESA-N 0 3 291.313 2.795 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1ccccc1[O-] ZINC000156004922 522917093 /nfs/dbraw/zinc/91/70/93/522917093.db2.gz OUUOHWOSCMUWJB-SMDDNHRTSA-N 0 3 259.353 2.928 20 10 CFCDHN COC(=O)CCCCC[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000289696997 522993908 /nfs/dbraw/zinc/99/39/08/522993908.db2.gz FWLUTEXYGOTCLF-UHFFFAOYSA-N 0 3 279.380 2.832 20 10 CFCDHN C[N@H+](Cc1cc2c(cc1[O-])OCO2)C(C1CC1)C1CC1 ZINC000066078951 523185829 /nfs/dbraw/zinc/18/58/29/523185829.db2.gz ILRRWFLOMDWMKR-UHFFFAOYSA-N 0 3 275.348 2.741 20 10 CFCDHN C[N@@H+](Cc1cc2c(cc1[O-])OCO2)C(C1CC1)C1CC1 ZINC000066078951 523185838 /nfs/dbraw/zinc/18/58/38/523185838.db2.gz ILRRWFLOMDWMKR-UHFFFAOYSA-N 0 3 275.348 2.741 20 10 CFCDHN CO[C@@H](C[NH2+]Cc1cc(Cl)cc(C)c1[O-])C1CC1 ZINC000293617477 523539092 /nfs/dbraw/zinc/53/90/92/523539092.db2.gz KMELGVDPWUAYLI-ZDUSSCGKSA-N 0 3 269.772 2.869 20 10 CFCDHN CC[C@H](C)N(C)CC[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297918735 523923220 /nfs/dbraw/zinc/92/32/20/523923220.db2.gz XAVPSVYWHWWDLI-JSGCOSHPSA-N 0 3 262.397 2.699 20 10 CFCDHN CN1CCc2cc(CN[C@@H]3CCCc4c3cnn4C)ccc21 ZINC000237050528 523996518 /nfs/dbraw/zinc/99/65/18/523996518.db2.gz PSYZRHNUJROEFN-MRXNPFEDSA-N 0 3 296.418 2.580 20 10 CFCDHN COc1ccc(CNCCNC(=O)OC(C)(C)C)cc1C ZINC000218179574 524070446 /nfs/dbraw/zinc/07/04/46/524070446.db2.gz IQBKZQRFKZXNEB-UHFFFAOYSA-N 0 3 294.395 2.618 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCSCC[C@H]2C)c1 ZINC000191817449 524747118 /nfs/dbraw/zinc/74/71/18/524747118.db2.gz SDJQYSCQTFTZBI-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCSCC[C@H]2C)c1 ZINC000191817449 524747125 /nfs/dbraw/zinc/74/71/25/524747125.db2.gz SDJQYSCQTFTZBI-LLVKDONJSA-N 0 3 267.394 2.728 20 10 CFCDHN C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1[O-])CN1CCCC1 ZINC000062748556 524749663 /nfs/dbraw/zinc/74/96/63/524749663.db2.gz QPFCQIYJYHDKRH-STQMWFEESA-N 0 3 280.387 2.914 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCSC2)c1 ZINC000230667604 524765450 /nfs/dbraw/zinc/76/54/50/524765450.db2.gz PCBOFWPVDARNKL-NXEZZACHSA-N 0 3 253.367 2.557 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCCc2c[nH]nc2C)c1 ZINC000050182440 524768043 /nfs/dbraw/zinc/76/80/43/524768043.db2.gz KFTOUESWMOSTSK-LBPRGKRZSA-N 0 3 289.379 2.716 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCc2cccnc2)c1 ZINC000037717789 524769949 /nfs/dbraw/zinc/76/99/49/524769949.db2.gz ABOXPLPRBZENGY-LBPRGKRZSA-N 0 3 272.348 2.689 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2ccc(C)nc2)c1 ZINC000062051030 524771718 /nfs/dbraw/zinc/77/17/18/524771718.db2.gz GKUSATSHNUHVBX-LBPRGKRZSA-N 0 3 272.348 2.955 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@](C)(OC)C2CC2)c1 ZINC000291370597 524772588 /nfs/dbraw/zinc/77/25/88/524772588.db2.gz YSJLZXSXDMGNNU-MEDUHNTESA-N 0 3 279.380 2.867 20 10 CFCDHN Cc1cc(CN[C@H](CO)c2ccccc2)ccc1N(C)C ZINC000272554828 524780226 /nfs/dbraw/zinc/78/02/26/524780226.db2.gz RLXAVOBCDLSTIV-QGZVFWFLSA-N 0 3 284.403 2.884 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+]Cc2ccn(C)c2)c1[O-] ZINC000271842499 524872293 /nfs/dbraw/zinc/87/22/93/524872293.db2.gz REVQABRBQFXIGD-UHFFFAOYSA-N 0 3 264.756 2.982 20 10 CFCDHN C[C@H]([NH2+]C1CCN(c2ncccn2)CC1)c1ccccc1[O-] ZINC000192712779 525298480 /nfs/dbraw/zinc/29/84/80/525298480.db2.gz AWJPPPVYXBBTMJ-ZDUSSCGKSA-N 0 3 298.390 2.502 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CCc3cc[nH]c(=O)c3C2)cc1C ZINC000277026464 525318524 /nfs/dbraw/zinc/31/85/24/525318524.db2.gz LZCGHFWQBHRBST-UHFFFAOYSA-N 0 3 284.359 2.668 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CCc3cc[nH]c(=O)c3C2)cc1C ZINC000277026464 525318530 /nfs/dbraw/zinc/31/85/30/525318530.db2.gz LZCGHFWQBHRBST-UHFFFAOYSA-N 0 3 284.359 2.668 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280610702 525341616 /nfs/dbraw/zinc/34/16/16/525341616.db2.gz YYDHTOJDXMZBLZ-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000280610702 525341624 /nfs/dbraw/zinc/34/16/24/525341624.db2.gz YYDHTOJDXMZBLZ-ZFWWWQNUSA-N 0 3 263.381 2.826 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@H](c3nccn3C)C2)c1 ZINC000365830306 525342720 /nfs/dbraw/zinc/34/27/20/525342720.db2.gz KDIYFXHDCHKVQZ-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@H](c3nccn3C)C2)c1 ZINC000365830306 525342727 /nfs/dbraw/zinc/34/27/27/525342727.db2.gz KDIYFXHDCHKVQZ-AWEZNQCLSA-N 0 3 285.391 2.814 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]CCOCC(F)(F)C(F)F)c1 ZINC000277420246 525348509 /nfs/dbraw/zinc/34/85/09/525348509.db2.gz AIWONDRVFBYYJZ-UHFFFAOYSA-N 0 3 295.276 2.707 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)CC(C)C)c1 ZINC000040775409 525365515 /nfs/dbraw/zinc/36/55/15/525365515.db2.gz CNZIMUCKHCNKOU-QWHCGFSZSA-N 0 3 251.370 2.758 20 10 CFCDHN C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccccc1[O-] ZINC000037649181 525416309 /nfs/dbraw/zinc/41/63/09/525416309.db2.gz HLZGDGBDCXBCRA-QWHCGFSZSA-N 0 3 260.381 2.527 20 10 CFCDHN C[C@@H](NCCOCC(F)F)c1ccc(N(C)C)cc1 ZINC000276246167 525453818 /nfs/dbraw/zinc/45/38/18/525453818.db2.gz OVIFPTVEERDYKC-LLVKDONJSA-N 0 3 272.339 2.685 20 10 CFCDHN C[C@@H]([NH2+]CCc1ccccn1)c1cc(F)ccc1[O-] ZINC000094616674 525462505 /nfs/dbraw/zinc/46/25/05/525462505.db2.gz NYRNWXGFNLOCHY-LLVKDONJSA-N 0 3 260.312 2.820 20 10 CFCDHN C[C@@H](NCc1ncccc1N(C)C)c1ccccc1O ZINC000289883980 525561612 /nfs/dbraw/zinc/56/16/12/525561612.db2.gz SDUHGFUJVCEKRL-GFCCVEGCSA-N 0 3 271.364 2.704 20 10 CFCDHN C[C@H]([NH2+][C@@H]1COc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000290207533 525585712 /nfs/dbraw/zinc/58/57/12/525585712.db2.gz HCJYMYQTDKMCAQ-KHIZAZIESA-N 0 3 285.343 2.537 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1ccccc1[O-] ZINC000217689615 525619864 /nfs/dbraw/zinc/61/98/64/525619864.db2.gz BPYFCLXCAUKXSE-QEJZJMRPSA-N 0 3 260.381 2.670 20 10 CFCDHN C[C@@](O)(C[NH2+]Cc1ccccc1[O-])C1CCCCC1 ZINC000191673559 525776317 /nfs/dbraw/zinc/77/63/17/525776317.db2.gz YFMYOIDGAFONQS-MRXNPFEDSA-N 0 3 263.381 2.813 20 10 CFCDHN COc1cccc(C[NH+]2CCC(CF)CC2)c1[O-] ZINC000295097383 525931917 /nfs/dbraw/zinc/93/19/17/525931917.db2.gz SFQYTAZTTJXIIK-UHFFFAOYSA-N 0 3 253.317 2.582 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H](C)CC[S@](C)=O)c([O-])c1 ZINC000228615624 525932734 /nfs/dbraw/zinc/93/27/34/525932734.db2.gz LLZPTMXKARTILD-PZROIBLQSA-N 0 3 269.410 2.508 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H](C)CO[C@H]2CCOC2)c([O-])c1C ZINC000273598692 525941285 /nfs/dbraw/zinc/94/12/85/525941285.db2.gz RKKVLFQEUVZJSK-SNPRPXQTSA-N 0 3 293.407 2.854 20 10 CFCDHN COc1cccc(C[NH2+]CCCCOC(C)C)c1[O-] ZINC000228565121 526013866 /nfs/dbraw/zinc/01/38/66/526013866.db2.gz QWACFXULRCUVHD-UHFFFAOYSA-N 0 3 267.369 2.696 20 10 CFCDHN COc1cccc(C[NH2+]CCSC(C)C)c1[O-] ZINC000289928556 526015871 /nfs/dbraw/zinc/01/58/71/526015871.db2.gz AGIAKYSNRASMMT-UHFFFAOYSA-N 0 3 255.383 2.632 20 10 CFCDHN COc1cccc(C[NH2+]C[C@@](C)(O)C2CCCCC2)c1[O-] ZINC000191670307 526019355 /nfs/dbraw/zinc/01/93/55/526019355.db2.gz CLDWMQVWQZRXML-QGZVFWFLSA-N 0 3 293.407 2.822 20 10 CFCDHN COc1cccc(OCC[N@H+](C)Cc2ccccc2[O-])c1 ZINC000157251361 526231020 /nfs/dbraw/zinc/23/10/20/526231020.db2.gz XOZGIUVDSRKSHR-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN COc1cccc(OCC[N@@H+](C)Cc2ccccc2[O-])c1 ZINC000157251361 526231023 /nfs/dbraw/zinc/23/10/23/526231023.db2.gz XOZGIUVDSRKSHR-UHFFFAOYSA-N 0 3 287.359 2.912 20 10 CFCDHN [O-]c1cc2c(cc1C[NH2+][C@@H]1[C@@H]3Cc4ccccc4[C@@H]31)OCO2 ZINC000290542404 526336569 /nfs/dbraw/zinc/33/65/69/526336569.db2.gz RJLARLYAGRDHDN-JEBQAFNWSA-N 0 3 295.338 2.549 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000366533848 526371227 /nfs/dbraw/zinc/37/12/27/526371227.db2.gz USEPCDLBMXELBK-OAHLLOKOSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000366533848 526371229 /nfs/dbraw/zinc/37/12/29/526371229.db2.gz USEPCDLBMXELBK-OAHLLOKOSA-N 0 3 261.365 2.641 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1CCOC2(CCSCC2)C1 ZINC000157729003 526374738 /nfs/dbraw/zinc/37/47/38/526374738.db2.gz BPLUPMRKVZETRD-CQSZACIVSA-N 0 3 293.432 2.927 20 10 CFCDHN COc1ccc(C[NH2+][C@H](C)Cc2ccoc2)c([O-])c1 ZINC000754045306 574065366 /nfs/dbraw/zinc/06/53/66/574065366.db2.gz FFFQWRYULBJOFZ-LLVKDONJSA-N 0 3 261.321 2.715 20 10 CFCDHN CC(C)(C)OC(=O)CCC[NH2+]Cc1ccccc1[O-] ZINC000744450647 574075286 /nfs/dbraw/zinc/07/52/86/574075286.db2.gz ZWXFWRXFGWWREO-UHFFFAOYSA-N 0 3 265.353 2.604 20 10 CFCDHN CCOCC[N@H+](CC)Cc1cc2c(cc1[O-])CCC2 ZINC000730801649 574097625 /nfs/dbraw/zinc/09/76/25/574097625.db2.gz FFEKGUYRTVMPLA-UHFFFAOYSA-N 0 3 263.381 2.739 20 10 CFCDHN CCOCC[N@@H+](CC)Cc1cc2c(cc1[O-])CCC2 ZINC000730801649 574097626 /nfs/dbraw/zinc/09/76/26/574097626.db2.gz FFEKGUYRTVMPLA-UHFFFAOYSA-N 0 3 263.381 2.739 20 10 CFCDHN Cc1cc(C)c(O)c(CN2CCN(C3CCC3)CC2)c1 ZINC000754726008 574128115 /nfs/dbraw/zinc/12/81/15/574128115.db2.gz JWAUSRMEUHDKGB-UHFFFAOYSA-N 0 3 274.408 2.679 20 10 CFCDHN CCCC[N@@H+]1CCCC[C@H]1CNC(=O)c1cc([O-])cs1 ZINC000732281652 574149832 /nfs/dbraw/zinc/14/98/32/574149832.db2.gz VQSICXKAXKEUNX-LBPRGKRZSA-N 0 3 296.436 2.838 20 10 CFCDHN CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([O-])cs1 ZINC000732281652 574149833 /nfs/dbraw/zinc/14/98/33/574149833.db2.gz VQSICXKAXKEUNX-LBPRGKRZSA-N 0 3 296.436 2.838 20 10 CFCDHN CCCCN1CCCC[C@H]1CNC(=O)C1=CC(=O)CS1 ZINC000732281652 574149834 /nfs/dbraw/zinc/14/98/34/574149834.db2.gz VQSICXKAXKEUNX-LBPRGKRZSA-N 0 3 296.436 2.838 20 10 CFCDHN [O-]c1cc2c(cc1C[N@@H+]1CCC[C@H](n3ccnc3)C1)CCC2 ZINC000738158992 574158998 /nfs/dbraw/zinc/15/89/98/574158998.db2.gz PRRIYOAMVCQEPY-KRWDZBQOSA-N 0 3 297.402 2.915 20 10 CFCDHN [O-]c1cc2c(cc1C[N@H+]1CCC[C@H](n3ccnc3)C1)CCC2 ZINC000738158992 574159001 /nfs/dbraw/zinc/15/90/01/574159001.db2.gz PRRIYOAMVCQEPY-KRWDZBQOSA-N 0 3 297.402 2.915 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000738548118 574172943 /nfs/dbraw/zinc/17/29/43/574172943.db2.gz IUWYNBDELCNZMV-UHFFFAOYSA-N 0 3 294.420 2.544 20 10 CFCDHN O=C(c1cc([O-])cs1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000738548118 574172945 /nfs/dbraw/zinc/17/29/45/574172945.db2.gz IUWYNBDELCNZMV-UHFFFAOYSA-N 0 3 294.420 2.544 20 10 CFCDHN Cn1ccnc1[C@H]1CC[N@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000755789650 574187798 /nfs/dbraw/zinc/18/77/98/574187798.db2.gz ISNVXCMPBFWIDD-HNNXBMFYSA-N 0 3 297.402 2.604 20 10 CFCDHN Cn1ccnc1[C@H]1CC[N@@H+](Cc2cc3c(cc2[O-])CCC3)C1 ZINC000755789650 574187799 /nfs/dbraw/zinc/18/77/99/574187799.db2.gz ISNVXCMPBFWIDD-HNNXBMFYSA-N 0 3 297.402 2.604 20 10 CFCDHN COCCC[NH2+][C@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756342826 574226996 /nfs/dbraw/zinc/22/69/96/574226996.db2.gz LFYGXSRACOJJSQ-ONGXEEELSA-N 0 3 253.317 2.706 20 10 CFCDHN C[C@@H]1C[C@H]([NH2+]C[C@H](O)c2ccco2)c2c1c(F)ccc2[O-] ZINC000756386705 574232299 /nfs/dbraw/zinc/23/22/99/574232299.db2.gz YTKKRNCRGOIVQM-CDMKHQONSA-N 0 3 291.322 2.996 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@H](C2CC2)N(C)C)c1 ZINC000756431309 574236569 /nfs/dbraw/zinc/23/65/69/574236569.db2.gz BWZAHRLOAKEAPU-SWLSCSKDSA-N 0 3 262.397 2.691 20 10 CFCDHN CCN(CC)C(=O)C[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F ZINC000756455761 574239031 /nfs/dbraw/zinc/23/90/31/574239031.db2.gz KQURDJXZXCTCCF-PWSUYJOCSA-N 0 3 294.370 2.538 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccn2)c([O-])c1 ZINC000756478228 574240178 /nfs/dbraw/zinc/24/01/78/574240178.db2.gz GYGWBSZJNOHIQA-CYBMUJFWSA-N 0 3 299.374 2.775 20 10 CFCDHN COC(=O)N1CCC[C@H]([NH2+][C@H](C)c2ccc(C)cc2[O-])C1 ZINC000756526877 574243640 /nfs/dbraw/zinc/24/36/40/574243640.db2.gz HXTUJOJYZOSIOP-OLZOCXBDSA-N 0 3 292.379 2.582 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCOC2)c2c1c(F)ccc2[O-] ZINC000756551711 574246254 /nfs/dbraw/zinc/24/62/54/574246254.db2.gz ALLIJQBASXQTAI-CKYFFXLPSA-N 0 3 265.328 2.848 20 10 CFCDHN C[C@H]([NH2+]CCCN1CCCCC1=O)c1cc(F)ccc1[O-] ZINC000756558318 574247637 /nfs/dbraw/zinc/24/76/37/574247637.db2.gz ZJPIOXZJWMWGFB-LBPRGKRZSA-N 0 3 294.370 2.585 20 10 CFCDHN C[C@H]([NH2+]CC1(O)CCC1)c1cc2c(cc1[O-])CCCC2 ZINC000756564239 574248378 /nfs/dbraw/zinc/24/83/78/574248378.db2.gz RLZYGHNBBXGXAT-LBPRGKRZSA-N 0 3 275.392 2.837 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)C2CC2)c([O-])c1C ZINC000756576299 574249339 /nfs/dbraw/zinc/24/93/39/574249339.db2.gz MDFYSUSZEXCMOA-BLLLJJGKSA-N 0 3 263.381 2.821 20 10 CFCDHN CC[S@@](=O)CC[NH2+][C@H](C)c1cc2c(cc1[O-])CCCC2 ZINC000756576683 574249407 /nfs/dbraw/zinc/24/94/07/574249407.db2.gz NZTUMXYLENRSGC-MPBGBICISA-N 0 3 295.448 2.690 20 10 CFCDHN Cc1cc(CN[C@@H](C)c2ccc(C)c(C)c2O)[nH]n1 ZINC000756583794 574250309 /nfs/dbraw/zinc/25/03/09/574250309.db2.gz BRTWQRZHFCIKPG-LBPRGKRZSA-N 0 3 259.353 2.891 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CCOC[C@H]2CCCO2)c([O-])c1C ZINC000756582339 574250684 /nfs/dbraw/zinc/25/06/84/574250684.db2.gz HMGUIAFKKHGFML-HUUCEWRRSA-N 0 3 293.407 2.855 20 10 CFCDHN CC[C@H](CCO)[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000756602820 574251548 /nfs/dbraw/zinc/25/15/48/574251548.db2.gz FPTCBKSVSHKZHC-QWHCGFSZSA-N 0 3 251.370 2.821 20 10 CFCDHN CC[C@@H](CCO)[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756602819 574251798 /nfs/dbraw/zinc/25/17/98/574251798.db2.gz FPTCBKSVSHKZHC-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CCC[C@@H]2C)c([O-])c1 ZINC000756616098 574252725 /nfs/dbraw/zinc/25/27/25/574252725.db2.gz IAPANBPVDJTSSR-KBPBESRZSA-N 0 3 262.397 2.836 20 10 CFCDHN CCc1nncn1CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000756620733 574252747 /nfs/dbraw/zinc/25/27/47/574252747.db2.gz LXJRSGRCMIXHFS-CYBMUJFWSA-N 0 3 288.395 2.514 20 10 CFCDHN CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1cc(OC)ccc1[O-] ZINC000756628611 574253153 /nfs/dbraw/zinc/25/31/53/574253153.db2.gz WKMPCCWPMSGFNH-FRRDWIJNSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@H]([NH2+]CCN1CC[C@H](C)C1)c1cc(F)ccc1[O-] ZINC000756628457 574253171 /nfs/dbraw/zinc/25/31/71/574253171.db2.gz MHCVQYFDCDPJCL-RYUDHWBXSA-N 0 3 266.360 2.524 20 10 CFCDHN Cc1noc(CC[NH2+][C@@H]2C[C@H](C)c3c2c([O-])ccc3F)n1 ZINC000756689098 574257718 /nfs/dbraw/zinc/25/77/18/574257718.db2.gz RPWLWNLLJLULNN-GZMMTYOYSA-N 0 3 291.326 2.603 20 10 CFCDHN COCCOC[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F ZINC000756734406 574260075 /nfs/dbraw/zinc/26/00/75/574260075.db2.gz WOWHCQQEGJVXCF-GMXVVIOVSA-N 0 3 297.370 2.721 20 10 CFCDHN C[C@@H](CC[NH2+][C@H]1C[C@@H](C)c2c1c([O-])ccc2F)[S@@](C)=O ZINC000756761265 574261076 /nfs/dbraw/zinc/26/10/76/574261076.db2.gz MKCKFGLQQKYSSF-AOOACEEISA-N 0 3 299.411 2.826 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC2(CCO)CCC2)c([O-])c1 ZINC000756765682 574261216 /nfs/dbraw/zinc/26/12/16/574261216.db2.gz QPDSQEBUSPHDHL-ZDUSSCGKSA-N 0 3 263.381 2.904 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+]CC2(CCO)CCC2)c([O-])c1 ZINC000756765679 574261227 /nfs/dbraw/zinc/26/12/27/574261227.db2.gz QPDSQEBUSPHDHL-CYBMUJFWSA-N 0 3 263.381 2.904 20 10 CFCDHN C[C@H]([NH2+]CC(C)(C)CO)c1cc2c(cc1[O-])CCCC2 ZINC000756761658 574261363 /nfs/dbraw/zinc/26/13/63/574261363.db2.gz UJNMSNDZSCOEER-LBPRGKRZSA-N 0 3 277.408 2.940 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[S@](C)=O)c([O-])c1C ZINC000756762117 574261372 /nfs/dbraw/zinc/26/13/72/574261372.db2.gz OPTSNDDABHUVAV-BLWXERESSA-N 0 3 283.437 2.817 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(C)(C)O)c([O-])c1C ZINC000756819122 574265050 /nfs/dbraw/zinc/26/50/50/574265050.db2.gz QLCLAUMTAAWHRP-NEPJUHHUSA-N 0 3 251.370 2.819 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@H](C)Cc2ccncc2)c1 ZINC000749295165 574288621 /nfs/dbraw/zinc/28/86/21/574288621.db2.gz LAVOQVCCIYVNOJ-CYBMUJFWSA-N 0 3 286.375 2.907 20 10 CFCDHN CC[C@@H](C[C@H](C)CO)[NH2+]Cc1cc(C)c(C)cc1[O-] ZINC000743500270 574307480 /nfs/dbraw/zinc/30/74/80/574307480.db2.gz VGPAJCXCSWEBEK-NHYWBVRUSA-N 0 3 265.397 2.896 20 10 CFCDHN CN(C)c1ccc(CNC(C)(C)c2cnn(C)c2)cc1 ZINC000742373944 574325522 /nfs/dbraw/zinc/32/55/22/574325522.db2.gz LMJNLRSRLDQSEB-UHFFFAOYSA-N 0 3 272.396 2.511 20 10 CFCDHN CCOc1ccc(C[NH2+]CC2(O)CCCCCC2)c([O-])c1 ZINC000735507497 574327747 /nfs/dbraw/zinc/32/77/47/574327747.db2.gz UIWZNDSQSPISPW-UHFFFAOYSA-N 0 3 293.407 2.966 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CCN1CCc2ccccc21 ZINC000725849639 574330550 /nfs/dbraw/zinc/33/05/50/574330550.db2.gz SQBCXYSKBJDELF-UHFFFAOYSA-N 0 3 298.386 2.553 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@H+]3CC[C@@H](OC)C3)c2c1 ZINC000751942094 574385541 /nfs/dbraw/zinc/38/55/41/574385541.db2.gz PNBUWLUGHXYZEO-CQSZACIVSA-N 0 3 287.359 2.775 20 10 CFCDHN COc1ccc2ccc([O-])c(C[N@@H+]3CC[C@@H](OC)C3)c2c1 ZINC000751942094 574385542 /nfs/dbraw/zinc/38/55/42/574385542.db2.gz PNBUWLUGHXYZEO-CQSZACIVSA-N 0 3 287.359 2.775 20 10 CFCDHN C[C@@H]([NH2+]CCOCC(F)(F)F)c1ccccc1[O-] ZINC000104431115 617740885 /nfs/dbraw/zinc/74/08/85/617740885.db2.gz BQRHVGFEQFLTMZ-SECBINFHSA-N 0 3 263.259 2.622 20 10 CFCDHN COc1ccc(CN2CCS[C@@H](C)[C@@H]2C)c(O)c1OC ZINC000892066208 617934037 /nfs/dbraw/zinc/93/40/37/617934037.db2.gz BSQRTEKCLPUGQR-QWRGUYRKSA-N 0 3 297.420 2.735 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCN2CCCCC2)c([O-])c1 ZINC000049574619 618058029 /nfs/dbraw/zinc/05/80/29/618058029.db2.gz NMRHJIOBYVMHBX-AWEZNQCLSA-N 0 3 262.397 2.837 20 10 CFCDHN CCc1nn(C)cc1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000091741880 618179116 /nfs/dbraw/zinc/17/91/16/618179116.db2.gz JJMSUJMIKRZHGQ-CYBMUJFWSA-N 0 3 286.423 2.899 20 10 CFCDHN CCOC(CN[C@H](C)c1ccc(N(C)C)cc1)OCC ZINC000093446866 618193761 /nfs/dbraw/zinc/19/37/61/618193761.db2.gz AGYPAOSZTYUEIO-CYBMUJFWSA-N 0 3 280.412 2.802 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCOC(C)(C)C)c1[O-] ZINC000308689810 618218410 /nfs/dbraw/zinc/21/84/10/618218410.db2.gz GNMGTWDFHRKIIX-UHFFFAOYSA-N 0 3 287.787 2.959 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@](C)(OC)C2)c([O-])c1 ZINC000793218275 618250569 /nfs/dbraw/zinc/25/05/69/618250569.db2.gz QTYAMNAZJMFKMV-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@](C)(OC)C2)c([O-])c1 ZINC000793218275 618250571 /nfs/dbraw/zinc/25/05/71/618250571.db2.gz QTYAMNAZJMFKMV-INIZCTEOSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)[C@H]1C[N@H+](Cc2ccccc2[O-])CCS1 ZINC000179584754 618327636 /nfs/dbraw/zinc/32/76/36/618327636.db2.gz WUROSISWTMGORA-CQSZACIVSA-N 0 3 251.395 2.966 20 10 CFCDHN CC(C)[C@H]1C[N@@H+](Cc2ccccc2[O-])CCS1 ZINC000179584754 618327643 /nfs/dbraw/zinc/32/76/43/618327643.db2.gz WUROSISWTMGORA-CQSZACIVSA-N 0 3 251.395 2.966 20 10 CFCDHN COc1ccc(C[NH2+]CC2(SC)CCC2)c([O-])c1 ZINC000193643404 618466644 /nfs/dbraw/zinc/46/66/44/618466644.db2.gz IDPLKADJYNYKLS-UHFFFAOYSA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@@H](CCNCc1c([O-])ccc(Cl)c1F)[NH+](C)C ZINC000895292984 618511895 /nfs/dbraw/zinc/51/18/95/618511895.db2.gz IAQNWPUDZCLLCP-VIFPVBQESA-N 0 3 274.767 2.615 20 10 CFCDHN COc1cccc(CNCc2cccc([N+](=O)[O-])c2)c1O ZINC000052926129 618621367 /nfs/dbraw/zinc/62/13/67/618621367.db2.gz GBKHKVZBUGFZGF-UHFFFAOYSA-N 0 3 288.303 2.599 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCC[C@H](CO)C2)c1 ZINC000311711631 618720544 /nfs/dbraw/zinc/72/05/44/618720544.db2.gz SEDFNXMYQVCZRK-IHRRRGAJSA-N 0 3 263.381 2.902 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]C[C@H]1CCC[C@H](O)C1)CC2 ZINC000311948730 618772487 /nfs/dbraw/zinc/77/24/87/618772487.db2.gz XKVGIYQJCPHAAR-FPMFFAJLSA-N 0 3 261.365 2.520 20 10 CFCDHN CCCN(CC)CC[NH2+]Cc1c([O-])cccc1Cl ZINC000223233019 619128616 /nfs/dbraw/zinc/12/86/16/619128616.db2.gz LQXXDMSZKTZIDP-UHFFFAOYSA-N 0 3 270.804 2.867 20 10 CFCDHN COc1ccc(O)c(CNCc2cnc3onc(C)c3c2)c1 ZINC000894260058 619290533 /nfs/dbraw/zinc/29/05/33/619290533.db2.gz MWRFBZANAHALGT-UHFFFAOYSA-N 0 3 299.330 2.535 20 10 CFCDHN COc1ccc(O)c([C@H](C)NCc2c(C)ccnc2N)c1 ZINC000894783224 619466713 /nfs/dbraw/zinc/46/67/13/619466713.db2.gz RDFPMOBJKAGQEI-NSHDSACASA-N 0 3 287.363 2.537 20 10 CFCDHN [O-]c1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1COCO1 ZINC000894871411 619492811 /nfs/dbraw/zinc/49/28/11/619492811.db2.gz DQCFNMVCAOCIRJ-INIZCTEOSA-N 0 3 285.343 2.522 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@H]2CCC3(CCC3)O2)c([O-])c1 ZINC000895677703 619580717 /nfs/dbraw/zinc/58/07/17/619580717.db2.gz QFAKCGAXBCUMRZ-CQSZACIVSA-N 0 3 261.365 2.892 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H]1CCC[C@]12CCCO2 ZINC000895679432 619581106 /nfs/dbraw/zinc/58/11/06/619581106.db2.gz GSQHXLZCWWIOEJ-CABCVRRESA-N 0 3 265.328 2.723 20 10 CFCDHN CCOc1ccc(C[N@@H+]2C[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000895780369 619609056 /nfs/dbraw/zinc/60/90/56/619609056.db2.gz IOSVXXNGVWHZAJ-BETUJISGSA-N 0 3 279.405 2.586 20 10 CFCDHN CCOc1ccc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c([O-])c1 ZINC000895780369 619609058 /nfs/dbraw/zinc/60/90/58/619609058.db2.gz IOSVXXNGVWHZAJ-BETUJISGSA-N 0 3 279.405 2.586 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895842037 619616881 /nfs/dbraw/zinc/61/68/81/619616881.db2.gz DWVQOAHCXHHZHT-HOCLYGCPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c([O-])c1 ZINC000895842037 619616882 /nfs/dbraw/zinc/61/68/82/619616882.db2.gz DWVQOAHCXHHZHT-HOCLYGCPSA-N 0 3 261.365 2.702 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCC2(C[C@@H]1F)OCCO2)c1ccccc1[O-] ZINC000895852380 619623032 /nfs/dbraw/zinc/62/30/32/619623032.db2.gz UNBQSIFPHWOVEO-FPMFFAJLSA-N 0 3 295.354 2.677 20 10 CFCDHN C[N@H+](CCc1ccc2c(c1)OCO2)Cc1ccccc1[O-] ZINC000895884525 619627196 /nfs/dbraw/zinc/62/71/96/619627196.db2.gz PNDAXBWQUWQLLJ-UHFFFAOYSA-N 0 3 285.343 2.795 20 10 CFCDHN C[N@@H+](CCc1ccc2c(c1)OCO2)Cc1ccccc1[O-] ZINC000895884525 619627199 /nfs/dbraw/zinc/62/71/99/619627199.db2.gz PNDAXBWQUWQLLJ-UHFFFAOYSA-N 0 3 285.343 2.795 20 10 CFCDHN CC1(C)CC[C@H](CO)[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000895924255 619635568 /nfs/dbraw/zinc/63/55/68/619635568.db2.gz UJZNYKCZFOHFSN-CYBMUJFWSA-N 0 3 267.344 2.514 20 10 CFCDHN CC1(C)CC[C@H](CO)[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000895924255 619635570 /nfs/dbraw/zinc/63/55/70/619635570.db2.gz UJZNYKCZFOHFSN-CYBMUJFWSA-N 0 3 267.344 2.514 20 10 CFCDHN CCN(CC)c1ccc(CN2CC(COC)C2)cc1 ZINC000895972221 619646983 /nfs/dbraw/zinc/64/69/83/619646983.db2.gz TZCNLUQJYRYDIT-UHFFFAOYSA-N 0 3 262.397 2.611 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000896281270 619709340 /nfs/dbraw/zinc/70/93/40/619709340.db2.gz VKYLFZURVKOXTC-MFKMUULPSA-N 0 3 289.297 2.900 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@](C)(O)c2cccc(F)c2)c([O-])c1 ZINC000896562685 619763448 /nfs/dbraw/zinc/76/34/48/619763448.db2.gz YAAJASFQPKTJSN-QGZVFWFLSA-N 0 3 289.350 2.837 20 10 CFCDHN CN(C)[C@H](CC[NH2+]Cc1cc(F)ccc1[O-])C(F)(F)F ZINC000896878447 619854157 /nfs/dbraw/zinc/85/41/57/619854157.db2.gz HFUPAJKROHKQEL-GFCCVEGCSA-N 0 3 294.292 2.504 20 10 CFCDHN CCOc1ccc(C[NH2+]C[C@@H]2CC[C@@H](C3CC3)O2)c([O-])c1 ZINC000897512351 620199794 /nfs/dbraw/zinc/19/97/94/620199794.db2.gz XZQMZYCNSCCYNC-RDJZCZTQSA-N 0 3 291.391 2.838 20 10 CFCDHN C[C@H](NCCCSc1nccs1)c1nccn1C ZINC000182993029 625410563 /nfs/dbraw/zinc/41/05/63/625410563.db2.gz PJKVFYJHUILHND-JTQLQIEISA-N 0 3 282.438 2.710 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(CC(F)F)C1)c1ccccc1[O-] ZINC000841765151 620264401 /nfs/dbraw/zinc/26/44/01/620264401.db2.gz NHVPIXRMYCPGBC-YPMHNXCESA-N 0 3 284.350 2.772 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071766 620333544 /nfs/dbraw/zinc/33/35/44/620333544.db2.gz RZKGDLZLEJIPHA-LBPRGKRZSA-N 0 3 274.389 2.913 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071766 620333546 /nfs/dbraw/zinc/33/35/46/620333546.db2.gz RZKGDLZLEJIPHA-LBPRGKRZSA-N 0 3 274.389 2.913 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+][C@H]2COC[C@@H]2C2CC2)c1[O-] ZINC000898381289 620378943 /nfs/dbraw/zinc/37/89/43/620378943.db2.gz CSILFMPDKMURLJ-OLZOCXBDSA-N 0 3 297.782 2.569 20 10 CFCDHN COC[C@@H](C[NH2+][C@H]1CCc2cccc([O-])c21)C(C)C ZINC000927096162 620452156 /nfs/dbraw/zinc/45/21/56/620452156.db2.gz JMGQFGVRSPSJHU-KGLIPLIRSA-N 0 3 263.381 2.888 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1C)c1ccc(C)cc1[O-] ZINC000903299803 621314157 /nfs/dbraw/zinc/31/41/57/621314157.db2.gz FCWXVPAJLWDBJT-VHDGCEQUSA-N 0 3 262.397 2.834 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+]Cc1ccc3nonc3c1)CC2 ZINC000903329202 621340510 /nfs/dbraw/zinc/34/05/10/621340510.db2.gz QDUULPDNBZBKMI-CYBMUJFWSA-N 0 3 281.315 2.706 20 10 CFCDHN CC[C@@H](NCc1cn(C)cn1)c1ccc(C)cc1O ZINC000903351193 621343038 /nfs/dbraw/zinc/34/30/38/621343038.db2.gz IQEPOHCHBLZGII-CQSZACIVSA-N 0 3 259.353 2.675 20 10 CFCDHN Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC23CCOCC3)c([O-])c1 ZINC000903391623 621351024 /nfs/dbraw/zinc/35/10/24/621351024.db2.gz ZQWTVBRMZAVGEV-CJNGLKHVSA-N 0 3 291.391 2.689 20 10 CFCDHN Cc1ncccc1CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000903415890 621366234 /nfs/dbraw/zinc/36/62/34/621366234.db2.gz NNORFTMOPHCYOP-CYBMUJFWSA-N 0 3 256.349 2.989 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]Cc1ccc(CCO)cc1)CC2 ZINC000903402967 621368982 /nfs/dbraw/zinc/36/89/82/621368982.db2.gz JOEBBWAGBGPGLP-INIZCTEOSA-N 0 3 283.371 2.704 20 10 CFCDHN Cc1cccc(CN2CCOc3ccc(N)cc3C2)c1O ZINC000903944792 621483384 /nfs/dbraw/zinc/48/33/84/621483384.db2.gz NFEATMPAIBFIKQ-UHFFFAOYSA-N 0 3 284.359 2.677 20 10 CFCDHN [O-]c1ccc(Cl)cc1CN1CC[C@@]2(C1)CCCC[NH2+]2 ZINC000904431509 621595266 /nfs/dbraw/zinc/59/52/66/621595266.db2.gz VLAMNDRIJUJAOE-OAHLLOKOSA-N 0 3 280.799 2.764 20 10 CFCDHN Cc1ccc(CC[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000183507300 625507020 /nfs/dbraw/zinc/50/70/20/625507020.db2.gz FNARWSGZFQFXLB-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN COC(=O)Cc1ccccc1C[N@H+](C)Cc1ccccc1[O-] ZINC000157249382 623022277 /nfs/dbraw/zinc/02/22/77/623022277.db2.gz LPSOCIPAAXSRQR-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN COC(=O)Cc1ccccc1C[N@@H+](C)Cc1ccccc1[O-] ZINC000157249382 623022282 /nfs/dbraw/zinc/02/22/82/623022282.db2.gz LPSOCIPAAXSRQR-UHFFFAOYSA-N 0 3 299.370 2.740 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC2CCC(O)CC2)c1 ZINC000227623520 623114345 /nfs/dbraw/zinc/11/43/45/623114345.db2.gz BAVQEPQTWVTCIV-IYXRBSQSSA-N 0 3 263.381 2.902 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000062748330 623295880 /nfs/dbraw/zinc/29/58/80/623295880.db2.gz GUVPYCYVGAKTHA-NEPJUHHUSA-N 0 3 266.360 2.524 20 10 CFCDHN CCN(CC)c1ccc(CN2CC[C@@](O)(C(F)F)C2)cc1 ZINC000824726381 623553015 /nfs/dbraw/zinc/55/30/15/623553015.db2.gz LAEZTEHMSGKASO-INIZCTEOSA-N 0 3 298.377 2.735 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@H](C(C)C)[C@H](CO)C(C)C ZINC000824846419 623576400 /nfs/dbraw/zinc/57/64/00/623576400.db2.gz RRARTVHYPHUQRM-RHSMWYFYSA-N 0 3 295.423 2.780 20 10 CFCDHN COc1cccc(C[N@@H+](C)[C@H]2C[C@@H](OC)C23CCC3)c1[O-] ZINC000825103377 623629797 /nfs/dbraw/zinc/62/97/97/623629797.db2.gz DGLDPIOSOZQLQL-LSDHHAIUSA-N 0 3 291.391 2.790 20 10 CFCDHN COc1cccc(C[N@H+](C)[C@H]2C[C@@H](OC)C23CCC3)c1[O-] ZINC000825103377 623629805 /nfs/dbraw/zinc/62/98/05/623629805.db2.gz DGLDPIOSOZQLQL-LSDHHAIUSA-N 0 3 291.391 2.790 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H](C)[C@@H](OC)C2CC2)c([O-])c1 ZINC000825099069 623629920 /nfs/dbraw/zinc/62/99/20/623629920.db2.gz TZWNCKVOSUGMDO-MEDUHNTESA-N 0 3 279.380 2.694 20 10 CFCDHN CO[C@H]1C[C@@H]([N@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103977 623631535 /nfs/dbraw/zinc/63/15/35/623631535.db2.gz JNLZRGDJSWQDPP-CABCVRRESA-N 0 3 279.355 2.921 20 10 CFCDHN CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(F)ccc2[O-])C12CCC2 ZINC000825103977 623631537 /nfs/dbraw/zinc/63/15/37/623631537.db2.gz JNLZRGDJSWQDPP-CABCVRRESA-N 0 3 279.355 2.921 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCC[C@H]2COC)c([O-])c1 ZINC000825294550 623665855 /nfs/dbraw/zinc/66/58/55/623665855.db2.gz TULIEFBGBNPLEX-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCC[C@H]2COC)c([O-])c1 ZINC000825294550 623665861 /nfs/dbraw/zinc/66/58/61/623665861.db2.gz TULIEFBGBNPLEX-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CC(C)[N@@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[O-])C1 ZINC000825331686 623674577 /nfs/dbraw/zinc/67/45/77/623674577.db2.gz LMVPKCXDUYCICJ-AWEZNQCLSA-N 0 3 282.815 2.960 20 10 CFCDHN CC(C)[N@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[O-])C1 ZINC000825331686 623674579 /nfs/dbraw/zinc/67/45/79/623674579.db2.gz LMVPKCXDUYCICJ-AWEZNQCLSA-N 0 3 282.815 2.960 20 10 CFCDHN COc1ccc(N2CCN(CC3=CCCC3)CC2)cc1 ZINC000827712519 624073365 /nfs/dbraw/zinc/07/33/65/624073365.db2.gz IGHPNBHNXSHAOX-UHFFFAOYSA-N 0 3 272.392 2.928 20 10 CFCDHN C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc(F)ccc1[O-] ZINC000827733847 624079901 /nfs/dbraw/zinc/07/99/01/624079901.db2.gz PSCHLICPJLPMSR-YVEFUNNKSA-N 0 3 289.350 2.786 20 10 CFCDHN CCOC(=O)[C@@]1(C)CCC[C@H]1[NH2+]Cc1ccccc1[O-] ZINC000827751365 624085090 /nfs/dbraw/zinc/08/50/90/624085090.db2.gz TZDXWKNUXFCXTA-ZBFHGGJFSA-N 0 3 277.364 2.604 20 10 CFCDHN C[S@@](=O)CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000827813593 624099826 /nfs/dbraw/zinc/09/98/26/624099826.db2.gz VWWPEKOZDJZHBN-LJQANCHMSA-N 0 3 281.421 2.515 20 10 CFCDHN C[S@@](=O)CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000827813593 624099827 /nfs/dbraw/zinc/09/98/27/624099827.db2.gz VWWPEKOZDJZHBN-LJQANCHMSA-N 0 3 281.421 2.515 20 10 CFCDHN CCn1nccc1C[NH2+]Cc1cc(Cl)cc(C)c1[O-] ZINC000827956839 624138286 /nfs/dbraw/zinc/13/82/86/624138286.db2.gz RHMLQGOYVNBRLM-UHFFFAOYSA-N 0 3 279.771 2.860 20 10 CFCDHN CCn1nccc1CNCc1cc(Cl)cc(C)c1O ZINC000827956839 624138290 /nfs/dbraw/zinc/13/82/90/624138290.db2.gz RHMLQGOYVNBRLM-UHFFFAOYSA-N 0 3 279.771 2.860 20 10 CFCDHN CN(C)c1ccc(CNCc2cnn(C3CCC3)c2)cc1 ZINC000921495958 624901990 /nfs/dbraw/zinc/90/19/90/624901990.db2.gz KIJAYJUCNKGZKU-UHFFFAOYSA-N 0 3 284.407 2.964 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000179899665 624982185 /nfs/dbraw/zinc/98/21/85/624982185.db2.gz QDFQACZUGOFZTF-LBPRGKRZSA-N 0 3 284.359 2.603 20 10 CFCDHN CNC(=O)c1cccc(C[NH2+][C@H](C)c2ccccc2[O-])c1 ZINC000179899682 624982327 /nfs/dbraw/zinc/98/23/27/624982327.db2.gz QDFQACZUGOFZTF-GFCCVEGCSA-N 0 3 284.359 2.603 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCOC[C@@H]2CCOC2)c([O-])c1 ZINC000185523829 625735931 /nfs/dbraw/zinc/73/59/31/625735931.db2.gz CLQZDRKNSNQFJC-GJZGRUSLSA-N 0 3 293.407 2.794 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCc2cccc([O-])c21)[C@H]1CCCO1 ZINC000834694499 625787907 /nfs/dbraw/zinc/78/79/07/625787907.db2.gz VULQBVUWTORQGL-KCQAQPDRSA-N 0 3 261.365 2.927 20 10 CFCDHN CO[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000834702598 625792186 /nfs/dbraw/zinc/79/21/86/625792186.db2.gz SHVJABSJDANKDX-GZBFAFLISA-N 0 3 261.365 2.784 20 10 CFCDHN CC[C@@H]([NH2+]CC[C@](C)(O)COC)c1ccc(C)cc1[O-] ZINC000834844158 625900298 /nfs/dbraw/zinc/90/02/98/625900298.db2.gz NNEBYHMFTMAQQF-ZBFHGGJFSA-N 0 3 281.396 2.529 20 10 CFCDHN CCO[C@@H]1COC[C@H]1[NH2+][C@@H](CC)c1ccc(C)cc1[O-] ZINC000834904854 625917382 /nfs/dbraw/zinc/91/73/82/625917382.db2.gz RZRPGSPYRDMDDN-SQWLQELKSA-N 0 3 279.380 2.545 20 10 CFCDHN C[C@](O)(C[NH2+]Cc1ccccc1[O-])c1cccc(F)c1 ZINC000922563421 626311924 /nfs/dbraw/zinc/31/19/24/626311924.db2.gz GYFQXEQQLHERIV-INIZCTEOSA-N 0 3 275.323 2.529 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H]1CCS[C@H](C)C1 ZINC000922840840 626377854 /nfs/dbraw/zinc/37/78/54/626377854.db2.gz BNGRVIIJAXXFDU-GHMZBOCLSA-N 0 3 267.394 2.775 20 10 CFCDHN C[C@@H]1CC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1(C)C ZINC000758998483 626623339 /nfs/dbraw/zinc/62/33/39/626623339.db2.gz CKNRTZUMLAMLBJ-IAQYHMDHSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1(C)C ZINC000758998483 626623342 /nfs/dbraw/zinc/62/33/42/626623342.db2.gz CKNRTZUMLAMLBJ-IAQYHMDHSA-N 0 3 291.391 2.686 20 10 CFCDHN C[C@@H](NCc1ccc2c(c1)CCO2)c1cccc(CO)c1 ZINC000760174023 626717428 /nfs/dbraw/zinc/71/74/28/626717428.db2.gz WWICJKIXOZCRLD-CYBMUJFWSA-N 0 3 283.371 2.965 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccn1 ZINC000851791696 634531915 /nfs/dbraw/zinc/53/19/15/634531915.db2.gz FNHHJXBKHCQGEV-QGZVFWFLSA-N 0 3 286.375 2.733 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])C[C@@H](O)c1ccccn1 ZINC000851791696 634531920 /nfs/dbraw/zinc/53/19/20/634531920.db2.gz FNHHJXBKHCQGEV-QGZVFWFLSA-N 0 3 286.375 2.733 20 10 CFCDHN COc1cccc([O-])c1C[NH2+][C@@H](C)C[C@@H](O)c1ccco1 ZINC000763524831 626994826 /nfs/dbraw/zinc/99/48/26/626994826.db2.gz MRAGLDBZIPHMMB-SMDDNHRTSA-N 0 3 291.347 2.596 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+][C@H](CCO)C2CCOCC2)c1 ZINC000763559874 626998441 /nfs/dbraw/zinc/99/84/41/626998441.db2.gz XQDOPVYXTSMLQI-CZUORRHYSA-N 0 3 293.407 2.529 20 10 CFCDHN CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000765452342 627139381 /nfs/dbraw/zinc/13/93/81/627139381.db2.gz FEXSWMIHXXCZAT-BFHYXJOUSA-N 0 3 291.439 2.706 20 10 CFCDHN COc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)c([O-])c1 ZINC000767926195 627295364 /nfs/dbraw/zinc/29/53/64/627295364.db2.gz CDEPZATYGJLSCJ-ZDUSSCGKSA-N 0 3 277.364 2.592 20 10 CFCDHN CCOc1ccc(C[N@H+](C)[C@@H]2CCSC2)c([O-])c1 ZINC000768263896 627329854 /nfs/dbraw/zinc/32/98/54/627329854.db2.gz YPHXMYLAHFPPKU-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)[C@@H]2CCSC2)c([O-])c1 ZINC000768263896 627329857 /nfs/dbraw/zinc/32/98/57/627329857.db2.gz YPHXMYLAHFPPKU-GFCCVEGCSA-N 0 3 267.394 2.728 20 10 CFCDHN CCC1(C)CC[NH+](Cc2cc3c(cc2[O-])OC[C@H]3O)CC1 ZINC000768443294 627343017 /nfs/dbraw/zinc/34/30/17/627343017.db2.gz DUVLXNWENWHCPR-OAHLLOKOSA-N 0 3 291.391 2.830 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)c1[O-] ZINC000768519423 627349196 /nfs/dbraw/zinc/34/91/96/627349196.db2.gz PHICSTUQHPEWGR-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c1[O-] ZINC000768519423 627349199 /nfs/dbraw/zinc/34/91/99/627349199.db2.gz PHICSTUQHPEWGR-WDEREUQCSA-N 0 3 299.798 2.647 20 10 CFCDHN CCOc1ccc(CN(CC)Cc2cnn(C)c2)c(O)c1 ZINC000769043652 627398560 /nfs/dbraw/zinc/39/85/60/627398560.db2.gz SXZBXRBMPPSVGQ-UHFFFAOYSA-N 0 3 289.379 2.547 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCN(C)c2ccccc2C1 ZINC000769319940 627423993 /nfs/dbraw/zinc/42/39/93/627423993.db2.gz FYDDEYZBFDRWEU-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCN(C)c2ccccc2C1 ZINC000769319940 627423997 /nfs/dbraw/zinc/42/39/97/627423997.db2.gz FYDDEYZBFDRWEU-UHFFFAOYSA-N 0 3 298.386 2.853 20 10 CFCDHN CCOc1ccc(C[N@H+](CCC(=O)OC)C(C)C)c([O-])c1 ZINC000769404653 627435210 /nfs/dbraw/zinc/43/52/10/627435210.db2.gz NBQXFMSWEYDIKW-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CCOc1ccc(C[N@@H+](CCC(=O)OC)C(C)C)c([O-])c1 ZINC000769404653 627435213 /nfs/dbraw/zinc/43/52/13/627435213.db2.gz NBQXFMSWEYDIKW-UHFFFAOYSA-N 0 3 295.379 2.564 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC000769464411 627443401 /nfs/dbraw/zinc/44/34/01/627443401.db2.gz WJZXPHKWPIHJMC-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCCOC(C)(C)C2)c([O-])c1 ZINC000769464411 627443406 /nfs/dbraw/zinc/44/34/06/627443406.db2.gz WJZXPHKWPIHJMC-UHFFFAOYSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(CN[C@H](CO)c2ccsc2)c(O)c1 ZINC000769936873 627489863 /nfs/dbraw/zinc/48/98/63/627489863.db2.gz ZXWGFMSGLIKAJB-CQSZACIVSA-N 0 3 293.388 2.676 20 10 CFCDHN COc1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c([O-])c1 ZINC000771888404 627643330 /nfs/dbraw/zinc/64/33/30/627643330.db2.gz OTDLPCDHRFNKAQ-CJNGLKHVSA-N 0 3 279.380 2.694 20 10 CFCDHN CCn1nccc1CN[C@H](C)c1ccc(N(C)C)cc1 ZINC000775365122 628015530 /nfs/dbraw/zinc/01/55/30/628015530.db2.gz UHIBKHLJIWTAAN-CYBMUJFWSA-N 0 3 272.396 2.820 20 10 CFCDHN CC[C@H]([NH2+]CCN1CC[C@H](C)C1)c1ccccc1[O-] ZINC000775416710 628023839 /nfs/dbraw/zinc/02/38/39/628023839.db2.gz XPEFNCHDJHWSKN-ZFWWWQNUSA-N 0 3 262.397 2.775 20 10 CFCDHN CC[C@H]([NH2+]CCN1CCC[C@@H]1C)c1ccccc1[O-] ZINC000775509003 628032362 /nfs/dbraw/zinc/03/23/62/628032362.db2.gz MIIIEKIDJROZRX-ZFWWWQNUSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CCCN(C(=O)OC)C1)c1ccccc1[O-] ZINC000775499813 628032574 /nfs/dbraw/zinc/03/25/74/628032574.db2.gz FDBRICPBQCKEFU-JSGCOSHPSA-N 0 3 292.379 2.664 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCCN(C(=O)OC)C1)c1ccccc1[O-] ZINC000775499814 628032637 /nfs/dbraw/zinc/03/26/37/628032637.db2.gz FDBRICPBQCKEFU-OCCSQVGLSA-N 0 3 292.379 2.664 20 10 CFCDHN COC(=O)CC1([NH2+]Cc2cc(Cl)cc(C)c2[O-])CCC1 ZINC000777441170 628225942 /nfs/dbraw/zinc/22/59/42/628225942.db2.gz PUEXAFZRXMTXSM-UHFFFAOYSA-N 0 3 297.782 2.929 20 10 CFCDHN COC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(F)ccc1[O-] ZINC000779086494 628351262 /nfs/dbraw/zinc/35/12/62/628351262.db2.gz FZDQKHPEIYXIFJ-MRXNPFEDSA-N 0 3 289.350 2.879 20 10 CFCDHN CC(C)[C@H]1CCC[N@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000780499805 628469840 /nfs/dbraw/zinc/46/98/40/628469840.db2.gz UAMRXMFPMYJHPM-BLLLJJGKSA-N 0 3 291.391 2.686 20 10 CFCDHN CC(C)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[O-])OC[C@H]3O)C1 ZINC000780499805 628469844 /nfs/dbraw/zinc/46/98/44/628469844.db2.gz UAMRXMFPMYJHPM-BLLLJJGKSA-N 0 3 291.391 2.686 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000780891877 628503199 /nfs/dbraw/zinc/50/31/99/628503199.db2.gz BNJVMWJFANPQCC-NEPJUHHUSA-N 0 3 283.799 2.947 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)c1[O-] ZINC000780891877 628503202 /nfs/dbraw/zinc/50/32/02/628503202.db2.gz BNJVMWJFANPQCC-NEPJUHHUSA-N 0 3 283.799 2.947 20 10 CFCDHN COc1ccccc1[C@@H](CO)N[C@H](C)c1ccccc1O ZINC000783524284 628716815 /nfs/dbraw/zinc/71/68/15/628716815.db2.gz YSPYTTBFQOWBGS-IUODEOHRSA-N 0 3 287.359 2.785 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC000783602292 628725987 /nfs/dbraw/zinc/72/59/87/628725987.db2.gz CMDZBYFZWJWXNM-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@H+]2CCC[C@H](OC)CC2)c([O-])c1 ZINC000783602292 628725988 /nfs/dbraw/zinc/72/59/88/628725988.db2.gz CMDZBYFZWJWXNM-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2[C@@H](C)O)c([O-])c1 ZINC000785989098 628928277 /nfs/dbraw/zinc/92/82/77/628928277.db2.gz QVTQLYYPYNJKIU-WOSRLPQWSA-N 0 3 293.407 2.772 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2[C@@H](C)O)c([O-])c1 ZINC000785989098 628928280 /nfs/dbraw/zinc/92/82/80/628928280.db2.gz QVTQLYYPYNJKIU-WOSRLPQWSA-N 0 3 293.407 2.772 20 10 CFCDHN C[C@@H]1C[C@@H]([NH2+]CCc2cncn2C)c2c1c(F)ccc2[O-] ZINC000788258136 629053568 /nfs/dbraw/zinc/05/35/68/629053568.db2.gz UIABQRXKAXRGRS-ZWNOBZJWSA-N 0 3 289.354 2.645 20 10 CFCDHN C[C@H]1C[C@H]([NH2+]CCCCCO)c2c1c(F)ccc2[O-] ZINC000790499444 629243163 /nfs/dbraw/zinc/24/31/63/629243163.db2.gz WWTOCIBGHNYZKW-JQWIXIFHSA-N 0 3 267.344 2.832 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]C[C@@H](O)C(F)(F)F)c2c1c(F)ccc2[O-] ZINC000790717844 629258806 /nfs/dbraw/zinc/25/88/06/629258806.db2.gz PTFPWSDRPATPER-SKWCMTHISA-N 0 3 293.260 2.592 20 10 CFCDHN C[C@@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CCCO1 ZINC000835024908 629320760 /nfs/dbraw/zinc/32/07/60/629320760.db2.gz ASADKHZBINEDSB-ZDTYVGOBSA-N 0 3 274.408 2.877 20 10 CFCDHN CN(C)c1ccc(/C=C/CNC[C@H](O)c2ccco2)cc1 ZINC000835037126 629332379 /nfs/dbraw/zinc/33/23/79/629332379.db2.gz SBBVNDHNIGYQFH-WMHVBEDNSA-N 0 3 286.375 2.682 20 10 CFCDHN CCn1cc(CNC/C=C\c2ccc(N(C)C)cc2)cn1 ZINC000835039018 629333208 /nfs/dbraw/zinc/33/32/08/629333208.db2.gz ACFSFEHOIPEVQK-WAYWQWQTSA-N 0 3 284.407 2.772 20 10 CFCDHN CCc1nc([C@@H](C)NCC=Cc2ccc(N(C)C)cc2)n[nH]1 ZINC000835043195 629337521 /nfs/dbraw/zinc/33/75/21/629337521.db2.gz QSRAEMOFBKGGDT-KTRBRXNASA-N 0 3 299.422 2.797 20 10 CFCDHN CC[C@H]1CN(C)CCN1C/C=C\c1ccc(N(C)C)cc1 ZINC000835055957 629357911 /nfs/dbraw/zinc/35/79/11/629357911.db2.gz QIIQNGCWGKOBOY-TUYSUELWSA-N 0 3 287.451 2.792 20 10 CFCDHN COc1ccc(C[NH2+]Cc2c[nH]nc2C(C)(C)C)c([O-])c1 ZINC000793388642 629535846 /nfs/dbraw/zinc/53/58/46/629535846.db2.gz QORXZLYGKGMDAX-UHFFFAOYSA-N 0 3 289.379 2.711 20 10 CFCDHN Cc1cc([C@H](C)NCc2ccc3c(c2)CCCN3C)n(C)n1 ZINC000793524636 629561703 /nfs/dbraw/zinc/56/17/03/629561703.db2.gz GWRLNKUXARVJAD-AWEZNQCLSA-N 0 3 298.434 2.962 20 10 CFCDHN Cc1cc([C@H](C)NCc2ccc(N(C)C)cc2C)n(C)n1 ZINC000793540505 629566270 /nfs/dbraw/zinc/56/62/70/629566270.db2.gz KQGUTGDMTBKBPX-AWEZNQCLSA-N 0 3 286.423 2.954 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000793610815 629578527 /nfs/dbraw/zinc/57/85/27/629578527.db2.gz YITQFLZNPBFCAL-UHFFFAOYSA-N 0 3 285.322 2.740 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](O)COCC1CC1)c1ccc(C)cc1[O-] ZINC000794802651 629688124 /nfs/dbraw/zinc/68/81/24/629688124.db2.gz GIDUPDKNPWINSN-GDBMZVCRSA-N 0 3 293.407 2.529 20 10 CFCDHN CCc1nncn1CC[NH2+][C@H](CC)c1ccc(C)cc1[O-] ZINC000794804857 629688172 /nfs/dbraw/zinc/68/81/72/629688172.db2.gz VQFIQGMKYOKHTM-CQSZACIVSA-N 0 3 288.395 2.595 20 10 CFCDHN CC[C@@H]([NH2+]CCOC[C@@H]1CCCO1)c1ccc(C)cc1[O-] ZINC000794809036 629688565 /nfs/dbraw/zinc/68/85/65/629688565.db2.gz PFZSKCNAOXDECV-GOEBONIOSA-N 0 3 293.407 2.937 20 10 CFCDHN CC[C@H]([NH2+]CC[C@@H](C)[S@](C)=O)c1ccc(C)cc1[O-] ZINC000794813910 629689587 /nfs/dbraw/zinc/68/95/87/629689587.db2.gz FZTRJVCSAVUZCY-UHYGZKCKSA-N 0 3 283.437 2.898 20 10 CFCDHN CC[C@@H]([NH2+]CC(C)(C)C(=O)NC)c1ccc(C)cc1[O-] ZINC000794814401 629689591 /nfs/dbraw/zinc/68/95/91/629689591.db2.gz DNCUTCHRVAPBAO-CYBMUJFWSA-N 0 3 278.396 2.514 20 10 CFCDHN CC[C@@H]([NH2+][C@@H](C)C(C)(C)O)c1ccc(C)cc1[O-] ZINC000794814623 629689657 /nfs/dbraw/zinc/68/96/57/629689657.db2.gz RSOSCZDMXLDNEF-WCQYABFASA-N 0 3 251.370 2.901 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2cnn3ccccc23)c([O-])c1 ZINC000796479604 629924243 /nfs/dbraw/zinc/92/42/43/629924243.db2.gz GQODWVADEPUKIM-UHFFFAOYSA-N 0 3 297.358 2.728 20 10 CFCDHN c1[nH]nc2c1[C@H](NCc1ccc3c(c1)CCO3)CCC2 ZINC000796740178 629958149 /nfs/dbraw/zinc/95/81/49/629958149.db2.gz WORQSYHUAQFOFI-CQSZACIVSA-N 0 3 269.348 2.512 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCCN(C)C1)c1ccc(F)cc1[O-] ZINC000796758381 629961274 /nfs/dbraw/zinc/96/12/74/629961274.db2.gz DHLULDRVQCEDCX-IUODEOHRSA-N 0 3 280.387 2.914 20 10 CFCDHN CNC(=O)CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808685452 631028326 /nfs/dbraw/zinc/02/83/26/631028326.db2.gz RNZVMABBHXIHLL-SNVBAGLBSA-N 0 3 284.787 2.531 20 10 CFCDHN CNC(=O)CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1[O-] ZINC000808685451 631028530 /nfs/dbraw/zinc/02/85/30/631028530.db2.gz RNZVMABBHXIHLL-JTQLQIEISA-N 0 3 284.787 2.531 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)C[S@](C)=O)c1[O-] ZINC000808714350 631033598 /nfs/dbraw/zinc/03/35/98/631033598.db2.gz VLDSRTKCRJIHDD-RAALSFIWSA-N 0 3 289.828 2.772 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCCCO)c1[O-] ZINC000808716822 631034198 /nfs/dbraw/zinc/03/41/98/631034198.db2.gz WVKKNQOILDNCEZ-JTQLQIEISA-N 0 3 257.761 2.777 20 10 CFCDHN Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)CN(C)C)c1[O-] ZINC000808717224 631034725 /nfs/dbraw/zinc/03/47/25/631034725.db2.gz CCXCYRSWXIVXPH-WDEREUQCSA-N 0 3 270.804 2.955 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@]2(O)CCO[C@@H]2C)c1[O-] ZINC000808716229 631034894 /nfs/dbraw/zinc/03/48/94/631034894.db2.gz KCEYDELHMMSDGW-RWSFTLGLSA-N 0 3 299.798 2.545 20 10 CFCDHN CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2[O-])C1 ZINC000840764359 631220341 /nfs/dbraw/zinc/22/03/41/631220341.db2.gz SHLVUVDDZYWUEQ-ZMLRMANQSA-N 0 3 253.317 2.749 20 10 CFCDHN Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2cn(C)cn2)c1[O-] ZINC000840763080 631220609 /nfs/dbraw/zinc/22/06/09/631220609.db2.gz GSBNHWCOKFZWFX-NSHDSACASA-N 0 3 293.798 2.981 20 10 CFCDHN CC[C@H]([NH2+][C@@H]1CCc2cccc([O-])c21)[C@H](O)C(C)C ZINC000840881262 631249691 /nfs/dbraw/zinc/24/96/91/631249691.db2.gz HCUHQRMWTDGEQH-WOSRLPQWSA-N 0 3 263.381 2.765 20 10 CFCDHN CC[C@H]([NH2+][C@@H](C)c1ccccc1[O-])[C@H](O)C(C)C ZINC000840882077 631250333 /nfs/dbraw/zinc/25/03/33/631250333.db2.gz MAWOQRAKMOBAIC-CORIIIEPSA-N 0 3 251.370 2.838 20 10 CFCDHN C[C@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1cc(F)ccc1[O-] ZINC000840886671 631252321 /nfs/dbraw/zinc/25/23/21/631252321.db2.gz LNVJORJPKBUZBH-KDDOJWQBSA-N 0 3 289.297 2.731 20 10 CFCDHN CCOc1ccc(C[N@H+](CC2CCC2)[C@@H](C)CO)c([O-])c1 ZINC000809665630 631259378 /nfs/dbraw/zinc/25/93/78/631259378.db2.gz XZDVQTYZVFYBNK-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOc1ccc(C[N@@H+](CC2CCC2)[C@@H](C)CO)c([O-])c1 ZINC000809665630 631259383 /nfs/dbraw/zinc/25/93/83/631259383.db2.gz XZDVQTYZVFYBNK-ZDUSSCGKSA-N 0 3 293.407 2.774 20 10 CFCDHN CCOC1CC2(C1)CC[N@H+](Cc1c([O-])cccc1OC)C2 ZINC000809707302 631268293 /nfs/dbraw/zinc/26/82/93/631268293.db2.gz FMANSBNICBSUGC-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN CCOC1CC2(C1)CC[N@@H+](Cc1c([O-])cccc1OC)C2 ZINC000809707302 631268298 /nfs/dbraw/zinc/26/82/98/631268298.db2.gz FMANSBNICBSUGC-UHFFFAOYSA-N 0 3 291.391 2.792 20 10 CFCDHN Cc1cc(N(C)C)ccc1CNCc1cnc2n1CCCC2 ZINC000840942917 631273309 /nfs/dbraw/zinc/27/33/09/631273309.db2.gz AHFMMTTVOFINMI-UHFFFAOYSA-N 0 3 298.434 2.884 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCc3nc[nH]c3C2)c(Cl)c1 ZINC000840945964 631275003 /nfs/dbraw/zinc/27/50/03/631275003.db2.gz COMHFMUBOIHVIJ-JTQLQIEISA-N 0 3 291.782 2.724 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCc3[nH]cnc3C2)c(Cl)c1 ZINC000840945964 631275010 /nfs/dbraw/zinc/27/50/10/631275010.db2.gz COMHFMUBOIHVIJ-JTQLQIEISA-N 0 3 291.782 2.724 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCc3nc[nH]c3C2)c(Cl)c1 ZINC000840945965 631275702 /nfs/dbraw/zinc/27/57/02/631275702.db2.gz COMHFMUBOIHVIJ-SNVBAGLBSA-N 0 3 291.782 2.724 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCc3[nH]cnc3C2)c(Cl)c1 ZINC000840945965 631275704 /nfs/dbraw/zinc/27/57/04/631275704.db2.gz COMHFMUBOIHVIJ-SNVBAGLBSA-N 0 3 291.782 2.724 20 10 CFCDHN NC1(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])CCCCC1 ZINC000841039555 631317529 /nfs/dbraw/zinc/31/75/29/631317529.db2.gz UAUVPBCYZRDLRG-UHFFFAOYSA-N 0 3 286.778 2.936 20 10 CFCDHN Cc1cc([O-])c(CN[C@@H](CC[NH3+])C(F)(F)F)c(Cl)c1 ZINC000841094458 631338349 /nfs/dbraw/zinc/33/83/49/631338349.db2.gz YOIZWIWYTGQHCR-NSHDSACASA-N 0 3 296.720 2.723 20 10 CFCDHN C[C@H]1C[C@@H]([NH2+]CCc2cn[nH]c2)c2c1c(F)ccc2[O-] ZINC000810248501 631349520 /nfs/dbraw/zinc/34/95/20/631349520.db2.gz WVKBSTWRZBLLMX-JOYOIKCWSA-N 0 3 275.327 2.635 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(Cl)cc1[O-] ZINC000841752485 631465338 /nfs/dbraw/zinc/46/53/38/631465338.db2.gz AXUXJEHSOGTPKJ-ONGXEEELSA-N 0 3 291.782 2.977 20 10 CFCDHN COc1ccc(C[NH2+]C[C@@H](CC(C)C)OC)c([O-])c1 ZINC000841888900 631488103 /nfs/dbraw/zinc/48/81/03/631488103.db2.gz UQXLFOZZIWKEJZ-CQSZACIVSA-N 0 3 267.369 2.552 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@@H](CO)CC1CCCCC1 ZINC000841893416 631489994 /nfs/dbraw/zinc/48/99/94/631489994.db2.gz KEGDNQONJJAXEW-OAHLLOKOSA-N 0 3 281.371 2.952 20 10 CFCDHN CCOc1ccc(C[N@H+](C)CCCCOC)c([O-])c1 ZINC000841894751 631490538 /nfs/dbraw/zinc/49/05/38/631490538.db2.gz TXMQICVPDHTXQC-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOc1ccc(C[N@@H+](C)CCCCOC)c([O-])c1 ZINC000841894751 631490543 /nfs/dbraw/zinc/49/05/43/631490543.db2.gz TXMQICVPDHTXQC-UHFFFAOYSA-N 0 3 267.369 2.649 20 10 CFCDHN CCOc1ccc(C[NH2+]Cc2ccc(CO)cc2)c([O-])c1 ZINC000842732285 631720746 /nfs/dbraw/zinc/72/07/46/631720746.db2.gz JPJTZKGLSIDLSL-UHFFFAOYSA-N 0 3 287.359 2.573 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CC(C)(C)[C@@]2(O)CCOC2)c1 ZINC000842917819 631781646 /nfs/dbraw/zinc/78/16/46/631781646.db2.gz BKFBEZWVUNYIRS-SUMWQHHRSA-N 0 3 293.407 2.529 20 10 CFCDHN C[NH2+]CC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000843049891 631814977 /nfs/dbraw/zinc/81/49/77/631814977.db2.gz WBZIJYRLGLMJRY-UHFFFAOYSA-N 0 3 286.778 2.616 20 10 CFCDHN Cc1cc([O-])c(CN2CC[C@@H]([NH3+])[C@H](C)C2)c(Cl)c1 ZINC000843051014 631815007 /nfs/dbraw/zinc/81/50/07/631815007.db2.gz DDSQFOYQIOZXOQ-ZWNOBZJWSA-N 0 3 268.788 2.523 20 10 CFCDHN CC(C)[C@@H]([NH3+])CCN(C)Cc1c([O-])ccc(Cl)c1F ZINC000843056275 631820263 /nfs/dbraw/zinc/82/02/63/631820263.db2.gz GXNKQRGIHSFJIE-LBPRGKRZSA-N 0 3 288.794 2.990 20 10 CFCDHN CCC[N@H+](Cc1ccc(N)nc1)Cc1ccccc1[O-] ZINC000843061031 631822838 /nfs/dbraw/zinc/82/28/38/631822838.db2.gz XEKJCVRPIASFOV-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN CCC[N@@H+](Cc1ccc(N)nc1)Cc1ccccc1[O-] ZINC000843061031 631822843 /nfs/dbraw/zinc/82/28/43/631822843.db2.gz XEKJCVRPIASFOV-UHFFFAOYSA-N 0 3 271.364 2.782 20 10 CFCDHN CC[C@H]([NH2+]CCCOC[C@H]1CCOC1)c1ccccc1[O-] ZINC000155966760 650038899 /nfs/dbraw/zinc/03/88/99/650038899.db2.gz AKTPSIXFZSQHST-ZBFHGGJFSA-N 0 3 293.407 2.876 20 10 CFCDHN C[C@H]1CC2(C[N@@H+]1Cc1ccccc1[O-])CCOCC2 ZINC000843432171 631957173 /nfs/dbraw/zinc/95/71/73/631957173.db2.gz RTENLPQNVPVUEG-ZDUSSCGKSA-N 0 3 261.365 2.783 20 10 CFCDHN C[C@H]1CC2(C[N@H+]1Cc1ccccc1[O-])CCOCC2 ZINC000843432171 631957176 /nfs/dbraw/zinc/95/71/76/631957176.db2.gz RTENLPQNVPVUEG-ZDUSSCGKSA-N 0 3 261.365 2.783 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H]2CO[C@H](C)C2)c1[O-] ZINC000843433444 631958287 /nfs/dbraw/zinc/95/82/87/631958287.db2.gz ZYHCCUWXGAPSJP-BXKDBHETSA-N 0 3 255.745 2.621 20 10 CFCDHN C[C@H](N)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000843484647 631966331 /nfs/dbraw/zinc/96/63/31/631966331.db2.gz KUIUWPIRFGTHNC-KBPBESRZSA-N 0 3 298.386 2.829 20 10 CFCDHN C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](C)N ZINC000843484652 631966745 /nfs/dbraw/zinc/96/67/45/631966745.db2.gz KUIUWPIRFGTHNC-UONOGXRCSA-N 0 3 298.386 2.829 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000814169482 632021474 /nfs/dbraw/zinc/02/14/74/632021474.db2.gz IMJMTWKRSPMPNT-KGLIPLIRSA-N 0 3 283.318 2.878 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000814169482 632021478 /nfs/dbraw/zinc/02/14/78/632021478.db2.gz IMJMTWKRSPMPNT-KGLIPLIRSA-N 0 3 283.318 2.878 20 10 CFCDHN CC[C@H]1CN(Cc2cc3c(cc2O)CCC3)[C@H](C)CO1 ZINC000844729297 632290184 /nfs/dbraw/zinc/29/01/84/632290184.db2.gz HLUAKBQIZAIDSE-WBMJQRKESA-N 0 3 275.392 2.880 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]CCC2CC(O)C2)c([O-])c1 ZINC000815621367 632299888 /nfs/dbraw/zinc/29/98/88/632299888.db2.gz SEFJIIHPZSHVEG-IYXRBSQSSA-N 0 3 263.381 2.821 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](CO)C(C)C)c([O-])c1 ZINC000815626117 632300577 /nfs/dbraw/zinc/30/05/77/632300577.db2.gz WDJGKIQFTRXVOM-KGLIPLIRSA-N 0 3 265.397 2.924 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccccc1[O-] ZINC000845991943 632609240 /nfs/dbraw/zinc/60/92/40/632609240.db2.gz XZPRRTYYPATRAA-LLVKDONJSA-N 0 3 271.364 2.854 20 10 CFCDHN C[C@@H]([NH2+]Cc1cc(F)ccc1[O-])[C@](C)(O)c1ccccc1 ZINC000846040334 632620658 /nfs/dbraw/zinc/62/06/58/632620658.db2.gz WGJJDIGJUPQQAU-PXAZEXFGSA-N 0 3 289.350 2.917 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2C[C@H](O)CC[C@H]2C)c1[O-] ZINC000817414184 632625387 /nfs/dbraw/zinc/62/53/87/632625387.db2.gz GZCVASVALIPLQU-ZWNOBZJWSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2C[C@H](O)CC[C@H]2C)c1[O-] ZINC000817414184 632625391 /nfs/dbraw/zinc/62/53/91/632625391.db2.gz GZCVASVALIPLQU-ZWNOBZJWSA-N 0 3 269.772 2.699 20 10 CFCDHN CCOc1ccc(C[NH2+]CCCC2(O)CCC2)c([O-])c1 ZINC000817415576 632626526 /nfs/dbraw/zinc/62/65/26/632626526.db2.gz ZHDDNYPMYRNRND-UHFFFAOYSA-N 0 3 279.380 2.576 20 10 CFCDHN COc1cccc([C@@H](C)N[C@H](CO)c2ccccc2)c1O ZINC000846143810 632646181 /nfs/dbraw/zinc/64/61/81/632646181.db2.gz HVTFPLLZVNZHPX-IUODEOHRSA-N 0 3 287.359 2.785 20 10 CFCDHN CCc1cc(CN[C@H](C)c2cccc(OC)c2O)[nH]n1 ZINC000846148120 632646800 /nfs/dbraw/zinc/64/68/00/632646800.db2.gz XCSLFYKTTFNIHN-SNVBAGLBSA-N 0 3 275.352 2.537 20 10 CFCDHN COc1cccc([C@@H](C)NC[C@H](OC)C(F)(F)F)c1O ZINC000846163739 632650639 /nfs/dbraw/zinc/65/06/39/632650639.db2.gz QQEFBTJBBVITER-KCJUWKMLSA-N 0 3 293.285 2.629 20 10 CFCDHN CCC[C@H](C)[C@@H](CO)[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000846182807 632654923 /nfs/dbraw/zinc/65/49/23/632654923.db2.gz DMUXBGKPXDGLEY-FPMFFAJLSA-N 0 3 263.381 2.766 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H](C)c1cnccc1N ZINC000817893060 632719613 /nfs/dbraw/zinc/71/96/13/632719613.db2.gz CMMHIWPGAKNHSP-CYBMUJFWSA-N 0 3 284.407 2.719 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCCNC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940561 632744371 /nfs/dbraw/zinc/74/43/71/632744371.db2.gz KDHCSFPJHHCIIC-UWVGGRQHSA-N 0 3 288.313 2.814 20 10 CFCDHN C[C@H](N[C@H]1CCC[NH2+]C1)c1cccc(C(F)(F)F)c1[O-] ZINC000817940561 632744375 /nfs/dbraw/zinc/74/43/75/632744375.db2.gz KDHCSFPJHHCIIC-UWVGGRQHSA-N 0 3 288.313 2.814 20 10 CFCDHN CC[C@@H](N[C@@H]1CC[NH2+]C1)c1cc(Br)ccc1[O-] ZINC000817944673 632747401 /nfs/dbraw/zinc/74/74/01/632747401.db2.gz JFMCCNANHZWHMX-ZYHUDNBSSA-N 0 3 299.212 2.557 20 10 CFCDHN CC[C@@H](NC[C@@H]1CCC[NH2+]1)c1cc(Cl)ccc1[O-] ZINC000817951675 632751768 /nfs/dbraw/zinc/75/17/68/632751768.db2.gz JHQZJKKBIPXLST-WCQYABFASA-N 0 3 268.788 2.838 20 10 CFCDHN CCC(N)(CC)C[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000817959977 632757892 /nfs/dbraw/zinc/75/78/92/632757892.db2.gz JLKLQSPVFHSYPU-JTQLQIEISA-N 0 3 254.349 2.699 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](N)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817965705 632763664 /nfs/dbraw/zinc/76/36/64/632763664.db2.gz UIRDUAOGHXZKTE-QWHCGFSZSA-N 0 3 268.788 2.824 20 10 CFCDHN C[C@@H]([NH2+]CC1(N)CCC1)c1cccc(C(F)(F)F)c1[O-] ZINC000817965459 632764038 /nfs/dbraw/zinc/76/40/38/632764038.db2.gz VIFOSKASCIUWSZ-SECBINFHSA-N 0 3 288.313 2.943 20 10 CFCDHN CC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1cc(Cl)ccc1[O-] ZINC000817965701 632764208 /nfs/dbraw/zinc/76/42/08/632764208.db2.gz UIRDUAOGHXZKTE-CHWSQXEVSA-N 0 3 268.788 2.824 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H]1NCCc2ccccc21)c1ccccc1[O-] ZINC000817973662 632773130 /nfs/dbraw/zinc/77/31/30/632773130.db2.gz GBEGMQMRTVAOAH-DYVFJYSZSA-N 0 3 282.387 2.930 20 10 CFCDHN CC[C@H]([NH2+]C[C@@H](C)N)c1ccc(C(F)(F)F)cc1[O-] ZINC000817973528 632773540 /nfs/dbraw/zinc/77/35/40/632773540.db2.gz UVOMQAVGPKNGBI-KCJUWKMLSA-N 0 3 276.302 2.799 20 10 CFCDHN CCN(C)c1ccc([C@@H](C)N[C@H]2CNCCC2(F)F)cc1 ZINC000817981346 632777924 /nfs/dbraw/zinc/77/79/24/632777924.db2.gz RGAALVBJZGUMQV-DOMZBBRYSA-N 0 3 297.393 2.791 20 10 CFCDHN COc1ccc(N2CCN(C3CCCC3)CC2)c(OC)c1 ZINC000846745530 632781900 /nfs/dbraw/zinc/78/19/00/632781900.db2.gz ILOVLZBWXPMOFW-UHFFFAOYSA-N 0 3 290.407 2.768 20 10 CFCDHN COc1cc(Br)cc(C[NH2+][C@H]2CC23CC3)c1[O-] ZINC000818229878 632817149 /nfs/dbraw/zinc/81/71/49/632817149.db2.gz GIFACCCYUZMRKR-NSHDSACASA-N 0 3 298.180 2.805 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c1[O-] ZINC000857062176 635922284 /nfs/dbraw/zinc/92/22/84/635922284.db2.gz YSWWUUJPOIWXRR-ZWNOBZJWSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)c1[O-] ZINC000857062176 635922286 /nfs/dbraw/zinc/92/22/86/635922286.db2.gz YSWWUUJPOIWXRR-ZWNOBZJWSA-N 0 3 283.799 2.804 20 10 CFCDHN Cc1ncncc1[C@@H](C)NCc1ccc(N(C)C)cc1 ZINC000848516166 633270656 /nfs/dbraw/zinc/27/06/56/633270656.db2.gz AIULGXXKHVUNLZ-GFCCVEGCSA-N 0 3 270.380 2.702 20 10 CFCDHN COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848925383 633408503 /nfs/dbraw/zinc/40/85/03/633408503.db2.gz UGXTVEPOCOCJGP-CQSZACIVSA-N 0 3 291.391 2.934 20 10 CFCDHN COc1cccc([O-])c1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848925383 633408509 /nfs/dbraw/zinc/40/85/09/633408509.db2.gz UGXTVEPOCOCJGP-CQSZACIVSA-N 0 3 291.391 2.934 20 10 CFCDHN Nc1ccc2c(c1)CC[C@H]2[NH2+]Cc1cc(F)ccc1[O-] ZINC000849351727 633627008 /nfs/dbraw/zinc/62/70/08/633627008.db2.gz CDBZIYHUFQMWTH-OAHLLOKOSA-N 0 3 272.323 2.891 20 10 CFCDHN Cc1cccc(CNc2ccc([C@@H]3CNCCO3)cc2)c1O ZINC000849352074 633627160 /nfs/dbraw/zinc/62/71/60/633627160.db2.gz HDTDIZWBNULAGA-KRWDZBQOSA-N 0 3 298.386 2.974 20 10 CFCDHN Cc1ccc(O)c(CNCc2cnc(C(F)(F)F)nc2)c1 ZINC000850345274 633947641 /nfs/dbraw/zinc/94/76/41/633947641.db2.gz RBCDQQVERNTJSP-UHFFFAOYSA-N 0 3 297.280 2.799 20 10 CFCDHN CCOc1ccc(C[NH2+][C@H]2COC3(CCC3)C2)c([O-])c1 ZINC000850367370 633957420 /nfs/dbraw/zinc/95/74/20/633957420.db2.gz GHKZIZJTMJWBCU-CYBMUJFWSA-N 0 3 277.364 2.592 20 10 CFCDHN COc1cccc(CN[C@H]2C[C@H](O)c3ccccc32)c1O ZINC000850370398 633959939 /nfs/dbraw/zinc/95/99/39/633959939.db2.gz DNMSLXZHXIEEBL-GJZGRUSLSA-N 0 3 285.343 2.669 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000850370955 633960775 /nfs/dbraw/zinc/96/07/75/633960775.db2.gz GWMSMGMPOJKFQX-ZBFHGGJFSA-N 0 3 255.317 2.660 20 10 CFCDHN COc1cccc(O)c1CN[C@@H]1C[C@H](O)c2ccccc21 ZINC000850370986 633961362 /nfs/dbraw/zinc/96/13/62/633961362.db2.gz HGRYBUWVLBOIPQ-ZBFHGGJFSA-N 0 3 285.343 2.669 20 10 CFCDHN COCc1csc(C[NH2+]Cc2ccc(OC)cc2[O-])c1 ZINC000850378202 633965608 /nfs/dbraw/zinc/96/56/08/633965608.db2.gz XRZRQZSWPSMABP-UHFFFAOYSA-N 0 3 293.388 2.899 20 10 CFCDHN C[C@@H](O)[C@H](NCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000850420433 633985126 /nfs/dbraw/zinc/98/51/26/633985126.db2.gz OUCCKFUXOWCWEH-ACJLOTCBSA-N 0 3 283.371 2.833 20 10 CFCDHN COC[C@H](CC[NH2+][C@@H]1C[C@H](C)c2c1c([O-])ccc2F)OC ZINC000850486003 634014314 /nfs/dbraw/zinc/01/43/14/634014314.db2.gz QDZCHAWXYQMQOK-GMXVVIOVSA-N 0 3 297.370 2.721 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)C1CCOCC1)c1ccccc1[O-] ZINC000850494905 634017791 /nfs/dbraw/zinc/01/77/91/634017791.db2.gz ZVXHBBQEMCZBOM-HOTGVXAUSA-N 0 3 293.407 2.875 20 10 CFCDHN C[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1ccccc1[O-] ZINC000850566886 634055019 /nfs/dbraw/zinc/05/50/19/634055019.db2.gz TULAKQIFBULOHC-LLVKDONJSA-N 0 3 285.334 2.983 20 10 CFCDHN CN(Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1O ZINC000109769161 634233000 /nfs/dbraw/zinc/23/30/00/634233000.db2.gz WHFHHDFRTWNZMV-UHFFFAOYSA-N 0 3 272.304 2.932 20 10 CFCDHN COc1cccc([O-])c1C[NH2+]CC[C@H]1CC1(F)F ZINC000856802674 635864235 /nfs/dbraw/zinc/86/42/35/635864235.db2.gz WRBCVJOKJANUJP-VIFPVBQESA-N 0 3 257.280 2.536 20 10 CFCDHN CC[C@H](C)[C@@H](O)CNCc1cc(F)c(N(C)C)cc1F ZINC000858135072 636135498 /nfs/dbraw/zinc/13/54/98/636135498.db2.gz LLTROYYQENCGDY-BONVTDFDSA-N 0 3 286.366 2.527 20 10 CFCDHN CN(C)c1cc(F)c(CNC[C@H]2CCC=CO2)cc1F ZINC000858158681 636143273 /nfs/dbraw/zinc/14/32/73/636143273.db2.gz OLYPKQIYQWXXGV-GFCCVEGCSA-N 0 3 282.334 2.813 20 10 CFCDHN C[C@H]1CC[C@@H](CNCc2cc(F)c(N(C)C)cc2F)O1 ZINC000858174309 636147638 /nfs/dbraw/zinc/14/76/38/636147638.db2.gz BVSIEEIQVYBNOT-JQWIXIFHSA-N 0 3 284.350 2.688 20 10 CFCDHN CCCn1nccc1CNCc1cc(C)ccc1O ZINC000858238928 636160438 /nfs/dbraw/zinc/16/04/38/636160438.db2.gz FDNOUILYLFZESU-UHFFFAOYSA-N 0 3 259.353 2.597 20 10 CFCDHN Cc1ccc(O)c(CNCc2ncc(CN(C)C)s2)c1 ZINC000858238940 636160824 /nfs/dbraw/zinc/16/08/24/636160824.db2.gz FKZBBCOXSIVNBP-UHFFFAOYSA-N 0 3 291.420 2.509 20 10 CFCDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1cc(F)c(N(C)C)cc1F ZINC000858284140 636175968 /nfs/dbraw/zinc/17/59/68/636175968.db2.gz XORNENMAHWTLLW-ZSYFIWHWSA-N 0 3 298.377 2.932 20 10 CFCDHN CC[C@@H]([NH2+]CCN(C)CC(F)F)c1ccc(C)cc1[O-] ZINC000858596243 636304049 /nfs/dbraw/zinc/30/40/49/636304049.db2.gz DFLDNTJQOCIHHV-CYBMUJFWSA-N 0 3 286.366 2.938 20 10 CFCDHN CC(C)N1CCN(Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862216967 637288066 /nfs/dbraw/zinc/28/80/66/637288066.db2.gz UGOIEKFHQWPQBX-UHFFFAOYSA-N 0 3 297.393 2.557 20 10 CFCDHN CC(C)N(Cc1cc(F)c(N(C)C)cc1F)C[C@@H](C)O ZINC000862241399 637296436 /nfs/dbraw/zinc/29/64/36/637296436.db2.gz UWTUALBRALPSBS-LLVKDONJSA-N 0 3 286.366 2.622 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483662 637399546 /nfs/dbraw/zinc/39/95/46/637399546.db2.gz WNFFCZXJNHTKQI-GOSISDBHSA-N 0 3 283.371 2.876 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483662 637399550 /nfs/dbraw/zinc/39/95/50/637399550.db2.gz WNFFCZXJNHTKQI-GOSISDBHSA-N 0 3 283.371 2.876 20 10 CFCDHN CCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NC(C)(C)C ZINC000076074139 650366363 /nfs/dbraw/zinc/36/63/63/650366363.db2.gz MHOLFNADCGOCSO-ZDUSSCGKSA-N 0 3 292.423 2.907 20 10 CFCDHN CCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)NC(C)(C)C ZINC000076074139 650366364 /nfs/dbraw/zinc/36/63/64/650366364.db2.gz MHOLFNADCGOCSO-ZDUSSCGKSA-N 0 3 292.423 2.907 20 10 CFCDHN C[C@@H]1C[C@@H](NCc2cc(F)c(N(C)C)cc2F)[C@@H](C)O1 ZINC000864050592 637843582 /nfs/dbraw/zinc/84/35/82/637843582.db2.gz LCACRLURIKJLKM-GPCCPHFNSA-N 0 3 284.350 2.686 20 10 CFCDHN COc1ccc(N2CCN([C@@H]3C=CCCC3)CC2)cc1 ZINC000076667802 650396912 /nfs/dbraw/zinc/39/69/12/650396912.db2.gz RIDRKRDCLWMQCS-OAHLLOKOSA-N 0 3 272.392 2.926 20 10 CFCDHN CC(C)CC[C@@](C)(O)C[NH2+]Cc1ccccc1[O-] ZINC000077456028 650426267 /nfs/dbraw/zinc/42/62/67/650426267.db2.gz XZAPXDZRUIYRDD-OAHLLOKOSA-N 0 3 251.370 2.669 20 10 CFCDHN CN(C)c1ccc(CN[C@@H]2C[C@H]2C(F)(F)F)cc1F ZINC000865752973 638552488 /nfs/dbraw/zinc/55/24/88/638552488.db2.gz GUZGCIHIUDDEKJ-MWLCHTKSSA-N 0 3 276.277 2.932 20 10 CFCDHN C[C@H]([NH2+][C@H]1[C@@H]2OC[C@H]3C[C@H]1C[C@H]23)c1cc(F)ccc1[O-] ZINC000866444371 638822341 /nfs/dbraw/zinc/82/23/41/638822341.db2.gz GRBOZDINKRDITQ-RFEWNFQQSA-N 0 3 277.339 2.605 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)CC2 ZINC000866501196 638831172 /nfs/dbraw/zinc/83/11/72/638831172.db2.gz YVORXRFRRQTHIW-OPRDCNLKSA-N 0 3 257.255 2.920 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@H]1CCCc2c1cnn2C ZINC000122805311 639440864 /nfs/dbraw/zinc/44/08/64/639440864.db2.gz GMORVWLUIRNVOG-KRWDZBQOSA-N 0 3 298.434 2.962 20 10 CFCDHN CC1([NH+]2CCCC2)CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000870258135 639567114 /nfs/dbraw/zinc/56/71/14/639567114.db2.gz HMMSHCIWTVURJG-UHFFFAOYSA-N 0 3 294.420 2.544 20 10 CFCDHN COC(=O)[C@](C)(C[NH2+]Cc1ccccc1[O-])c1ccccc1 ZINC000191587456 650512300 /nfs/dbraw/zinc/51/23/00/650512300.db2.gz NGPDMTFPHRUJKL-GOSISDBHSA-N 0 3 299.370 2.613 20 10 CFCDHN Cc1cccc(C[C@H](CO)[NH2+][C@@H](C)c2ccccc2[O-])c1 ZINC000191608988 650512808 /nfs/dbraw/zinc/51/28/08/650512808.db2.gz CFAXKCSCLYLISR-GOEBONIOSA-N 0 3 285.387 2.955 20 10 CFCDHN Cc1ccc(C[C@@H](CO)[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000191680455 650516258 /nfs/dbraw/zinc/51/62/58/650516258.db2.gz RSLSXXYMYUMXGM-INIZCTEOSA-N 0 3 289.350 2.533 20 10 CFCDHN C[C@H]([NH2+]CCC[C@@H]1CCOC1=O)c1cc(F)ccc1[O-] ZINC000872112882 641643874 /nfs/dbraw/zinc/64/38/74/641643874.db2.gz LKXXWUCYMQLFSF-WDEREUQCSA-N 0 3 281.327 2.525 20 10 CFCDHN Cc1nccnc1[C@@H](C)N[C@@H](C)c1ccccc1O ZINC000872134684 641662639 /nfs/dbraw/zinc/66/26/39/641662639.db2.gz UGJAVMXVJSEKFK-CMPLNLGQSA-N 0 3 257.337 2.902 20 10 CFCDHN Nc1cnc(C[N@H+](Cc2ccccc2[O-])C2CCCC2)cn1 ZINC000873204857 642066118 /nfs/dbraw/zinc/06/61/18/642066118.db2.gz JZWCMGJMSCNINV-UHFFFAOYSA-N 0 3 298.390 2.709 20 10 CFCDHN Nc1cnc(C[N@@H+](Cc2ccccc2[O-])C2CCCC2)cn1 ZINC000873204857 642066123 /nfs/dbraw/zinc/06/61/23/642066123.db2.gz JZWCMGJMSCNINV-UHFFFAOYSA-N 0 3 298.390 2.709 20 10 CFCDHN Cc1ccc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876680930 642970770 /nfs/dbraw/zinc/97/07/70/642970770.db2.gz JQZIDUIUYRXIKW-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN Cc1ccc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c([O-])c1 ZINC000876680930 642970773 /nfs/dbraw/zinc/97/07/73/642970773.db2.gz JQZIDUIUYRXIKW-OAHLLOKOSA-N 0 3 271.364 2.734 20 10 CFCDHN CO[C@H](C)C[N@H+](Cc1ccc(C)cc1[O-])C(C)C ZINC000876758857 642998178 /nfs/dbraw/zinc/99/81/78/642998178.db2.gz LDTCQEZRWWQGQY-CYBMUJFWSA-N 0 3 251.370 2.946 20 10 CFCDHN CO[C@H](C)C[N@@H+](Cc1ccc(C)cc1[O-])C(C)C ZINC000876758857 642998179 /nfs/dbraw/zinc/99/81/79/642998179.db2.gz LDTCQEZRWWQGQY-CYBMUJFWSA-N 0 3 251.370 2.946 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000876780286 643005329 /nfs/dbraw/zinc/00/53/29/643005329.db2.gz TXAKATDOQJIVDF-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000876780286 643005330 /nfs/dbraw/zinc/00/53/30/643005330.db2.gz TXAKATDOQJIVDF-OAHLLOKOSA-N 0 3 275.392 2.949 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000876804903 643015972 /nfs/dbraw/zinc/01/59/72/643015972.db2.gz VURINJSVIFUBAM-HIFRSBDPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000876804903 643015977 /nfs/dbraw/zinc/01/59/77/643015977.db2.gz VURINJSVIFUBAM-HIFRSBDPSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc(C[NH2+]C[C@@H]2Cc3ccccc3O2)c([O-])c1 ZINC000876915823 643063392 /nfs/dbraw/zinc/06/33/92/643063392.db2.gz CTBDZJLLNNZJIG-HNNXBMFYSA-N 0 3 269.344 2.794 20 10 CFCDHN Cc1ccc(CNCc2cccc3c2OCO3)c(O)c1 ZINC000876957590 643079484 /nfs/dbraw/zinc/07/94/84/643079484.db2.gz DESIPABCAWHSOK-UHFFFAOYSA-N 0 3 271.316 2.719 20 10 CFCDHN CC[C@H]([NH2+]CCCn1cccn1)c1ccccc1[O-] ZINC000126262068 643084882 /nfs/dbraw/zinc/08/48/82/643084882.db2.gz QTJQSMSEGALRSJ-AWEZNQCLSA-N 0 3 259.353 2.720 20 10 CFCDHN CC(C)N1CCC[C@H](C[NH2+]Cc2ccc(F)c(F)c2[O-])C1 ZINC000877019597 643106158 /nfs/dbraw/zinc/10/61/58/643106158.db2.gz AJWSBKJIJCHYDZ-GFCCVEGCSA-N 0 3 298.377 2.880 20 10 CFCDHN Cc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c([O-])c1 ZINC000877019546 643106165 /nfs/dbraw/zinc/10/61/65/643106165.db2.gz NTODJFPSVAHPSP-UHFFFAOYSA-N 0 3 286.331 2.941 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)[C@@H](C)c2ccccc2)c([O-])c1 ZINC000877034474 643112826 /nfs/dbraw/zinc/11/28/26/643112826.db2.gz IFBBMXJEAFFDPG-YOEHRIQHSA-N 0 3 285.387 2.955 20 10 CFCDHN CCC(CC)(CC(=O)OC)[NH2+]Cc1ccc(C)cc1[O-] ZINC000877073509 643136213 /nfs/dbraw/zinc/13/62/13/643136213.db2.gz LZSDODZXAGRFSF-UHFFFAOYSA-N 0 3 279.380 2.912 20 10 CFCDHN CC[S@](=O)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C)cc2[O-])C1 ZINC000877077314 643138597 /nfs/dbraw/zinc/13/85/97/643138597.db2.gz CJOZAKSGIOBPCL-MDOVXXIYSA-N 0 3 295.448 2.870 20 10 CFCDHN Cc1ccc(C[NH2+]CCOc2ccc(Cl)cn2)c([O-])c1 ZINC000877086330 643144385 /nfs/dbraw/zinc/14/43/85/643144385.db2.gz WLYMAWFBSRYCMH-UHFFFAOYSA-N 0 3 292.766 2.918 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCc1ccc(CO)cc1 ZINC000877138273 643173007 /nfs/dbraw/zinc/17/30/07/643173007.db2.gz SBWOVQZIIACETC-UHFFFAOYSA-N 0 3 271.360 2.525 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCCc1nccs1 ZINC000877149073 643178465 /nfs/dbraw/zinc/17/84/65/643178465.db2.gz DOIUGDYBAIENOY-UHFFFAOYSA-N 0 3 262.378 2.880 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(C)cc1[O-] ZINC000877479442 643295816 /nfs/dbraw/zinc/29/58/16/643295816.db2.gz CWQKDMTXJVXGDE-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN CCC[C@@]1(CO)CCC[N@H+]1Cc1ccc(C)cc1[O-] ZINC000877479442 643295822 /nfs/dbraw/zinc/29/58/22/643295822.db2.gz CWQKDMTXJVXGDE-INIZCTEOSA-N 0 3 263.381 2.828 20 10 CFCDHN Cc1ccc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c([O-])c1 ZINC000877485409 643300078 /nfs/dbraw/zinc/30/00/78/643300078.db2.gz SORRRPFNQXJPEX-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c([O-])c1 ZINC000877485409 643300082 /nfs/dbraw/zinc/30/00/82/643300082.db2.gz SORRRPFNQXJPEX-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000877508322 643318537 /nfs/dbraw/zinc/31/85/37/643318537.db2.gz WWCXKRSPLHVYPH-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000877508322 643318545 /nfs/dbraw/zinc/31/85/45/643318545.db2.gz WWCXKRSPLHVYPH-GDBMZVCRSA-N 0 3 261.365 2.844 20 10 CFCDHN CCOC(=O)c1ccc(CNCc2c(C)cccc2O)o1 ZINC000877527577 643331322 /nfs/dbraw/zinc/33/13/22/643331322.db2.gz SZMIPPQGDBQUMG-UHFFFAOYSA-N 0 3 289.331 2.760 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1c(C)cccc1[O-])OC ZINC000877558303 643358999 /nfs/dbraw/zinc/35/89/99/643358999.db2.gz CJFDGLISJNIZKW-XHDPSFHLSA-N 0 3 251.370 2.851 20 10 CFCDHN CC[C@H](C)[C@@H](C[NH2+]Cc1ccc(C)cc1[O-])OC ZINC000877559545 643359667 /nfs/dbraw/zinc/35/96/67/643359667.db2.gz YWYZOADRQBJIKY-SWLSCSKDSA-N 0 3 251.370 2.851 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+][C@@H]([C@@H](CO)C1CC1)C1CC1 ZINC000877565928 643365080 /nfs/dbraw/zinc/36/50/80/643365080.db2.gz BIQDAGZGXXSICT-DOTOQJQBSA-N 0 3 275.392 2.587 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000877573790 643371903 /nfs/dbraw/zinc/37/19/03/643371903.db2.gz UZYMIRWGFSBYIK-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000877573790 643371909 /nfs/dbraw/zinc/37/19/09/643371909.db2.gz UZYMIRWGFSBYIK-MRXNPFEDSA-N 0 3 261.365 2.703 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]CCOCC1CCCC1 ZINC000877577804 643375705 /nfs/dbraw/zinc/37/57/05/643375705.db2.gz JYAWSINSBVFSET-UHFFFAOYSA-N 0 3 263.381 2.997 20 10 CFCDHN CO[C@H]1C[C@H]([NH2+]Cc2ccc(C)cc2[O-])C12CCC2 ZINC000877583732 643379254 /nfs/dbraw/zinc/37/92/54/643379254.db2.gz AIXILXFJKDEEOT-GJZGRUSLSA-N 0 3 261.365 2.748 20 10 CFCDHN CC(C)C[N@H+](C)CCCNCc1ccc(F)c(F)c1[O-] ZINC000877609984 643397265 /nfs/dbraw/zinc/39/72/65/643397265.db2.gz PHGHBYXSGQTDFB-UHFFFAOYSA-N 0 3 286.366 2.738 20 10 CFCDHN CC(C)C[N@@H+](C)CCCNCc1ccc(F)c(F)c1[O-] ZINC000877609984 643397267 /nfs/dbraw/zinc/39/72/67/643397267.db2.gz PHGHBYXSGQTDFB-UHFFFAOYSA-N 0 3 286.366 2.738 20 10 CFCDHN Cc1cccc([O-])c1C[NH2+]C[C@H](C)c1ccccn1 ZINC000877621293 643407618 /nfs/dbraw/zinc/40/76/18/643407618.db2.gz UCFQPVDKLALVFN-ZDUSSCGKSA-N 0 3 256.349 2.989 20 10 CFCDHN COC(=O)Cc1ccccc1C[NH2+]Cc1ccc(C)cc1[O-] ZINC000877621808 643408235 /nfs/dbraw/zinc/40/82/35/643408235.db2.gz WUGSZMFKCZAVEP-UHFFFAOYSA-N 0 3 299.370 2.706 20 10 CFCDHN Cc1ccc(C[NH2+]CCCOC(C)(C)C)c([O-])c1 ZINC000877629835 643413827 /nfs/dbraw/zinc/41/38/27/643413827.db2.gz WDUSJAPFBSJDND-UHFFFAOYSA-N 0 3 251.370 2.995 20 10 CFCDHN Cc1ccc(C[NH2+]CC2(O)CCC(C)CC2)c([O-])c1 ZINC000877644666 643428663 /nfs/dbraw/zinc/42/86/63/643428663.db2.gz ZIXLZEKXZCQLIJ-UHFFFAOYSA-N 0 3 263.381 2.731 20 10 CFCDHN Cc1ccc(C[NH2+][C@@H](CO)CCC(C)C)c([O-])c1 ZINC000877653526 643433457 /nfs/dbraw/zinc/43/34/57/643433457.db2.gz MBMXLLJZRXPTDV-CQSZACIVSA-N 0 3 251.370 2.587 20 10 CFCDHN CC(=O)Nc1cccc2c1CN(Cc1ccccc1O)CC2 ZINC000877683192 643452697 /nfs/dbraw/zinc/45/26/97/643452697.db2.gz TZMMIEXBBAPVSK-UHFFFAOYSA-N 0 3 296.370 2.909 20 10 CFCDHN CCOc1ccc(C[NH+]2CC(COC)(C3CC3)C2)c([O-])c1 ZINC000877686098 643454965 /nfs/dbraw/zinc/45/49/65/643454965.db2.gz KWFFBSFIXHEJQC-UHFFFAOYSA-N 0 3 291.391 2.649 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CN3CCC2CC3)c1[O-] ZINC000877706249 643474153 /nfs/dbraw/zinc/47/41/53/643474153.db2.gz ITYQCEYBLXQYEW-OAHLLOKOSA-N 0 3 294.826 2.880 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CN3CCC2CC3)c1[O-] ZINC000877706249 643474158 /nfs/dbraw/zinc/47/41/58/643474158.db2.gz ITYQCEYBLXQYEW-OAHLLOKOSA-N 0 3 294.826 2.880 20 10 CFCDHN C[N@@H+]1CC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000877744369 643522306 /nfs/dbraw/zinc/52/23/06/643522306.db2.gz RZMMZRHVNVUNAT-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@@H]21 ZINC000877744369 643522310 /nfs/dbraw/zinc/52/23/10/643522310.db2.gz RZMMZRHVNVUNAT-FZMZJTMJSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@@H+]1CC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000877744368 643524167 /nfs/dbraw/zinc/52/41/67/643524167.db2.gz RZMMZRHVNVUNAT-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN C[N@H+]1CC[C@@H]2CN(Cc3cc(Cl)ccc3[O-])CC[C@H]21 ZINC000877744368 643524173 /nfs/dbraw/zinc/52/41/73/643524173.db2.gz RZMMZRHVNVUNAT-BXUZGUMPSA-N 0 3 280.799 2.572 20 10 CFCDHN CCOC(=O)c1ccc(C[NH2+][C@H](C)c2ccccc2[O-])[nH]1 ZINC000877755742 643535605 /nfs/dbraw/zinc/53/56/05/643535605.db2.gz LUFKHYNVGZUVHE-LLVKDONJSA-N 0 3 288.347 2.748 20 10 CFCDHN COCc1ccc(CN[C@H](C)c2ccccc2O)o1 ZINC000877756253 643537307 /nfs/dbraw/zinc/53/73/07/643537307.db2.gz BPGALRNCOHWGLF-LLVKDONJSA-N 0 3 261.321 2.982 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)c2ccccc2[O-])c1O ZINC000877757029 643537473 /nfs/dbraw/zinc/53/74/73/643537473.db2.gz ALGMSWCGNVSQIT-NSHDSACASA-N 0 3 273.332 2.957 20 10 CFCDHN C[C@H]([NH2+]Cc1cnc(C2CC2)nc1)c1ccccc1[O-] ZINC000877758407 643539292 /nfs/dbraw/zinc/53/92/92/643539292.db2.gz YVBKYPONYJVVMX-NSHDSACASA-N 0 3 269.348 2.910 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1C[C@H](C)C[C@@H](C)C1)c1ccccc1[O-] ZINC000879647827 644361239 /nfs/dbraw/zinc/36/12/39/644361239.db2.gz MODHKISOLJJKCH-MGPQQGTHSA-N 0 3 290.407 2.547 20 10 CFCDHN C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)C[C@H](C)C1)c1ccccc1[O-] ZINC000879647826 644361556 /nfs/dbraw/zinc/36/15/56/644361556.db2.gz MODHKISOLJJKCH-MELADBBJSA-N 0 3 290.407 2.547 20 10 CFCDHN CC(C)CCNC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[O-] ZINC000879649073 644362758 /nfs/dbraw/zinc/36/27/58/644362758.db2.gz LGJAUSWBYPRWJW-OLZOCXBDSA-N 0 3 278.396 2.594 20 10 CFCDHN C[C@@H]([NH2+]C[C@H]1CC2(CCC2)C(=O)O1)c1ccccc1[O-] ZINC000879649506 644363057 /nfs/dbraw/zinc/36/30/57/644363057.db2.gz VGWFQHUKXMCJOF-VXGBXAGGSA-N 0 3 275.348 2.529 20 10 CFCDHN CCC[C@H](C)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[O-] ZINC000879651769 644365064 /nfs/dbraw/zinc/36/50/64/644365064.db2.gz JZDBDEVEEJZEAP-RWMBFGLXSA-N 0 3 278.396 2.736 20 10 CFCDHN C[C@H]([NH2+][C@@H](C)c1ccccc1[O-])C(=O)N1CCCCCC1 ZINC000879652368 644365921 /nfs/dbraw/zinc/36/59/21/644365921.db2.gz ZIOKVKHBMRJOAS-KBPBESRZSA-N 0 3 290.407 2.834 20 10 CFCDHN COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1[O-])C(C)C ZINC000094618370 650960004 /nfs/dbraw/zinc/96/00/04/650960004.db2.gz TTWLOLBXPCSFGC-GXFFZTMASA-N 0 3 255.333 2.853 20 10 CFCDHN C[C@H]([NH2+]C[C@@]1(C)CCCO1)c1cc(F)ccc1[O-] ZINC000094798226 650963929 /nfs/dbraw/zinc/96/39/29/650963929.db2.gz FASZKKCFJXYHQP-IINYFYTJSA-N 0 3 253.317 2.751 20 10 CFCDHN Cc1ccc(NCc2ccc(N3CCN(C)CC3)cc2)nc1 ZINC000882880268 645488479 /nfs/dbraw/zinc/48/84/79/645488479.db2.gz KTUQOEHRCUNALS-UHFFFAOYSA-N 0 3 296.418 2.754 20 10 CFCDHN CC(C)C[N@H+](C)CCCNCc1cc(F)cc(F)c1[O-] ZINC000883158159 645631704 /nfs/dbraw/zinc/63/17/04/645631704.db2.gz WCZXYOQFQOCBOT-UHFFFAOYSA-N 0 3 286.366 2.738 20 10 CFCDHN CC(C)C[N@@H+](C)CCCNCc1cc(F)cc(F)c1[O-] ZINC000883158159 645631706 /nfs/dbraw/zinc/63/17/06/645631706.db2.gz WCZXYOQFQOCBOT-UHFFFAOYSA-N 0 3 286.366 2.738 20 10 CFCDHN CCOc1ccc(C[NH2+][C@@H]2CCC[C@]23CCCO3)c([O-])c1 ZINC000883371070 645776325 /nfs/dbraw/zinc/77/63/25/645776325.db2.gz YHUYAGOSNUXXFB-SJORKVTESA-N 0 3 291.391 2.982 20 10 CFCDHN CN(CC[NH+]1CCCC1)Cc1c([O-])cccc1Cl ZINC000133911330 646254135 /nfs/dbraw/zinc/25/41/35/646254135.db2.gz UDKHQTFAPQHLKX-UHFFFAOYSA-N 0 3 268.788 2.573 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000134983503 646423819 /nfs/dbraw/zinc/42/38/19/646423819.db2.gz OABOQEBTWXKKTR-OAHLLOKOSA-N 0 3 277.751 2.869 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000134983485 646424375 /nfs/dbraw/zinc/42/43/75/646424375.db2.gz OABOQEBTWXKKTR-HNNXBMFYSA-N 0 3 277.751 2.869 20 10 CFCDHN CC[C@H]([NH2+][C@@H](COC)[C@H]1CCCOC1)c1ccccc1[O-] ZINC000886788356 647136842 /nfs/dbraw/zinc/13/68/42/647136842.db2.gz ASCGNIQUKVRRTA-BPUTZDHNSA-N 0 3 293.407 2.875 20 10 CFCDHN COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1[O-])[C@@H]1CCCOC1 ZINC000886789508 647137605 /nfs/dbraw/zinc/13/76/05/647137605.db2.gz WJVNDMDMBTYNMI-JMSVASOKSA-N 0 3 297.370 2.624 20 10 CFCDHN Cc1cc(N(C)C)ccc1CN[C@@H](C)c1ccnnc1 ZINC000925081581 648101777 /nfs/dbraw/zinc/10/17/77/648101777.db2.gz SAOOICKPHFFLFT-ZDUSSCGKSA-N 0 3 270.380 2.702 20 10 CFCDHN C[C@H](NCCCSc1nccs1)c1cn(C)cn1 ZINC000925104497 648106959 /nfs/dbraw/zinc/10/69/59/648106959.db2.gz ZRKAGWNTOOZGQP-JTQLQIEISA-N 0 3 282.438 2.710 20 10 CFCDHN Cc1ccc(NCC[NH2+][C@@H](C)c2ccccc2[O-])nc1 ZINC000927073909 648698692 /nfs/dbraw/zinc/69/86/92/648698692.db2.gz VDXKXUTXTSUDQI-ZDUSSCGKSA-N 0 3 271.364 2.858 20 10 CFCDHN COC[C@H](C[N@H+](C)Cc1ccccc1[O-])C(C)C ZINC000929975004 649158539 /nfs/dbraw/zinc/15/85/39/649158539.db2.gz CROUKRZSLZDRPD-AWEZNQCLSA-N 0 3 251.370 2.743 20 10 CFCDHN COC[C@H](C[N@@H+](C)Cc1ccccc1[O-])C(C)C ZINC000929975004 649158540 /nfs/dbraw/zinc/15/85/40/649158540.db2.gz CROUKRZSLZDRPD-AWEZNQCLSA-N 0 3 251.370 2.743 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H]2c2ccnn2C)cc1 ZINC000932266392 649571554 /nfs/dbraw/zinc/57/15/54/649571554.db2.gz XPIYQBJSVLMWSG-KRWDZBQOSA-N 0 3 284.407 2.823 20 10 CFCDHN [O-]c1ccccc1C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000305745008 651074217 /nfs/dbraw/zinc/07/42/17/651074217.db2.gz MYRPSCAPOPSRRE-KRWDZBQOSA-N 0 3 283.371 2.874 20 10 CFCDHN [O-]c1ccccc1C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000305745008 651074219 /nfs/dbraw/zinc/07/42/19/651074219.db2.gz MYRPSCAPOPSRRE-KRWDZBQOSA-N 0 3 283.371 2.874 20 10 CFCDHN Cc1ccc(C)c(CN2CCOCC23CCC3)c1O ZINC001140182367 770263514 /nfs/dbraw/zinc/26/35/14/770263514.db2.gz QUVBZWBYAUBTQQ-UHFFFAOYSA-N 0 3 261.365 2.764 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]CCOC2CCC2)c1[O-] ZINC000690709489 770543805 /nfs/dbraw/zinc/54/38/05/770543805.db2.gz QKKKWTWPWIGCTO-UHFFFAOYSA-N 0 3 285.771 2.713 20 10 CFCDHN C[C@@H](Cc1ccccn1)[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000694086827 775359849 /nfs/dbraw/zinc/35/98/49/775359849.db2.gz ZZFCQGGAHQGDCI-SWLSCSKDSA-N 0 3 268.360 2.995 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H](CO)C(C)C)c1ccccc1[O-] ZINC000394022614 775546173 /nfs/dbraw/zinc/54/61/73/775546173.db2.gz KBBOSWHBXAVOQM-TZMCWYRMSA-N 0 3 251.370 2.697 20 10 CFCDHN C[C@@H]1CC([NH2+][C@H]2CCc3cccc([O-])c32)C[C@@H](C)O1 ZINC000694800637 775580076 /nfs/dbraw/zinc/58/00/76/775580076.db2.gz MSCMZBDKGPDBHT-GYSYKLTISA-N 0 3 261.365 2.925 20 10 CFCDHN C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1cc(F)ccc1[O-] ZINC000397928399 776071529 /nfs/dbraw/zinc/07/15/29/776071529.db2.gz LFNWPMYRQQJQSZ-PTRXPTGYSA-N 0 3 255.358 2.933 20 10 CFCDHN C[C@@H]1C[C@H](C[NH2+][C@@H]2CCc3cccc([O-])c32)[C@@H](C)O1 ZINC000686517676 776158035 /nfs/dbraw/zinc/15/80/35/776158035.db2.gz OXVKGKPHQHOHRR-HBJVGIJOSA-N 0 3 261.365 2.783 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C[C@H]1CC[C@@H](C(F)(F)F)O1 ZINC000722401026 776616792 /nfs/dbraw/zinc/61/67/92/776616792.db2.gz MLSBKOIFHLTPDA-PWSUYJOCSA-N 0 3 293.260 2.731 20 10 CFCDHN COC(=O)CC1C[NH+](Cc2c([O-])ccc3ccccc32)C1 ZINC001231589300 777269603 /nfs/dbraw/zinc/26/96/03/777269603.db2.gz BBKBWLTXAVZZPU-UHFFFAOYSA-N 0 3 285.343 2.540 20 10 CFCDHN COc1cc(CN2CC3(C2)CCCCC3)c(O)cc1O ZINC001231637154 777287203 /nfs/dbraw/zinc/28/72/03/777287203.db2.gz GLYFSTZOEHXQHF-UHFFFAOYSA-N 0 3 277.364 2.873 20 10 CFCDHN Cc1cc(C)c(CN2CCOC[C@@H]2C2CC2)c(O)c1 ZINC001231849946 777350893 /nfs/dbraw/zinc/35/08/93/777350893.db2.gz XHSVBRQGCFAHAX-OAHLLOKOSA-N 0 3 261.365 2.620 20 10 CFCDHN COc1cc(N(C)C)ccc1CN(C)CCc1ccccn1 ZINC001231849571 777351073 /nfs/dbraw/zinc/35/10/73/777351073.db2.gz WFENWOZPFOOMST-UHFFFAOYSA-N 0 3 299.418 2.831 20 10 CFCDHN COc1cc(N(C)C)ccc1CN1CCC[C@@]12CCOC2 ZINC001231855332 777351591 /nfs/dbraw/zinc/35/15/91/777351591.db2.gz QRDBJGPAGIWLDO-KRWDZBQOSA-N 0 3 290.407 2.516 20 10 CFCDHN CCN1CC[N@H+](Cc2cccc(Cl)c2[O-])C(C)(C)C1 ZINC001231912973 777383724 /nfs/dbraw/zinc/38/37/24/777383724.db2.gz BJVKPBNBUPJUAW-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN CCN1CC[N@@H+](Cc2cccc(Cl)c2[O-])C(C)(C)C1 ZINC001231912973 777383731 /nfs/dbraw/zinc/38/37/31/777383731.db2.gz BJVKPBNBUPJUAW-UHFFFAOYSA-N 0 3 282.815 2.962 20 10 CFCDHN COC(=O)c1c(CN2C[C@H]3CC[C@@H]2C3)c2ccccc2n1C ZINC001232405038 777548861 /nfs/dbraw/zinc/54/88/61/777548861.db2.gz DTSXSVAWGSAYLJ-QWHCGFSZSA-N 0 3 298.386 2.949 20 10 CFCDHN Oc1cccc2c1CN(Cc1cncc3cnccc31)CC2 ZINC001232652694 777630958 /nfs/dbraw/zinc/63/09/58/777630958.db2.gz KFYJQEMSYWPOKW-UHFFFAOYSA-N 0 3 291.354 2.894 20 10 CFCDHN CC(C)[N@H+](Cc1ccc(N(C)C)cc1[O-])C1CCOCC1 ZINC001232842035 777690063 /nfs/dbraw/zinc/69/00/63/777690063.db2.gz XSGAHMOHIWMPPY-UHFFFAOYSA-N 0 3 292.423 2.848 20 10 CFCDHN CC(C)[N@@H+](Cc1ccc(N(C)C)cc1[O-])C1CCOCC1 ZINC001232842035 777690068 /nfs/dbraw/zinc/69/00/68/777690068.db2.gz XSGAHMOHIWMPPY-UHFFFAOYSA-N 0 3 292.423 2.848 20 10 CFCDHN CCC[C@@H]1CCCCN1Cc1cc(O)c(O)c(O)c1 ZINC001233014067 777764559 /nfs/dbraw/zinc/76/45/59/777764559.db2.gz YASXZQOZBUPMHZ-GFCCVEGCSA-N 0 3 265.353 2.958 20 10 CFCDHN CCC[N@H+](CCOC)Cc1cc(Cl)cc(OC)c1[O-] ZINC001233287388 777866603 /nfs/dbraw/zinc/86/66/03/777866603.db2.gz OBBFVWXBOWGQMU-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN CCC[N@@H+](CCOC)Cc1cc(Cl)cc(OC)c1[O-] ZINC001233287388 777866608 /nfs/dbraw/zinc/86/66/08/777866608.db2.gz OBBFVWXBOWGQMU-UHFFFAOYSA-N 0 3 287.787 2.913 20 10 CFCDHN [O-]c1cc(O)ccc1C[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001168407311 777866667 /nfs/dbraw/zinc/86/66/67/777866667.db2.gz NRXPXFSOSYLLOR-OAHLLOKOSA-N 0 3 287.334 2.884 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+]2CC[C@@H](O)[C@@H](C)CC2)c1[O-] ZINC001233287766 777870277 /nfs/dbraw/zinc/87/02/77/777870277.db2.gz GWKDQEORFQYKHM-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](O)[C@@H](C)CC2)c1[O-] ZINC001233287766 777870286 /nfs/dbraw/zinc/87/02/86/777870286.db2.gz GWKDQEORFQYKHM-GXFFZTMASA-N 0 3 299.798 2.647 20 10 CFCDHN C[C@H]1CCC[C@@H](C[NH2+]Cc2cc(F)ccc2[O-])O1 ZINC000688883313 777885589 /nfs/dbraw/zinc/88/55/89/777885589.db2.gz KSEDNQCLVXGYLH-GWCFXTLKSA-N 0 3 253.317 2.579 20 10 CFCDHN Cc1cccc(CN(C)Cc2cc(O)c(O)cc2O)c1 ZINC001233482603 777961654 /nfs/dbraw/zinc/96/16/54/777961654.db2.gz UOYQLXCJTLDKGB-UHFFFAOYSA-N 0 3 273.332 2.744 20 10 CFCDHN Oc1c(CN2CCCOCC2)cccc1OC(F)(F)F ZINC001233728400 778056223 /nfs/dbraw/zinc/05/62/23/778056223.db2.gz WPOZCBQDBKMALE-UHFFFAOYSA-N 0 3 291.269 2.513 20 10 CFCDHN COc1cccc(C[N@H+](C(C)C)C2CCOCC2)c1[O-] ZINC000093604949 778330715 /nfs/dbraw/zinc/33/07/15/778330715.db2.gz IYINHUGGLBBJHQ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN COc1cccc(C[N@@H+](C(C)C)C2CCOCC2)c1[O-] ZINC000093604949 778330720 /nfs/dbraw/zinc/33/07/20/778330720.db2.gz IYINHUGGLBBJHQ-UHFFFAOYSA-N 0 3 279.380 2.790 20 10 CFCDHN [O-]c1c(C[NH+]2CC3(COC3)C2)cccc1-c1ccccc1 ZINC001234993214 778347446 /nfs/dbraw/zinc/34/74/46/778347446.db2.gz XDNRPOMTCYWMDG-UHFFFAOYSA-N 0 3 281.355 2.891 20 10 CFCDHN [O-]c1c(CN2CCCCC23C[NH2+]C3)ccc2ccccc21 ZINC001235102590 778381673 /nfs/dbraw/zinc/38/16/73/778381673.db2.gz RPNBWPQHWXAVCH-UHFFFAOYSA-N 0 3 282.387 2.873 20 10 CFCDHN [O-]c1cc(Cl)ccc1CN1CCCC[C@@]12CC[NH2+]C2 ZINC001235122441 778391644 /nfs/dbraw/zinc/39/16/44/778391644.db2.gz UTIHUYHXZHJJFO-HNNXBMFYSA-N 0 3 280.799 2.764 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001235676453 778532698 /nfs/dbraw/zinc/53/26/98/778532698.db2.gz SPABQQRAOMIUKI-GJZGRUSLSA-N 0 3 295.398 2.985 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@H](O)[C@@H](F)CC2)c([O-])c1 ZINC001235676453 778532700 /nfs/dbraw/zinc/53/27/00/778532700.db2.gz SPABQQRAOMIUKI-GJZGRUSLSA-N 0 3 295.398 2.985 20 10 CFCDHN CC(C)(C)c1ccc(C[NH+]2CC(C3COC3)C2)c([O-])c1 ZINC001235676812 778533841 /nfs/dbraw/zinc/53/38/41/778533841.db2.gz VVRAORFGLIEENA-UHFFFAOYSA-N 0 3 275.392 2.768 20 10 CFCDHN C[N@@H+](Cc1ccc(C(C)(C)C)cc1[O-])CC1COC1 ZINC001235677132 778534190 /nfs/dbraw/zinc/53/41/90/778534190.db2.gz BLNOVEJDRXFDMK-UHFFFAOYSA-N 0 3 263.381 2.768 20 10 CFCDHN C[N@H+](Cc1ccc(C(C)(C)C)cc1[O-])CC1COC1 ZINC001235677132 778534192 /nfs/dbraw/zinc/53/41/92/778534192.db2.gz BLNOVEJDRXFDMK-UHFFFAOYSA-N 0 3 263.381 2.768 20 10 CFCDHN CC(C)(C)c1ccc(C[N@@H+]2CC[C@H](CO)C2)c([O-])c1 ZINC001235685951 778537476 /nfs/dbraw/zinc/53/74/76/778537476.db2.gz VVAKDGDJTCVZJH-LBPRGKRZSA-N 0 3 263.381 2.504 20 10 CFCDHN CC(C)(C)c1ccc(C[N@H+]2CC[C@H](CO)C2)c([O-])c1 ZINC001235685951 778537479 /nfs/dbraw/zinc/53/74/79/778537479.db2.gz VVAKDGDJTCVZJH-LBPRGKRZSA-N 0 3 263.381 2.504 20 10 CFCDHN CN(Cc1cccc(Cl)c1[O-])C[C@@H]1CCC[N@@H+]1C ZINC000160248145 778597988 /nfs/dbraw/zinc/59/79/88/778597988.db2.gz LFMYBUPMQHCJGO-LBPRGKRZSA-N 0 3 268.788 2.572 20 10 CFCDHN CN(Cc1cccc(Cl)c1[O-])C[C@@H]1CCC[N@H+]1C ZINC000160248145 778597991 /nfs/dbraw/zinc/59/79/91/778597991.db2.gz LFMYBUPMQHCJGO-LBPRGKRZSA-N 0 3 268.788 2.572 20 10 CFCDHN [O-]c1c(CN2CC3(C2)CCCC[NH2+]3)ccc2ccccc21 ZINC001235923298 778610831 /nfs/dbraw/zinc/61/08/31/778610831.db2.gz XBFIKSLEYOYJKG-UHFFFAOYSA-N 0 3 282.387 2.873 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CCC[C@H]([NH2+]C2CC2)C1 ZINC001236219028 778742924 /nfs/dbraw/zinc/74/29/24/778742924.db2.gz VEVIKXVOMPEOFP-LBPRGKRZSA-N 0 3 280.799 2.762 20 10 CFCDHN CCOC1CC[NH+](Cc2ccc(CC)cc2[O-])CC1 ZINC001236790293 778936547 /nfs/dbraw/zinc/93/65/47/778936547.db2.gz VITDUSUILQFBDF-UHFFFAOYSA-N 0 3 263.381 2.956 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H](c3nc(C)no3)C2)c([O-])c1 ZINC001236791756 778936725 /nfs/dbraw/zinc/93/67/25/778936725.db2.gz KEGOTZSZFPJCPM-AWEZNQCLSA-N 0 3 287.363 2.636 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H](c3nc(C)no3)C2)c([O-])c1 ZINC001236791756 778936730 /nfs/dbraw/zinc/93/67/30/778936730.db2.gz KEGOTZSZFPJCPM-AWEZNQCLSA-N 0 3 287.363 2.636 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC001236791382 778937459 /nfs/dbraw/zinc/93/74/59/778937459.db2.gz HAQOBBSBSFUWHC-QGZVFWFLSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c([O-])c1 ZINC001236791382 778937463 /nfs/dbraw/zinc/93/74/63/778937463.db2.gz HAQOBBSBSFUWHC-QGZVFWFLSA-N 0 3 275.392 2.957 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@@H](C(=O)OC)CC2)c([O-])c1 ZINC001236789558 778937473 /nfs/dbraw/zinc/93/74/73/778937473.db2.gz YBPPMMKSORSIMR-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@@H](C(=O)OC)CC2)c([O-])c1 ZINC001236789558 778937475 /nfs/dbraw/zinc/93/74/75/778937475.db2.gz YBPPMMKSORSIMR-CQSZACIVSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+](CCOC)C(C)C)c([O-])c1 ZINC001236789798 778937804 /nfs/dbraw/zinc/93/78/04/778937804.db2.gz RPSWISXMTACKEH-UHFFFAOYSA-N 0 3 251.370 2.811 20 10 CFCDHN CCc1ccc(C[N@@H+](CCOC)C(C)C)c([O-])c1 ZINC001236789798 778937810 /nfs/dbraw/zinc/93/78/10/778937810.db2.gz RPSWISXMTACKEH-UHFFFAOYSA-N 0 3 251.370 2.811 20 10 CFCDHN CCc1ccc(C[N@@H+]2CC[C@H]3OCC[C@@H]3C2)c([O-])c1 ZINC001236792822 778938695 /nfs/dbraw/zinc/93/86/95/778938695.db2.gz RUIIFCPSLBYQKD-GDBMZVCRSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[N@H+]2CC[C@H]3OCC[C@@H]3C2)c([O-])c1 ZINC001236792822 778938700 /nfs/dbraw/zinc/93/87/00/778938700.db2.gz RUIIFCPSLBYQKD-GDBMZVCRSA-N 0 3 261.365 2.565 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(n3ccnc3)CC2)c([O-])c1 ZINC001236793571 778938802 /nfs/dbraw/zinc/93/88/02/778938802.db2.gz ZCGOFWPADDOEIJ-UHFFFAOYSA-N 0 3 285.391 2.988 20 10 CFCDHN CCc1ccc(CN2CC(N3CCCCC3)C2)c(O)c1 ZINC001236792985 778939449 /nfs/dbraw/zinc/93/94/49/778939449.db2.gz UUJLKERHIIHFGJ-UHFFFAOYSA-N 0 3 274.408 2.625 20 10 CFCDHN CCc1ccc(CN2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC001236792270 778939519 /nfs/dbraw/zinc/93/95/19/778939519.db2.gz NHJSSDIZALCUAT-MRXNPFEDSA-N 0 3 263.381 2.811 20 10 CFCDHN CCc1ccc(C[NH+]2CCC(C(C)=O)CC2)c([O-])c1 ZINC001236795205 778940932 /nfs/dbraw/zinc/94/09/32/778940932.db2.gz RSSOYRCXFCYFTO-UHFFFAOYSA-N 0 3 261.365 2.756 20 10 CFCDHN CCc1ccc(C[N@@H+]2CCC[C@](C)(C(=O)OC)C2)c([O-])c1 ZINC001236795626 778941898 /nfs/dbraw/zinc/94/18/98/778941898.db2.gz XCZMEDYQEVIGFE-KRWDZBQOSA-N 0 3 291.391 2.730 20 10 CFCDHN CCc1ccc(C[N@H+]2CCC[C@](C)(C(=O)OC)C2)c([O-])c1 ZINC001236795626 778941903 /nfs/dbraw/zinc/94/19/03/778941903.db2.gz XCZMEDYQEVIGFE-KRWDZBQOSA-N 0 3 291.391 2.730 20 10 CFCDHN COc1cc(C)c(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC001236816813 778949992 /nfs/dbraw/zinc/94/99/92/778949992.db2.gz YCPCVMXCUIXIOK-CHWSQXEVSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+]2CC[C@@H](OC)C[C@H]2C)c([O-])c1 ZINC001236816813 778949989 /nfs/dbraw/zinc/94/99/89/778949989.db2.gz YCPCVMXCUIXIOK-CHWSQXEVSA-N 0 3 279.380 2.709 20 10 CFCDHN COc1cc(C)c(C[N@H+](C)CCc2ccncc2)c([O-])c1 ZINC001236812916 778950160 /nfs/dbraw/zinc/95/01/60/778950160.db2.gz HMHJAFNVYQAMBP-UHFFFAOYSA-N 0 3 286.375 2.779 20 10 CFCDHN COc1cc(C)c(C[N@@H+](C)CCc2ccncc2)c([O-])c1 ZINC001236812916 778950165 /nfs/dbraw/zinc/95/01/65/778950165.db2.gz HMHJAFNVYQAMBP-UHFFFAOYSA-N 0 3 286.375 2.779 20 10 CFCDHN COc1cc(C)c(CN2CCC[C@H]2c2cnccn2)c(O)c1 ZINC001236813931 778950284 /nfs/dbraw/zinc/95/02/84/778950284.db2.gz MXAXMKPETAFTFU-INIZCTEOSA-N 0 3 299.374 2.836 20 10 CFCDHN CCC[N@H+](CCOC)Cc1c(C)cc(OC)cc1[O-] ZINC001236819681 778954082 /nfs/dbraw/zinc/95/40/82/778954082.db2.gz ZFBHSTUITWGPNZ-UHFFFAOYSA-N 0 3 267.369 2.568 20 10 CFCDHN CCC[N@@H+](CCOC)Cc1c(C)cc(OC)cc1[O-] ZINC001236819681 778954086 /nfs/dbraw/zinc/95/40/86/778954086.db2.gz ZFBHSTUITWGPNZ-UHFFFAOYSA-N 0 3 267.369 2.568 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@H+]1CC[C@@H](O)[C@H](F)CC1 ZINC001236827540 778956826 /nfs/dbraw/zinc/95/68/26/778956826.db2.gz UYUCORUMYQTNNI-HZPDHXFCSA-N 0 3 289.350 2.840 20 10 CFCDHN [O-]c1cc2ccccc2cc1C[N@@H+]1CC[C@@H](O)[C@H](F)CC1 ZINC001236827540 778956829 /nfs/dbraw/zinc/95/68/29/778956829.db2.gz UYUCORUMYQTNNI-HZPDHXFCSA-N 0 3 289.350 2.840 20 10 CFCDHN C[C@@H]1C[C@@H](O)CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832651 778957722 /nfs/dbraw/zinc/95/77/22/778957722.db2.gz JWUAMLQYLKZNTC-WBMJQRKESA-N 0 3 271.360 2.891 20 10 CFCDHN C[C@@H]1C[C@@H](O)CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236832651 778957726 /nfs/dbraw/zinc/95/77/26/778957726.db2.gz JWUAMLQYLKZNTC-WBMJQRKESA-N 0 3 271.360 2.891 20 10 CFCDHN COC[C@H]1CC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835063 778958963 /nfs/dbraw/zinc/95/89/63/778958963.db2.gz GZLCWLOWXNTMKM-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN COC[C@H]1CC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835063 778958968 /nfs/dbraw/zinc/95/89/68/778958968.db2.gz GZLCWLOWXNTMKM-OAHLLOKOSA-N 0 3 257.333 2.766 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834029 778959428 /nfs/dbraw/zinc/95/94/28/778959428.db2.gz RWOSJLBHYFLJCG-OAHLLOKOSA-N 0 3 299.370 2.930 20 10 CFCDHN CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236834029 778959429 /nfs/dbraw/zinc/95/94/29/778959429.db2.gz RWOSJLBHYFLJCG-OAHLLOKOSA-N 0 3 299.370 2.930 20 10 CFCDHN C[N@@H+](Cc1cc2ccccc2cc1[O-])CC1COC1 ZINC001236833082 778959664 /nfs/dbraw/zinc/95/96/64/778959664.db2.gz OFPCWEMPDHKZGW-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN C[N@H+](Cc1cc2ccccc2cc1[O-])CC1COC1 ZINC001236833082 778959671 /nfs/dbraw/zinc/95/96/71/778959671.db2.gz OFPCWEMPDHKZGW-UHFFFAOYSA-N 0 3 257.333 2.624 20 10 CFCDHN CCNC(=O)[C@@H]1CCC[N@@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835760 778960802 /nfs/dbraw/zinc/96/08/02/778960802.db2.gz RJVZEQCOEOZUJJ-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN CCNC(=O)[C@@H]1CCC[N@H+]1Cc1cc2ccccc2cc1[O-] ZINC001236835760 778960805 /nfs/dbraw/zinc/96/08/05/778960805.db2.gz RJVZEQCOEOZUJJ-INIZCTEOSA-N 0 3 298.386 2.646 20 10 CFCDHN COCC[NH+](CCOC)Cc1cc2ccccc2cc1[O-] ZINC001236841162 778961701 /nfs/dbraw/zinc/96/17/01/778961701.db2.gz VUQJIBGFBFOXMN-UHFFFAOYSA-N 0 3 289.375 2.640 20 10 CFCDHN C[C@@]1(O)CCC[N@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841455 778962099 /nfs/dbraw/zinc/96/20/99/778962099.db2.gz KSTISEKTDAPRNJ-QGZVFWFLSA-N 0 3 271.360 2.892 20 10 CFCDHN C[C@@]1(O)CCC[N@@H+](Cc2cc3ccccc3cc2[O-])C1 ZINC001236841455 778962102 /nfs/dbraw/zinc/96/21/02/778962102.db2.gz KSTISEKTDAPRNJ-QGZVFWFLSA-N 0 3 271.360 2.892 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](C)C2)c([O-])c1 ZINC001237046091 778998268 /nfs/dbraw/zinc/99/82/68/778998268.db2.gz PHMWLHAIDYGRMU-WFASDCNBSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CC[C@H](O)[C@@H](C)C2)c([O-])c1 ZINC001237046091 778998276 /nfs/dbraw/zinc/99/82/76/778998276.db2.gz PHMWLHAIDYGRMU-WFASDCNBSA-N 0 3 263.381 2.718 20 10 CFCDHN CC(C)c1ccc(C[N@@H+]2CCOC[C@@H](C)C2)c([O-])c1 ZINC001237046663 778998351 /nfs/dbraw/zinc/99/83/51/778998351.db2.gz VDFAGTKSKYGXON-ZDUSSCGKSA-N 0 3 263.381 2.984 20 10 CFCDHN CC(C)c1ccc(C[N@H+]2CCOC[C@@H](C)C2)c([O-])c1 ZINC001237046663 778998357 /nfs/dbraw/zinc/99/83/57/778998357.db2.gz VDFAGTKSKYGXON-ZDUSSCGKSA-N 0 3 263.381 2.984 20 10 CFCDHN CC[N@H+](CCOC)Cc1ccc(C(C)C)cc1[O-] ZINC001237046649 778999130 /nfs/dbraw/zinc/99/91/30/778999130.db2.gz UTFFCBHFYGCTOX-UHFFFAOYSA-N 0 3 251.370 2.984 20 10 CFCDHN CC[N@@H+](CCOC)Cc1ccc(C(C)C)cc1[O-] ZINC001237046649 778999131 /nfs/dbraw/zinc/99/91/31/778999131.db2.gz UTFFCBHFYGCTOX-UHFFFAOYSA-N 0 3 251.370 2.984 20 10 CFCDHN CCOc1ccc(C[N@@H+]2CC[C@](C)(CF)C2)c([O-])c1 ZINC001237046308 778999158 /nfs/dbraw/zinc/99/91/58/778999158.db2.gz ACZGBPTZJPTMRF-OAHLLOKOSA-N 0 3 267.344 2.972 20 10 CFCDHN CCOc1ccc(C[N@H+]2CC[C@](C)(CF)C2)c([O-])c1 ZINC001237046308 778999160 /nfs/dbraw/zinc/99/91/60/778999160.db2.gz ACZGBPTZJPTMRF-OAHLLOKOSA-N 0 3 267.344 2.972 20 10 CFCDHN CCN(Cc1c(O)ccc(Cl)c1Cl)C1CN(C)C1 ZINC001237083621 779005004 /nfs/dbraw/zinc/00/50/04/779005004.db2.gz BEEKOXYPYIUCKV-UHFFFAOYSA-N 0 3 289.206 2.835 20 10 CFCDHN Cc1cccc([O-])c1C[N@@H+]1CC[C@@H]2CCCO[C@H]2C1 ZINC001237484361 779118323 /nfs/dbraw/zinc/11/83/23/779118323.db2.gz CWTLAHFADOWTMK-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1cccc([O-])c1C[N@H+]1CC[C@@H]2CCCO[C@H]2C1 ZINC001237484361 779118326 /nfs/dbraw/zinc/11/83/26/779118326.db2.gz CWTLAHFADOWTMK-BBRMVZONSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001237933363 779210213 /nfs/dbraw/zinc/21/02/13/779210213.db2.gz AGZVJOOIUCMJLG-OTYXRUKQSA-N 0 3 285.746 2.796 20 10 CFCDHN [O-]c1cc(Cl)c(F)cc1C[N@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001237933363 779210217 /nfs/dbraw/zinc/21/02/17/779210217.db2.gz AGZVJOOIUCMJLG-OTYXRUKQSA-N 0 3 285.746 2.796 20 10 CFCDHN Cc1cc(F)cc(C[NH+]2CCC3(CCCO3)CC2)c1[O-] ZINC001238060442 779243006 /nfs/dbraw/zinc/24/30/06/779243006.db2.gz AVNYYCUPFIJATP-UHFFFAOYSA-N 0 3 279.355 2.985 20 10 CFCDHN COC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1[O-] ZINC001238065672 779243832 /nfs/dbraw/zinc/24/38/32/779243832.db2.gz XXTAEXZKSBADPE-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN COC[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(C)c1[O-] ZINC001238065672 779243834 /nfs/dbraw/zinc/24/38/34/779243834.db2.gz XXTAEXZKSBADPE-AWEZNQCLSA-N 0 3 267.344 2.841 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@H+](Cc2cc(F)cc(C)c2[O-])[C@@H]1C ZINC001238069138 779245331 /nfs/dbraw/zinc/24/53/31/779245331.db2.gz XGBDOKDVUOTCAS-BXUZGUMPSA-N 0 3 295.354 2.613 20 10 CFCDHN COC(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)cc(C)c2[O-])[C@@H]1C ZINC001238069138 779245337 /nfs/dbraw/zinc/24/53/37/779245337.db2.gz XGBDOKDVUOTCAS-BXUZGUMPSA-N 0 3 295.354 2.613 20 10 CFCDHN CN(Cc1cc(Cl)ccc1[O-])[C@@]1(C)CCC[NH2+]C1 ZINC001236199149 779496085 /nfs/dbraw/zinc/49/60/85/779496085.db2.gz FMMYWYRKBQEAIP-AWEZNQCLSA-N 0 3 268.788 2.620 20 10 CFCDHN Oc1ccccc1CN1CCC[C@H]1c1cnccn1 ZINC001203556700 780036510 /nfs/dbraw/zinc/03/65/10/780036510.db2.gz WHXOIRNXODJPKH-AWEZNQCLSA-N 0 3 255.321 2.519 20 10 CFCDHN C[C@@H]([NH2+][C@H]1CCCC2(C1)OCCO2)c1ccccc1[O-] ZINC000715714435 780316644 /nfs/dbraw/zinc/31/66/44/780316644.db2.gz CPBRSNVMSNAKHJ-OLZOCXBDSA-N 0 3 277.364 2.729 20 10 CFCDHN CCc1cccc(CN2CCO[C@H](C(C)C)C2)c1O ZINC000708999072 781287185 /nfs/dbraw/zinc/28/71/85/781287185.db2.gz DRFAGHUDNHEFJU-HNNXBMFYSA-N 0 3 263.381 2.811 20 10 CFCDHN Cc1cc(Cl)cc(C[NH2+][C@H](C)CCCCO)c1[O-] ZINC000295012771 199299941 /nfs/dbraw/zinc/29/99/41/199299941.db2.gz JQVIBMBWOCGUTA-LLVKDONJSA-N 0 3 271.788 2.995 20 10 CFCDHN COc1cccc(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c1[O-] ZINC000032131234 346300769 /nfs/dbraw/zinc/30/07/69/346300769.db2.gz QAQTZSBWVPRFJE-BLLLJJGKSA-N 0 3 287.359 2.613 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000093482967 347676495 /nfs/dbraw/zinc/67/64/95/347676495.db2.gz RUOFBPVMMQQVRG-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c([O-])c1 ZINC000093482967 347676496 /nfs/dbraw/zinc/67/64/96/347676496.db2.gz RUOFBPVMMQQVRG-UKRRQHHQSA-N 0 3 293.407 2.916 20 10 CFCDHN CN(C)c1ccc(CN2CCOCC23CCCC3)cc1 ZINC000093840482 347686644 /nfs/dbraw/zinc/68/66/44/347686644.db2.gz JLPQJVYTLUDJQB-UHFFFAOYSA-N 0 3 274.408 2.898 20 10 CFCDHN CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1[O-])C(C)(C)O ZINC000293564108 198685722 /nfs/dbraw/zinc/68/57/22/198685722.db2.gz GHGOWFMPLCWVEJ-LBPRGKRZSA-N 0 3 271.788 2.993 20 10 CFCDHN COc1cc(Cl)cc(C[NH2+]C[C@H](C)CCCO)c1[O-] ZINC000294816962 199195985 /nfs/dbraw/zinc/19/59/85/199195985.db2.gz ONCYGTDCWTYHRW-SNVBAGLBSA-N 0 3 287.787 2.552 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CC[C@H](SC)C2)c1[O-] ZINC000294925348 199251683 /nfs/dbraw/zinc/25/16/83/199251683.db2.gz BGQXEJFYCKCCIJ-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN CCOc1cccc(C[N@H+]2CC[C@H](SC)C2)c1[O-] ZINC000294925348 199251685 /nfs/dbraw/zinc/25/16/85/199251685.db2.gz BGQXEJFYCKCCIJ-LBPRGKRZSA-N 0 3 267.394 2.728 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)CC2 ZINC000297161739 200102294 /nfs/dbraw/zinc/10/22/94/200102294.db2.gz CWGCZJCPVDDQAP-CVEARBPZSA-N 0 3 283.371 2.573 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CC[C@H](C)CCO)c1 ZINC000297350428 200158466 /nfs/dbraw/zinc/15/84/66/200158466.db2.gz PCLAXZDCHRYLPQ-WCQYABFASA-N 0 3 251.370 2.760 20 10 CFCDHN CCC[C@@H](CCO)C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297645792 200251626 /nfs/dbraw/zinc/25/16/26/200251626.db2.gz JYIPDYGRTHYCNK-GXTWGEPZSA-N 0 3 263.381 2.768 20 10 CFCDHN [O-]c1cccc2c1[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)CC2 ZINC000297938612 200306807 /nfs/dbraw/zinc/30/68/07/200306807.db2.gz YAPIVFRMFGDQSH-HOTGVXAUSA-N 0 3 283.371 2.745 20 10 CFCDHN Cc1ccc([C@H](O)C[NH2+][C@H]2CCc3cccc([O-])c32)o1 ZINC000297970295 200310397 /nfs/dbraw/zinc/31/03/97/200310397.db2.gz ZUQMXXRNUDLNDZ-GXTWGEPZSA-N 0 3 273.332 2.604 20 10 CFCDHN COc1cccc(CC[NH2+]Cc2cc(OC)ccc2[O-])c1 ZINC000224547353 540735010 /nfs/dbraw/zinc/73/50/10/540735010.db2.gz VOJMZVQCZUITQQ-UHFFFAOYSA-N 0 3 287.359 2.742 20 10 CFCDHN COc1cccc(C[NH2+]CCc2ccccc2F)c1[O-] ZINC000019912702 372207786 /nfs/dbraw/zinc/20/77/86/372207786.db2.gz WHIUXTSOMRQFEA-UHFFFAOYSA-N 0 3 275.323 2.872 20 10 CFCDHN C[C@H](CN1CCCCC1)[NH2+][C@H](C)c1ccccc1[O-] ZINC000037154263 372656668 /nfs/dbraw/zinc/65/66/68/372656668.db2.gz BMHHXGBJBXNVIP-ZIAGYGMSSA-N 0 3 262.397 2.917 20 10 CFCDHN CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1[O-] ZINC000037643962 372677770 /nfs/dbraw/zinc/67/77/70/372677770.db2.gz WIOIGWIIPLFCEA-UKRRQHHQSA-N 0 3 262.397 2.775 20 10 CFCDHN COCc1cccc(C[NH2+]Cc2cc(OC)ccc2[O-])c1 ZINC000038010621 372764087 /nfs/dbraw/zinc/76/40/87/372764087.db2.gz PMSKCELWCPQTFW-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN COCc1cccc(CNCc2cc(OC)ccc2O)c1 ZINC000038010621 372764092 /nfs/dbraw/zinc/76/40/92/372764092.db2.gz PMSKCELWCPQTFW-UHFFFAOYSA-N 0 3 287.359 2.837 20 10 CFCDHN CC[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(C)cc1[O-] ZINC000293272209 522623636 /nfs/dbraw/zinc/62/36/36/522623636.db2.gz CIWDGTPCUYYRDA-ZFWWWQNUSA-N 0 3 264.413 2.939 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+]C1Cc2ccccc2C1 ZINC000083421207 374743973 /nfs/dbraw/zinc/74/39/73/374743973.db2.gz AXEBIVMZLZKOCU-UHFFFAOYSA-N 0 3 257.308 2.788 20 10 CFCDHN Cc1nn(C)c(C)c1C[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000092325869 375101552 /nfs/dbraw/zinc/10/15/52/375101552.db2.gz ZLSPJMBPANOVSP-LLVKDONJSA-N 0 3 273.380 2.902 20 10 CFCDHN CCOc1cccc(C[N@@H+]2CCC[C@H](COC)C2)c1[O-] ZINC000093337669 375215002 /nfs/dbraw/zinc/21/50/02/375215002.db2.gz XTIHWUASAMDKLD-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN CCOc1cccc(C[N@H+]2CCC[C@H](COC)C2)c1[O-] ZINC000093337669 375215008 /nfs/dbraw/zinc/21/50/08/375215008.db2.gz XTIHWUASAMDKLD-ZDUSSCGKSA-N 0 3 279.380 2.649 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644790 375283700 /nfs/dbraw/zinc/28/37/00/375283700.db2.gz ISHJWEBTAKQPNJ-HIFRSBDPSA-N 0 3 262.397 2.615 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000093644790 375283703 /nfs/dbraw/zinc/28/37/03/375283703.db2.gz ISHJWEBTAKQPNJ-HIFRSBDPSA-N 0 3 262.397 2.615 20 10 CFCDHN CCC1(CO)CC[NH+](Cc2cc(C)ccc2[O-])CC1 ZINC000093592371 375270463 /nfs/dbraw/zinc/27/04/63/375270463.db2.gz CHIOIQBHBGTARJ-UHFFFAOYSA-N 0 3 263.381 2.685 20 10 CFCDHN Cc1nn(C)c2ncc(CN(C)Cc3ccccc3O)cc12 ZINC000111236354 375835704 /nfs/dbraw/zinc/83/57/04/375835704.db2.gz CLYHUOLSMWNONU-UHFFFAOYSA-N 0 3 296.374 2.614 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC000121266722 376793330 /nfs/dbraw/zinc/79/33/30/376793330.db2.gz PDTLEFSYXBZGSP-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC000121266722 376793337 /nfs/dbraw/zinc/79/33/37/376793337.db2.gz PDTLEFSYXBZGSP-CYBMUJFWSA-N 0 3 271.364 2.803 20 10 CFCDHN C[C@H](NCc1ccc2c(c1)CCCN2C)c1cnn(C)c1 ZINC000122931676 376942264 /nfs/dbraw/zinc/94/22/64/376942264.db2.gz GIOYYIZLKCSYBM-ZDUSSCGKSA-N 0 3 284.407 2.653 20 10 CFCDHN Cn1ccc(CNCc2ccc3c(c2)CCCN3C)c1 ZINC000124581497 377065722 /nfs/dbraw/zinc/06/57/22/377065722.db2.gz HMXDDPMJKDJZMU-UHFFFAOYSA-N 0 3 269.392 2.697 20 10 CFCDHN Cc1cccc(C[NH2+]C[C@H](CC(C)C)N(C)C)c1[O-] ZINC000124694236 377077675 /nfs/dbraw/zinc/07/76/75/377077675.db2.gz GLBOWPCNSKPQMB-HNNXBMFYSA-N 0 3 264.413 2.767 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000124712477 377080391 /nfs/dbraw/zinc/08/03/91/377080391.db2.gz PMXMBPVGVNZNBF-CHWSQXEVSA-N 0 3 280.799 2.762 20 10 CFCDHN [O-]c1c(Cl)cccc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000124712477 377080393 /nfs/dbraw/zinc/08/03/93/377080393.db2.gz PMXMBPVGVNZNBF-CHWSQXEVSA-N 0 3 280.799 2.762 20 10 CFCDHN Cc1cccc(C[NH2+][C@@H](CC(C)C)CN(C)C)c1[O-] ZINC000124800604 377090772 /nfs/dbraw/zinc/09/07/72/377090772.db2.gz NAZLFLVTDAXTTF-HNNXBMFYSA-N 0 3 264.413 2.767 20 10 CFCDHN Cc1cccc(CN[C@H](CO)c2ccccc2)c1O ZINC000124818148 377092694 /nfs/dbraw/zinc/09/26/94/377092694.db2.gz LNVPQVOJAZOLPU-OAHLLOKOSA-N 0 3 257.333 2.524 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+](C[C@@H]2CCOC2)C2CC2)c1 ZINC000130028096 377503133 /nfs/dbraw/zinc/50/31/33/377503133.db2.gz YKUJMJMUYVUMHM-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c1 ZINC000130028096 377503138 /nfs/dbraw/zinc/50/31/38/377503138.db2.gz YKUJMJMUYVUMHM-ZDUSSCGKSA-N 0 3 261.365 2.702 20 10 CFCDHN [O-]c1cccc(Cl)c1CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000129920724 377490315 /nfs/dbraw/zinc/49/03/15/377490315.db2.gz DMRWFWGGLCYIIS-ZDUSSCGKSA-N 0 3 294.826 2.963 20 10 CFCDHN CCOc1cccc(C[N@H+](CC)C[C@@H]2CCCO2)c1[O-] ZINC000132668785 377864874 /nfs/dbraw/zinc/86/48/74/377864874.db2.gz RQFFFHIGXZRQQW-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN CCOc1cccc(C[N@@H+](CC)C[C@@H]2CCCO2)c1[O-] ZINC000132668785 377864883 /nfs/dbraw/zinc/86/48/83/377864883.db2.gz RQFFFHIGXZRQQW-AWEZNQCLSA-N 0 3 279.380 2.792 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000134606192 378036833 /nfs/dbraw/zinc/03/68/33/378036833.db2.gz DKUOOYATJHAPLX-KRWDZBQOSA-N 0 3 269.344 2.796 20 10 CFCDHN CC[C@H](N[C@@H]1C=C[C@H](CO)C1)c1ccc(N(C)C)cc1 ZINC000134627237 378040161 /nfs/dbraw/zinc/04/01/61/378040161.db2.gz SYOHWHHIUBXBLW-LXZKKBNFSA-N 0 3 274.408 2.730 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+][C@H]2CCO[C@]3(CCSC3)C2)c1 ZINC000151438674 378326617 /nfs/dbraw/zinc/32/66/17/378326617.db2.gz KHQGBPNBWILCPU-GOEBONIOSA-N 0 3 293.432 2.845 20 10 CFCDHN COc1cc([O-])c(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1OC ZINC000529637761 383739917 /nfs/dbraw/zinc/73/99/17/383739917.db2.gz DHIPGRWYDXATFJ-UPJWGTAASA-N 0 3 291.391 2.935 20 10 CFCDHN COCCC1CC[NH+](Cc2cc(OC)ccc2[O-])CC1 ZINC000529637294 383740047 /nfs/dbraw/zinc/74/00/47/383740047.db2.gz BLSAXYYKKPYENG-UHFFFAOYSA-N 0 3 279.380 2.649 20 10 CFCDHN COC(=O)C[C@@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000178776532 380485714 /nfs/dbraw/zinc/48/57/14/380485714.db2.gz UOLRTRJVWQHFJE-AWEZNQCLSA-N 0 3 277.364 2.537 20 10 CFCDHN COC(=O)C[C@@H]1CCC[N@H+]1Cc1cc(C)c(C)cc1[O-] ZINC000178776532 380485720 /nfs/dbraw/zinc/48/57/20/380485720.db2.gz UOLRTRJVWQHFJE-AWEZNQCLSA-N 0 3 277.364 2.537 20 10 CFCDHN CCN(CC)c1ccc(CNC(=O)[C@@H](N)C(C)(C)C)cc1 ZINC000178657211 380473439 /nfs/dbraw/zinc/47/34/39/380473439.db2.gz FVTKZJTYCSWYBU-OAHLLOKOSA-N 0 3 291.439 2.522 20 10 CFCDHN CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000179565728 380559403 /nfs/dbraw/zinc/55/94/03/380559403.db2.gz UQINOOBAAGJZFW-AWEZNQCLSA-N 0 3 290.407 2.521 20 10 CFCDHN CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000179565728 380559406 /nfs/dbraw/zinc/55/94/06/380559406.db2.gz UQINOOBAAGJZFW-AWEZNQCLSA-N 0 3 290.407 2.521 20 10 CFCDHN C[C@H]([NH2+][C@H]1Cc2ccccc2[C@@H]1O)c1ccccc1[O-] ZINC000179667827 380570079 /nfs/dbraw/zinc/57/00/79/380570079.db2.gz ADPJSIWWFTVTLL-KCTSRDHCSA-N 0 3 269.344 2.701 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(F)ccc1[O-] ZINC000180198311 380631917 /nfs/dbraw/zinc/63/19/17/380631917.db2.gz LQFBYCBYABSGQA-HNNXBMFYSA-N 0 3 280.387 2.838 20 10 CFCDHN CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cc(F)ccc1[O-] ZINC000180198311 380631921 /nfs/dbraw/zinc/63/19/21/380631921.db2.gz LQFBYCBYABSGQA-HNNXBMFYSA-N 0 3 280.387 2.838 20 10 CFCDHN CCN(Cc1ccccn1)Cc1cc(OC)ccc1O ZINC000180200259 380632714 /nfs/dbraw/zinc/63/27/14/380632714.db2.gz IXYODTFWOSNOQV-UHFFFAOYSA-N 0 3 272.348 2.818 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)CCn2cccn2)c1[O-] ZINC000180222673 380633990 /nfs/dbraw/zinc/63/39/90/380633990.db2.gz BOWXJEOITPUMKZ-UHFFFAOYSA-N 0 3 279.771 2.683 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)CCn2cccn2)c1[O-] ZINC000180222673 380633992 /nfs/dbraw/zinc/63/39/92/380633992.db2.gz BOWXJEOITPUMKZ-UHFFFAOYSA-N 0 3 279.771 2.683 20 10 CFCDHN C[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1ccccc1[O-] ZINC000179882327 380591405 /nfs/dbraw/zinc/59/14/05/380591405.db2.gz FROJRWTVQNPDCY-DZGCQCFKSA-N 0 3 271.360 2.646 20 10 CFCDHN C[C@@H]([NH2+][C@@H](C)C(=O)NCc1ccccc1)c1ccccc1[O-] ZINC000179878540 380592438 /nfs/dbraw/zinc/59/24/38/380592438.db2.gz TWKDNFKBYFXDCK-KGLIPLIRSA-N 0 3 298.386 2.748 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)c1ccccc1F)c1ccccc1[O-] ZINC000179890656 380593181 /nfs/dbraw/zinc/59/31/81/380593181.db2.gz CZVBXHWWIZCTQI-BZNIZROVSA-N 0 3 275.323 2.916 20 10 CFCDHN Cc1cccc(C[NH+]2CCC(n3ccnc3)CC2)c1[O-] ZINC000179902723 380594415 /nfs/dbraw/zinc/59/44/15/380594415.db2.gz PSWRSCNABNHTKH-UHFFFAOYSA-N 0 3 271.364 2.734 20 10 CFCDHN CCCCC[N@H+](CCO)Cc1cc(F)ccc1[O-] ZINC000179913902 380596336 /nfs/dbraw/zinc/59/63/36/380596336.db2.gz FQXZMHMDCWUYJX-UHFFFAOYSA-N 0 3 255.333 2.516 20 10 CFCDHN CCCCC[N@@H+](CCO)Cc1cc(F)ccc1[O-] ZINC000179913902 380596345 /nfs/dbraw/zinc/59/63/45/380596345.db2.gz FQXZMHMDCWUYJX-UHFFFAOYSA-N 0 3 255.333 2.516 20 10 CFCDHN Cc1ccc([O-])c(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1 ZINC000179963880 380603142 /nfs/dbraw/zinc/60/31/42/380603142.db2.gz CSNQUFIVBFPSBW-ZDUSSCGKSA-N 0 3 291.391 2.864 20 10 CFCDHN Cc1ccc([O-])c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1 ZINC000179963880 380603153 /nfs/dbraw/zinc/60/31/53/380603153.db2.gz CSNQUFIVBFPSBW-ZDUSSCGKSA-N 0 3 291.391 2.864 20 10 CFCDHN COc1cccc(CN2CCc3c(cccc3OC)C2)c1O ZINC000180787242 380699460 /nfs/dbraw/zinc/69/94/60/380699460.db2.gz CPDKFCCCGCGOPW-UHFFFAOYSA-N 0 3 299.370 2.968 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@@H]2CCOC[C@@H]2C)c1 ZINC000287426364 380829724 /nfs/dbraw/zinc/82/97/24/380829724.db2.gz KJYNJJZRGILAFS-AVGNSLFASA-N 0 3 279.380 2.724 20 10 CFCDHN Cc1cc(Cl)cc(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c1[O-] ZINC000289220241 381028158 /nfs/dbraw/zinc/02/81/58/381028158.db2.gz CKLCIQFBGYXCMK-CHWSQXEVSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cc(Cl)cc(C[N@H+](C)[C@@H]2CCC[C@H]2O)c1[O-] ZINC000289220241 381028167 /nfs/dbraw/zinc/02/81/67/381028167.db2.gz CKLCIQFBGYXCMK-CHWSQXEVSA-N 0 3 269.772 2.699 20 10 CFCDHN Cc1cccc(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c1[O-] ZINC000182090922 380989207 /nfs/dbraw/zinc/98/92/07/380989207.db2.gz RFVXGFVAJBLHLT-HNNXBMFYSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCC[C@@H](Cc3nccn3C)C2)c1[O-] ZINC000182090922 380989212 /nfs/dbraw/zinc/98/92/12/380989212.db2.gz RFVXGFVAJBLHLT-HNNXBMFYSA-N 0 3 299.418 2.889 20 10 CFCDHN Cc1cccc(C[NH2+][C@H]2CCO[C@]3(CCSC3)C2)c1[O-] ZINC000182635515 381126470 /nfs/dbraw/zinc/12/64/70/381126470.db2.gz YIQLIVRKBFFJDU-GOEBONIOSA-N 0 3 293.432 2.845 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCOCC3(CCC3)C2)c1 ZINC000368974418 381173071 /nfs/dbraw/zinc/17/30/71/381173071.db2.gz PAQYZVXNPJCBNV-CYBMUJFWSA-N 0 3 291.391 2.964 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCOCC3(CCC3)C2)c1 ZINC000368974418 381173081 /nfs/dbraw/zinc/17/30/81/381173081.db2.gz PAQYZVXNPJCBNV-CYBMUJFWSA-N 0 3 291.391 2.964 20 10 CFCDHN C[C@@H]1CCCN(CC[NH2+][C@H]2CCc3cccc([O-])c32)C1 ZINC000296019945 381214406 /nfs/dbraw/zinc/21/44/06/381214406.db2.gz PMEHSBOFUIGFOV-HIFRSBDPSA-N 0 3 274.408 2.701 20 10 CFCDHN CC(C)C[C@H](C[NH2+][C@H]1CCc2cccc([O-])c21)N(C)C ZINC000296101330 381254635 /nfs/dbraw/zinc/25/46/35/381254635.db2.gz UITSQHBUSBYSAL-CABCVRRESA-N 0 3 276.424 2.945 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]CCCC(C)(F)F)c1 ZINC000296098473 381254671 /nfs/dbraw/zinc/25/46/71/381254671.db2.gz RQTMCLANCBIGCV-UHFFFAOYSA-N 0 3 259.296 2.926 20 10 CFCDHN C[C@H]([NH2+]CCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[O-] ZINC000183394567 381266864 /nfs/dbraw/zinc/26/68/64/381266864.db2.gz FSYYUFAKCVNTIN-ZNMIVQPWSA-N 0 3 292.423 2.542 20 10 CFCDHN C[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000183545135 381286478 /nfs/dbraw/zinc/28/64/78/381286478.db2.gz YRIDLRWYZFPGKW-ZFWWWQNUSA-N 0 3 271.360 2.819 20 10 CFCDHN CCc1nn(C)c(OC)c1CN[C@H](C)c1ccccc1O ZINC000183590524 381290948 /nfs/dbraw/zinc/29/09/48/381290948.db2.gz XHOPBRGXDULKBE-LLVKDONJSA-N 0 3 289.379 2.548 20 10 CFCDHN Cc1cccc(CN2CCN(c3ccccc3O)CC2)c1O ZINC000183467338 381275694 /nfs/dbraw/zinc/27/56/94/381275694.db2.gz JUNKBHODCOTDBN-UHFFFAOYSA-N 0 3 298.386 2.728 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccccc1[O-] ZINC000183487358 381277270 /nfs/dbraw/zinc/27/72/70/381277270.db2.gz DKQVDWWUYIFLOJ-WBMJQRKESA-N 0 3 263.381 2.984 20 10 CFCDHN CCCN(CC)CC[NH2+][C@H](C)c1ccccc1[O-] ZINC000183541608 381285246 /nfs/dbraw/zinc/28/52/46/381285246.db2.gz XVKKPYOZTQBJDD-CYBMUJFWSA-N 0 3 250.386 2.775 20 10 CFCDHN C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccccc1[O-] ZINC000183545153 381285473 /nfs/dbraw/zinc/28/54/73/381285473.db2.gz YRIDLRWYZFPGKW-HIFRSBDPSA-N 0 3 271.360 2.819 20 10 CFCDHN COc1ccc(O)c(CN(C)[C@H](C)c2ccncc2)c1 ZINC000183712028 381308501 /nfs/dbraw/zinc/30/85/01/381308501.db2.gz DOXJOHICLQAUPC-GFCCVEGCSA-N 0 3 272.348 2.989 20 10 CFCDHN COc1cccc(CN(C)[C@H](C)c2cccnc2)c1O ZINC000183730596 381311339 /nfs/dbraw/zinc/31/13/39/381311339.db2.gz JTPMSMDJKWIZLS-GFCCVEGCSA-N 0 3 272.348 2.989 20 10 CFCDHN COCC1(C[NH2+][C@H]2CCc3cccc([O-])c32)CCC1 ZINC000296389788 381374648 /nfs/dbraw/zinc/37/46/48/381374648.db2.gz JTUBKVLHDVPLPF-ZDUSSCGKSA-N 0 3 261.365 2.786 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c([O-])c1 ZINC000296557214 381447186 /nfs/dbraw/zinc/44/71/86/381447186.db2.gz RYVOSJIMUPAESC-AVOUXACISA-N 0 3 274.408 2.976 20 10 CFCDHN CCC(CC)(C[NH2+][C@H]1CCc2cccc([O-])c21)C(=O)OC ZINC000296557758 381448305 /nfs/dbraw/zinc/44/83/05/381448305.db2.gz UCHHMVKVYAXDMS-ZDUSSCGKSA-N 0 3 291.391 2.949 20 10 CFCDHN C[C@@H](CCCCO)[NH2+][C@@H](C)c1cc(F)ccc1[O-] ZINC000296637971 381483647 /nfs/dbraw/zinc/48/36/47/381483647.db2.gz XXDCBGODYNVJQJ-QWRGUYRKSA-N 0 3 255.333 2.733 20 10 CFCDHN COc1cc(Cl)cc(C[N@H+](C)CC2(O)CCCC2)c1[O-] ZINC000184695762 381463154 /nfs/dbraw/zinc/46/31/54/381463154.db2.gz BDYRFVCQBJWAOM-UHFFFAOYSA-N 0 3 299.798 2.791 20 10 CFCDHN COc1cc(Cl)cc(C[N@@H+](C)CC2(O)CCCC2)c1[O-] ZINC000184695762 381463160 /nfs/dbraw/zinc/46/31/60/381463160.db2.gz BDYRFVCQBJWAOM-UHFFFAOYSA-N 0 3 299.798 2.791 20 10 CFCDHN COCCCCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000185233419 381572862 /nfs/dbraw/zinc/57/28/62/381572862.db2.gz AGPQKANWGAVKAW-LLVKDONJSA-N 0 3 255.333 2.999 20 10 CFCDHN CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3cccc([O-])c32)C1 ZINC000297836850 381573858 /nfs/dbraw/zinc/57/38/58/381573858.db2.gz SEJDHMXNPZNZOA-RBSFLKMASA-N 0 3 274.408 2.842 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CCc2ccccc2O)c1 ZINC000185302997 381591812 /nfs/dbraw/zinc/59/18/12/381591812.db2.gz HADRIXPGXVLULA-GFCCVEGCSA-N 0 3 287.359 3.000 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]C[C@@H](C)N(C)C2CC2)c1 ZINC000185368612 381612787 /nfs/dbraw/zinc/61/27/87/381612787.db2.gz WSHQMRZQUVIDCM-OLZOCXBDSA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@H](C)N(C)C2CC2)c1 ZINC000185368630 381613128 /nfs/dbraw/zinc/61/31/28/381613128.db2.gz WSHQMRZQUVIDCM-QWHCGFSZSA-N 0 3 262.397 2.834 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]C[C@@H](O)Cc2ccccc2)c1 ZINC000185370133 381616006 /nfs/dbraw/zinc/61/60/06/381616006.db2.gz RBRMZEQMOGPYJU-ZBFHGGJFSA-N 0 3 285.387 2.955 20 10 CFCDHN C[C@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1cc(F)ccc1[O-] ZINC000185475932 381643875 /nfs/dbraw/zinc/64/38/75/381643875.db2.gz FENRVFJTBQCQPB-APBUJDDRSA-N 0 3 287.400 2.729 20 10 CFCDHN C[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cc(F)ccc1[O-] ZINC000185482629 381645915 /nfs/dbraw/zinc/64/59/15/381645915.db2.gz PRMRVHNJUYCVGZ-ZYHUDNBSSA-N 0 3 269.360 2.979 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]CCC(=O)OC(C)(C)C)c1 ZINC000185540291 381661671 /nfs/dbraw/zinc/66/16/71/381661671.db2.gz BYRGBFVKWGDJBU-NSHDSACASA-N 0 3 295.379 2.783 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+]C[C@]2(C)CCCC[C@@H]2O)c1 ZINC000185644133 381691374 /nfs/dbraw/zinc/69/13/74/381691374.db2.gz ANPVKUUBMRBLHJ-ZLIFDBKOSA-N 0 3 293.407 2.993 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+][C@@H](C)C2CCOCC2)c1 ZINC000185782527 381732465 /nfs/dbraw/zinc/73/24/65/381732465.db2.gz MWPHNMRQSITRFD-NWDGAFQWSA-N 0 3 279.380 2.867 20 10 CFCDHN CC(C)N(Cc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 ZINC000291373753 381761434 /nfs/dbraw/zinc/76/14/34/381761434.db2.gz ZPCFBTPJZGWMQT-CQSZACIVSA-N 0 3 280.387 2.891 20 10 CFCDHN CC1(C)C[N@H+](Cc2ccccc2[O-])[C@@H]1[C@H]1CCCO1 ZINC000291658514 381767810 /nfs/dbraw/zinc/76/78/10/381767810.db2.gz VFHJTQBMSDAFOP-HUUCEWRRSA-N 0 3 261.365 2.782 20 10 CFCDHN CC1(C)C[N@@H+](Cc2ccccc2[O-])[C@@H]1[C@H]1CCCO1 ZINC000291658514 381767817 /nfs/dbraw/zinc/76/78/17/381767817.db2.gz VFHJTQBMSDAFOP-HUUCEWRRSA-N 0 3 261.365 2.782 20 10 CFCDHN COc1ccc([O-])c([C@H](C)[NH2+][C@@H](CO)CC(C)(C)C)c1 ZINC000186143492 381833721 /nfs/dbraw/zinc/83/37/21/381833721.db2.gz ROADPXQPXUMCJD-NWDGAFQWSA-N 0 3 281.396 2.849 20 10 CFCDHN C[C@H]([NH2+]CCCOC1CCOCC1)c1cc(F)ccc1[O-] ZINC000186074675 381818471 /nfs/dbraw/zinc/81/84/71/381818471.db2.gz VNPCHBPEQMWMFC-LBPRGKRZSA-N 0 3 297.370 2.768 20 10 CFCDHN Cc1ccc([O-])c([C@@H](C)[NH2+]CCCCCCO)c1 ZINC000186231139 381859646 /nfs/dbraw/zinc/85/96/46/381859646.db2.gz QELPVQPBBJTVRN-CYBMUJFWSA-N 0 3 251.370 2.904 20 10 CFCDHN CC[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1ccccc1[O-] ZINC000186249137 381863791 /nfs/dbraw/zinc/86/37/91/381863791.db2.gz DNYSVXHDJWXOTG-GUTXKFCHSA-N 0 3 263.381 2.984 20 10 CFCDHN CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1ccc(C)cc1[O-] ZINC000186354249 381889876 /nfs/dbraw/zinc/88/98/76/381889876.db2.gz LDNVHCNYWPVMQZ-LBPRGKRZSA-N 0 3 278.396 2.514 20 10 CFCDHN CCCC(=O)N1CCCN(Cc2cccc(C)c2O)CC1 ZINC000373222851 381952932 /nfs/dbraw/zinc/95/29/32/381952932.db2.gz DZMYRKUEGCTXST-UHFFFAOYSA-N 0 3 290.407 2.535 20 10 CFCDHN COc1ccc([O-])c(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1 ZINC000373370700 381988878 /nfs/dbraw/zinc/98/88/78/381988878.db2.gz RGGQQJZIYIWASC-DLBZAZTESA-N 0 3 291.391 2.696 20 10 CFCDHN CC[C@@H]([NH2+]CCCCCS(C)(=O)=O)c1ccccc1[O-] ZINC000186852837 382030251 /nfs/dbraw/zinc/03/02/51/382030251.db2.gz MHZJPTHDRYUYQP-CQSZACIVSA-N 0 3 299.436 2.648 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000375298180 382078639 /nfs/dbraw/zinc/07/86/39/382078639.db2.gz ACJPPGPMCUGXKU-OAHLLOKOSA-N 0 3 279.355 2.922 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000375298180 382078644 /nfs/dbraw/zinc/07/86/44/382078644.db2.gz ACJPPGPMCUGXKU-OAHLLOKOSA-N 0 3 279.355 2.922 20 10 CFCDHN COC[C@H]1CC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000293587286 382185694 /nfs/dbraw/zinc/18/56/94/382185694.db2.gz IEMCKHQHFINRTQ-CYBMUJFWSA-N 0 3 257.333 2.766 20 10 CFCDHN COC[C@H]1CC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000293587286 382185698 /nfs/dbraw/zinc/18/56/98/382185698.db2.gz IEMCKHQHFINRTQ-CYBMUJFWSA-N 0 3 257.333 2.766 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1cc(F)ccc1[O-] ZINC000293693178 382236360 /nfs/dbraw/zinc/23/63/60/382236360.db2.gz LHGNBYRASCWXPY-VXGBXAGGSA-N 0 3 296.386 2.734 20 10 CFCDHN CO[C@H](C[NH2+]Cc1cc(Cl)cc(C)c1[O-])C1CC1 ZINC000293617468 382198029 /nfs/dbraw/zinc/19/80/29/382198029.db2.gz KMELGVDPWUAYLI-CYBMUJFWSA-N 0 3 269.772 2.869 20 10 CFCDHN CC[C@@H](C)NC(=O)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1[O-] ZINC000293814888 382289760 /nfs/dbraw/zinc/28/97/60/382289760.db2.gz RTRMJEKSGARAJZ-KGLIPLIRSA-N 0 3 292.423 2.964 20 10 CFCDHN CC[C@@H]([NH2+]CCCc1cnn(C)n1)c1ccc(C)cc1[O-] ZINC000293720724 382249188 /nfs/dbraw/zinc/24/91/88/382249188.db2.gz NQFCTSSKXBCONL-OAHLLOKOSA-N 0 3 288.395 2.503 20 10 CFCDHN CC[C@H]([NH2+]CCCc1cnn(C)n1)c1ccc(C)cc1[O-] ZINC000293720721 382249437 /nfs/dbraw/zinc/24/94/37/382249437.db2.gz NQFCTSSKXBCONL-HNNXBMFYSA-N 0 3 288.395 2.503 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1ccccc1[O-] ZINC000293728696 382254345 /nfs/dbraw/zinc/25/43/45/382254345.db2.gz OFDYQHCGTSAMCP-CHWSQXEVSA-N 0 3 278.396 2.595 20 10 CFCDHN CN(C)c1ccc(CN[C@@H](CCO)c2ccccc2)cc1 ZINC000293819464 382291084 /nfs/dbraw/zinc/29/10/84/382291084.db2.gz OWDCEGVRRSHFMH-SFHVURJKSA-N 0 3 284.403 2.966 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](O)C(F)(F)F)c([O-])c1 ZINC000293771053 382272710 /nfs/dbraw/zinc/27/27/10/382272710.db2.gz PPGMNZILGAOVOJ-KOLCDFICSA-N 0 3 277.286 2.583 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)C(F)(F)F)c([O-])c1 ZINC000293771057 382272748 /nfs/dbraw/zinc/27/27/48/382272748.db2.gz PPGMNZILGAOVOJ-MWLCHTKSSA-N 0 3 277.286 2.583 20 10 CFCDHN CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1ccc(C)cc1[O-] ZINC000293774275 382273331 /nfs/dbraw/zinc/27/33/31/382273331.db2.gz SLKXJVCUQVTDPO-ZIAGYGMSSA-N 0 3 292.423 2.904 20 10 CFCDHN CC[C@@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1ccccc1[O-] ZINC000187975330 382313272 /nfs/dbraw/zinc/31/32/72/382313272.db2.gz JMFZULPSISMPLZ-YUELXQCFSA-N 0 3 263.381 2.984 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000293880117 382319969 /nfs/dbraw/zinc/31/99/69/382319969.db2.gz CZNJVIAAMKWAND-INIZCTEOSA-N 0 3 279.380 2.648 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000293880117 382319975 /nfs/dbraw/zinc/31/99/75/382319975.db2.gz CZNJVIAAMKWAND-INIZCTEOSA-N 0 3 279.380 2.648 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@@H+]1CCC[C@@H]1Cn1cncn1 ZINC000377694605 382321680 /nfs/dbraw/zinc/32/16/80/382321680.db2.gz HBGXVTSHEOTEIY-HIFRSBDPSA-N 0 3 286.379 2.599 20 10 CFCDHN CC[C@@H](c1ccccc1[O-])[N@H+]1CCC[C@@H]1Cn1cncn1 ZINC000377694605 382321686 /nfs/dbraw/zinc/32/16/86/382321686.db2.gz HBGXVTSHEOTEIY-HIFRSBDPSA-N 0 3 286.379 2.599 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3nc[nH]c3C2)c([O-])c1 ZINC000377803453 382349140 /nfs/dbraw/zinc/34/91/40/382349140.db2.gz WQOYQHFOEHOAGA-RYUDHWBXSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@H]2CCc3[nH]cnc3C2)c([O-])c1 ZINC000377803453 382349146 /nfs/dbraw/zinc/34/91/46/382349146.db2.gz WQOYQHFOEHOAGA-RYUDHWBXSA-N 0 3 271.364 2.632 20 10 CFCDHN Cc1cccc(C[N@H+](C)C[C@@H](O)Cc2ccccc2)c1[O-] ZINC000293941228 382346678 /nfs/dbraw/zinc/34/66/78/382346678.db2.gz OGXMRQWBVGSYLR-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN Cc1cccc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c1[O-] ZINC000293941228 382346682 /nfs/dbraw/zinc/34/66/82/382346682.db2.gz OGXMRQWBVGSYLR-KRWDZBQOSA-N 0 3 285.387 2.736 20 10 CFCDHN CCCOc1ccc(C[N@@H+]2CCCC[C@@H](CO)C2)c([O-])c1 ZINC000378350308 382443910 /nfs/dbraw/zinc/44/39/10/382443910.db2.gz RCUDBCSFTFZMPK-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN CCCOc1ccc(C[N@H+]2CCCC[C@@H](CO)C2)c([O-])c1 ZINC000378350308 382443918 /nfs/dbraw/zinc/44/39/18/382443918.db2.gz RCUDBCSFTFZMPK-CQSZACIVSA-N 0 3 293.407 2.775 20 10 CFCDHN COc1cc(Cl)cc(CN2CC([C@@H]3CCOC3)C2)c1O ZINC000365558285 382414747 /nfs/dbraw/zinc/41/47/47/382414747.db2.gz COALDYKPMCDQTH-SNVBAGLBSA-N 0 3 297.782 2.523 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@H]3OCC[C@H]32)cc1 ZINC000366276887 382496542 /nfs/dbraw/zinc/49/65/42/382496542.db2.gz ZKFFWXMEPRSAQE-HZPDHXFCSA-N 0 3 260.381 2.506 20 10 CFCDHN Cc1cn2c(n1)CC[C@@H]([NH2+][C@@H](C)c1ccccc1[O-])C2 ZINC000378617601 382491160 /nfs/dbraw/zinc/49/11/60/382491160.db2.gz BEPUDEKXRZJMGG-QWHCGFSZSA-N 0 3 271.364 2.563 20 10 CFCDHN Cc1cccnc1CCC[NH2+]Cc1cc(F)ccc1[O-] ZINC000294738335 382526626 /nfs/dbraw/zinc/52/66/26/382526626.db2.gz DSTTXZFAJBLDTK-UHFFFAOYSA-N 0 3 274.339 2.957 20 10 CFCDHN Cc1cc([O-])c(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)cc1C ZINC000366651568 382540053 /nfs/dbraw/zinc/54/00/53/382540053.db2.gz IIDJAJJMOZHUOT-LSDHHAIUSA-N 0 3 275.392 2.867 20 10 CFCDHN Cc1cc([O-])c(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)cc1C ZINC000366651568 382540058 /nfs/dbraw/zinc/54/00/58/382540058.db2.gz IIDJAJJMOZHUOT-LSDHHAIUSA-N 0 3 275.392 2.867 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH+]2CCC3(CCO3)CC2)c1 ZINC000367356069 382565663 /nfs/dbraw/zinc/56/56/63/382565663.db2.gz JLLGLNSJNOMBMP-GFCCVEGCSA-N 0 3 277.364 2.717 20 10 CFCDHN Cc1cccc(CNCc2cnc3n2CCCC3)c1O ZINC000367440091 382569946 /nfs/dbraw/zinc/56/99/46/382569946.db2.gz ZLLCUDDWDVBQAH-UHFFFAOYSA-N 0 3 271.364 2.523 20 10 CFCDHN CO[C@H](C[NH2+]Cc1cc(F)ccc1[O-])Cc1ccccc1 ZINC000294826811 382532339 /nfs/dbraw/zinc/53/23/39/382532339.db2.gz PPXVWTSRVSYNIZ-INIZCTEOSA-N 0 3 289.350 2.879 20 10 CFCDHN Cc1cccc(C[NH2+]C2(C(=O)N(C)C)CCCCC2)c1[O-] ZINC000295095621 382575592 /nfs/dbraw/zinc/57/55/92/382575592.db2.gz UGZNMZUBCSEEHC-UHFFFAOYSA-N 0 3 290.407 2.581 20 10 CFCDHN CN(C)c1ccc(CN2CC[C@H](O)CC(C)(C)C2)cc1F ZINC000295240716 382597376 /nfs/dbraw/zinc/59/73/76/382597376.db2.gz OZVZOMJORAIVDA-AWEZNQCLSA-N 0 3 294.414 2.875 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@@H]2CCC[C@H]2CCO)cc1C ZINC000189971895 382647622 /nfs/dbraw/zinc/64/76/22/382647622.db2.gz SGVYZBTUPAOIPP-DZGCQCFKSA-N 0 3 263.381 2.650 20 10 CFCDHN Cc1cccc(C[N@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190840474 382682245 /nfs/dbraw/zinc/68/22/45/382682245.db2.gz QAUDPGWTJBQBAH-NSHDSACASA-N 0 3 251.395 2.886 20 10 CFCDHN Cc1cccc(C[N@@H+]2CCSC[C@@H](C)C2)c1[O-] ZINC000190840474 382682246 /nfs/dbraw/zinc/68/22/46/382682246.db2.gz QAUDPGWTJBQBAH-NSHDSACASA-N 0 3 251.395 2.886 20 10 CFCDHN COc1ccc([O-])c(C[N@@H+]2CCSC[C@@H](C)C2)c1 ZINC000190847840 382682652 /nfs/dbraw/zinc/68/26/52/382682652.db2.gz LCEFKVZOWBBICL-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN COc1ccc([O-])c(C[N@H+]2CCSC[C@@H](C)C2)c1 ZINC000190847840 382682653 /nfs/dbraw/zinc/68/26/53/382682653.db2.gz LCEFKVZOWBBICL-NSHDSACASA-N 0 3 267.394 2.586 20 10 CFCDHN C[N@@H+](Cc1ccccc1[O-])C[C@H](O)CC1CCCC1 ZINC000190860882 382682851 /nfs/dbraw/zinc/68/28/51/382682851.db2.gz DOCUFRUBMZTBFI-OAHLLOKOSA-N 0 3 263.381 2.765 20 10 CFCDHN C[N@H+](Cc1ccccc1[O-])C[C@H](O)CC1CCCC1 ZINC000190860882 382682852 /nfs/dbraw/zinc/68/28/52/382682852.db2.gz DOCUFRUBMZTBFI-OAHLLOKOSA-N 0 3 263.381 2.765 20 10 CFCDHN COc1ccc(O)c(CNCc2cc(F)ccc2OC)c1 ZINC000189694522 382635891 /nfs/dbraw/zinc/63/58/91/382635891.db2.gz XJKRXQIVJISRQX-UHFFFAOYSA-N 0 3 291.322 2.838 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@@H]2CCSC2)c([O-])c1 ZINC000266124197 384085847 /nfs/dbraw/zinc/08/58/47/384085847.db2.gz AXQZIPDQFSGOBX-GFCCVEGCSA-N 0 3 267.394 2.776 20 10 CFCDHN C[C@@H]([NH2+]Cc1ccccc1[O-])[C@@H](O)c1cccc(F)c1 ZINC000267219154 384327689 /nfs/dbraw/zinc/32/76/89/384327689.db2.gz SJLJDHTUVANQNN-BDJLRTHQSA-N 0 3 275.323 2.743 20 10 CFCDHN CCOc1cccc(C[N@H+](CCO)C2CCCCC2)c1[O-] ZINC000269336604 384749752 /nfs/dbraw/zinc/74/97/52/384749752.db2.gz DTJVTLJHACXSNN-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN CCOc1cccc(C[N@@H+](CCO)C2CCCCC2)c1[O-] ZINC000269336604 384749757 /nfs/dbraw/zinc/74/97/57/384749757.db2.gz DTJVTLJHACXSNN-UHFFFAOYSA-N 0 3 293.407 2.918 20 10 CFCDHN Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1[O-] ZINC000281444328 385196435 /nfs/dbraw/zinc/19/64/35/385196435.db2.gz SJEIJOXQUXLGDH-UHFFFAOYSA-N 0 3 259.353 2.768 20 10 CFCDHN CC[C@H](NCc1ccc(OC)c(C)c1)[C@@H](O)C(F)(F)F ZINC000270864476 385250605 /nfs/dbraw/zinc/25/06/05/385250605.db2.gz FAPZZNBYJNYOIO-WCQYABFASA-N 0 3 291.313 2.795 20 10 CFCDHN CCCC[N@H+](CCC(=O)OC)Cc1ccccc1[O-] ZINC000282454519 385316455 /nfs/dbraw/zinc/31/64/55/385316455.db2.gz MCWWOGLFSFJJIK-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCCC[N@@H+](CCC(=O)OC)Cc1ccccc1[O-] ZINC000282454519 385316457 /nfs/dbraw/zinc/31/64/57/385316457.db2.gz MCWWOGLFSFJJIK-UHFFFAOYSA-N 0 3 265.353 2.557 20 10 CFCDHN CCCOc1ccc(C[NH2+][C@H]2CCO[C@@H](C)C2)c([O-])c1 ZINC000271218059 385377422 /nfs/dbraw/zinc/37/74/22/385377422.db2.gz FMBGMDXCJBUEJZ-JSGCOSHPSA-N 0 3 279.380 2.838 20 10 CFCDHN CCOC(=O)CC1CC[NH+](Cc2ccccc2[O-])CC1 ZINC000271324264 385380208 /nfs/dbraw/zinc/38/02/08/385380208.db2.gz XYZULUMWEPVCTN-UHFFFAOYSA-N 0 3 277.364 2.557 20 10 CFCDHN CCn1cc(CN[C@H](C)c2ccc(N(C)C)cc2)cn1 ZINC000271432260 385381175 /nfs/dbraw/zinc/38/11/75/385381175.db2.gz CAWIKSJTTQQHLI-CYBMUJFWSA-N 0 3 272.396 2.820 20 10 CFCDHN Cc1cccc(C[NH2+]CC2([C@H](C)CCO)CCC2)c1[O-] ZINC000271840849 385394244 /nfs/dbraw/zinc/39/42/44/385394244.db2.gz QULBMYIZMCFBOU-CQSZACIVSA-N 0 3 277.408 2.979 20 10 CFCDHN Cc1cc(O)c(CN[C@H]2CCCc3nn(C)cc32)cc1C ZINC000282920139 385410945 /nfs/dbraw/zinc/41/09/45/385410945.db2.gz HEEFWLKYFLHSFC-HNNXBMFYSA-N 0 3 285.391 2.910 20 10 CFCDHN Cc1cc([O-])c(C[NH2+][C@H]2CCCc3nn(C)cc32)cc1C ZINC000282920139 385410948 /nfs/dbraw/zinc/41/09/48/385410948.db2.gz HEEFWLKYFLHSFC-HNNXBMFYSA-N 0 3 285.391 2.910 20 10 CFCDHN Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)CCO)c([O-])c1 ZINC000283693776 385490372 /nfs/dbraw/zinc/49/03/72/385490372.db2.gz ANKANFZMCWUAME-GXFFZTMASA-N 0 3 251.370 2.678 20 10 CFCDHN COC(=O)[C@H]1CCCC[C@]1(C)[NH2+]Cc1cccc(C)c1[O-] ZINC000272415171 385531799 /nfs/dbraw/zinc/53/17/99/385531799.db2.gz MFKPNZHLZSROPF-PBHICJAKSA-N 0 3 291.391 2.912 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCC2(O)CCC2)c([O-])c1C ZINC000284386800 385548712 /nfs/dbraw/zinc/54/87/12/385548712.db2.gz OVVTWOMMXXPMMN-ZDUSSCGKSA-N 0 3 263.381 2.965 20 10 CFCDHN C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1ccccc1[O-] ZINC000272813196 385623356 /nfs/dbraw/zinc/62/33/56/385623356.db2.gz DKOWJWSVVIRFLP-IAQYHMDHSA-N 0 3 275.323 2.916 20 10 CFCDHN C[C@@H]([NH2+]CCc1cnn(C)c1)c1cc2c(cc1[O-])CCCC2 ZINC000273425029 385682730 /nfs/dbraw/zinc/68/27/30/385682730.db2.gz TXLMQEPCQYHSHQ-CYBMUJFWSA-N 0 3 299.418 2.898 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+]CCCN2CCCC2=O)c([O-])c1C ZINC000273421080 385683011 /nfs/dbraw/zinc/68/30/11/385683011.db2.gz SBXWRIDHZGDHPX-AWEZNQCLSA-N 0 3 290.407 2.672 20 10 CFCDHN COc1cccc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000273442741 385683055 /nfs/dbraw/zinc/68/30/55/385683055.db2.gz WSIHPRARTVVGJH-KBPBESRZSA-N 0 3 293.407 2.630 20 10 CFCDHN COc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1[O-] ZINC000273442741 385683057 /nfs/dbraw/zinc/68/30/57/385683057.db2.gz WSIHPRARTVVGJH-KBPBESRZSA-N 0 3 293.407 2.630 20 10 CFCDHN Cc1noc(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2[O-])n1 ZINC000273451677 385684249 /nfs/dbraw/zinc/68/42/49/385684249.db2.gz GCRGPGAGPUIPCO-NSHDSACASA-N 0 3 275.352 2.594 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[NH2+]CC2([C@H](O)C(C)C)CC2)c1 ZINC000273510289 385686190 /nfs/dbraw/zinc/68/61/90/385686190.db2.gz ROJAZSDBADFFPM-MLGOLLRUSA-N 0 3 293.407 2.849 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+]CCN(C)CC(F)(F)F)c1 ZINC000273559579 385688106 /nfs/dbraw/zinc/68/81/06/385688106.db2.gz HUQZFNBHLFNUSP-NSHDSACASA-N 0 3 290.329 2.845 20 10 CFCDHN CC[C@H](O)CC[NH2+][C@H](C)c1ccc(C)c(C)c1[O-] ZINC000273583656 385689812 /nfs/dbraw/zinc/68/98/12/385689812.db2.gz NFPQORPOWMJPKM-OLZOCXBDSA-N 0 3 251.370 2.821 20 10 CFCDHN CC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(C)c(C)c1[O-] ZINC000273584308 385689992 /nfs/dbraw/zinc/68/99/92/385689992.db2.gz NISFJJDQZAGSQY-SWLSCSKDSA-N 0 3 251.370 2.821 20 10 CFCDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)NC(C)(C)C)c(O)c1C ZINC000273615751 385690841 /nfs/dbraw/zinc/69/08/41/385690841.db2.gz XHONCCVLFPJALF-QWHCGFSZSA-N 0 3 292.423 2.963 20 10 CFCDHN CCOc1ccc([O-])c(C[NH2+][C@@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000273161146 385671413 /nfs/dbraw/zinc/67/14/13/385671413.db2.gz UGLGDCAQDNDSRS-SJORKVTESA-N 0 3 291.391 2.838 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@@H+]1CC[C@H](n2cncn2)C1 ZINC000372479974 393449913 /nfs/dbraw/zinc/44/99/13/393449913.db2.gz CWNMADKDTYATTB-AWEZNQCLSA-N 0 3 294.358 2.584 20 10 CFCDHN [O-]c1ccc2ccccc2c1C[N@H+]1CC[C@H](n2cncn2)C1 ZINC000372479974 393449917 /nfs/dbraw/zinc/44/99/17/393449917.db2.gz CWNMADKDTYATTB-AWEZNQCLSA-N 0 3 294.358 2.584 20 10 CFCDHN [O-]c1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1CO ZINC000372773180 393456896 /nfs/dbraw/zinc/45/68/96/393456896.db2.gz QMDBZNGGVTZNJV-QAPCUYQASA-N 0 3 283.371 2.778 20 10 CFCDHN C[C@H](CO)[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000263645204 393964355 /nfs/dbraw/zinc/96/43/55/393964355.db2.gz BGCBGOCOBJYCHP-GFCCVEGCSA-N 0 3 257.333 2.530 20 10 CFCDHN C[C@H](O)C[C@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 ZINC000127706817 394054682 /nfs/dbraw/zinc/05/46/82/394054682.db2.gz VFGBZKZZPXOBAN-GXTWGEPZSA-N 0 3 280.387 2.627 20 10 CFCDHN CN1CCc2cc(CNCc3c[nH]nc3C(C)(C)C)ccc21 ZINC000364454228 394216413 /nfs/dbraw/zinc/21/64/13/394216413.db2.gz YCNMEOKOLBYKER-UHFFFAOYSA-N 0 3 298.434 2.989 20 10 CFCDHN CC(C)N(Cc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 ZINC000291373751 394239545 /nfs/dbraw/zinc/23/95/45/394239545.db2.gz ZPCFBTPJZGWMQT-AWEZNQCLSA-N 0 3 280.387 2.891 20 10 CFCDHN CN(C)c1ccc(CN2CCC[C@@]23CCOC3)cc1F ZINC000367047694 394250292 /nfs/dbraw/zinc/25/02/92/394250292.db2.gz LSTIVWOXJRCTRW-INIZCTEOSA-N 0 3 278.371 2.647 20 10 CFCDHN COc1cc(O)c(CN2CCS[C@@H](C)[C@H]2C)cc1OC ZINC000160217595 286238989 /nfs/dbraw/zinc/23/89/89/286238989.db2.gz AJMGIBMFMAUNIC-MNOVXSKESA-N 0 3 297.420 2.735 20 10 CFCDHN CN(C)c1ccc(CNCc2cccc([N+](=O)[O-])c2)cc1 ZINC000020146124 171031725 /nfs/dbraw/zinc/03/17/25/171031725.db2.gz HMDOXUDAJHZOTR-UHFFFAOYSA-N 0 3 285.347 2.951 20 10 CFCDHN COc1ccc(C[NH2+][C@@H](C)c2ccccc2[O-])cn1 ZINC000020186165 171050266 /nfs/dbraw/zinc/05/02/66/171050266.db2.gz AMNOAJQCGAZVTE-NSHDSACASA-N 0 3 258.321 2.647 20 10 CFCDHN CCOc1cccc(CN[C@H](C)c2cnn(C)c2C)c1O ZINC000037167730 260072987 /nfs/dbraw/zinc/07/29/87/260072987.db2.gz NFKFVWKBZIACHQ-LLVKDONJSA-N 0 3 289.379 2.684 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C2(C3CC3)CCOCC2)c1 ZINC000364044545 262119251 /nfs/dbraw/zinc/11/92/51/262119251.db2.gz WIFMTBDMZCKVJO-UHFFFAOYSA-N 0 3 261.365 2.749 20 10 CFCDHN C[C@@H]([NH2+]Cc1cccc(-n2cncn2)c1)c1ccccc1[O-] ZINC000367783370 267117376 /nfs/dbraw/zinc/11/73/76/267117376.db2.gz LNLWBJPFGABBOE-CYBMUJFWSA-N 0 3 294.358 2.824 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@@H+]2CCC[C@H]3OCC[C@H]32)c1 ZINC000368052871 267142858 /nfs/dbraw/zinc/14/28/58/267142858.db2.gz ZRCZRYJVVZBZBL-DJSGYFEHSA-N 0 3 277.364 2.715 20 10 CFCDHN COc1ccc([O-])c([C@@H](C)[N@H+]2CCC[C@H]3OCC[C@H]32)c1 ZINC000368052871 267142860 /nfs/dbraw/zinc/14/28/60/267142860.db2.gz ZRCZRYJVVZBZBL-DJSGYFEHSA-N 0 3 277.364 2.715 20 10 CFCDHN Cc1cccc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c1[O-] ZINC000369476680 267245286 /nfs/dbraw/zinc/24/52/86/267245286.db2.gz NPLOQGXJAVXJFH-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1cccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1[O-] ZINC000369476680 267245288 /nfs/dbraw/zinc/24/52/88/267245288.db2.gz NPLOQGXJAVXJFH-MRXNPFEDSA-N 0 3 284.359 2.749 20 10 CFCDHN Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3c[nH]nc3C2)c([O-])c1 ZINC000370394570 267315397 /nfs/dbraw/zinc/31/53/97/267315397.db2.gz FRPBQFCZYBQJPT-WCQYABFASA-N 0 3 271.364 2.632 20 10 CFCDHN [O-]c1ccc(F)cc1C[NH2+][C@H]1C[C@H](CO)c2ccccc21 ZINC000370392377 267315743 /nfs/dbraw/zinc/31/57/43/267315743.db2.gz YLKJCOMWIKQZKE-WBMJQRKESA-N 0 3 287.334 2.842 20 10 CFCDHN C[C@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cc(Cl)ccc1[O-] ZINC000370397280 267316755 /nfs/dbraw/zinc/31/67/55/267316755.db2.gz MNQIGOHMPXPXQJ-CABZTGNLSA-N 0 3 291.782 2.977 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000375301893 267845625 /nfs/dbraw/zinc/84/56/25/267845625.db2.gz ICOBHNXTECDFKQ-HNNXBMFYSA-N 0 3 265.328 2.534 20 10 CFCDHN [O-]c1ccc(F)cc1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000375301893 267845629 /nfs/dbraw/zinc/84/56/29/267845629.db2.gz ICOBHNXTECDFKQ-HNNXBMFYSA-N 0 3 265.328 2.534 20 10 CFCDHN Cc1ccc([O-])c(C[NH2+]C[C@@]2(O)CCc3ccccc32)c1 ZINC000269809774 274755129 /nfs/dbraw/zinc/75/51/29/274755129.db2.gz LTZCSNUGRHVPTP-SFHVURJKSA-N 0 3 283.371 2.624 20 10 CFCDHN [O-]c1ccccc1C[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000360669246 275061736 /nfs/dbraw/zinc/06/17/36/275061736.db2.gz CCXDOMPJELDDHS-QGZVFWFLSA-N 0 3 287.334 2.625 20 10 CFCDHN [O-]c1ccccc1C[N@@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000360669246 275061737 /nfs/dbraw/zinc/06/17/37/275061737.db2.gz CCXDOMPJELDDHS-QGZVFWFLSA-N 0 3 287.334 2.625 20 10 CFCDHN CC1(C)CN(Cc2cc3c(cc2O)OCO3)[C@@H]1C1CC1 ZINC000291549003 276133730 /nfs/dbraw/zinc/13/37/30/276133730.db2.gz LZZDRZWTNYAZEG-OAHLLOKOSA-N 0 3 275.348 2.741 20 10 CFCDHN CC1(C)C[N@H+](Cc2cc3c(cc2[O-])OCO3)[C@@H]1C1CC1 ZINC000291549003 276133733 /nfs/dbraw/zinc/13/37/33/276133733.db2.gz LZZDRZWTNYAZEG-OAHLLOKOSA-N 0 3 275.348 2.741 20 10 CFCDHN CC1(C)C[N@@H+](Cc2cc3c(cc2[O-])OCO3)[C@@H]1C1CC1 ZINC000291549003 276133734 /nfs/dbraw/zinc/13/37/34/276133734.db2.gz LZZDRZWTNYAZEG-OAHLLOKOSA-N 0 3 275.348 2.741 20 10 CFCDHN CO[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000297648978 277642730 /nfs/dbraw/zinc/64/27/30/277642730.db2.gz KBEHGIWUDKXZTF-KCQAQPDRSA-N 0 3 261.365 2.927 20 10 CFCDHN CO[C@](C)(C[NH2+][C@@H]1CCc2cccc([O-])c21)C1CC1 ZINC000297467241 277773828 /nfs/dbraw/zinc/77/38/28/277773828.db2.gz YHNJJKXZWUGMPF-CZUORRHYSA-N 0 3 261.365 2.784 20 10 CFCDHN CCN1CCCC[C@@H]1C[NH2+][C@@H]1CCc2cccc([O-])c21 ZINC000297962732 279275227 /nfs/dbraw/zinc/27/52/27/279275227.db2.gz ZIQMTUBUBLRFNX-HUUCEWRRSA-N 0 3 274.408 2.844 20 10 CFCDHN CC[C@@H]([NH2+][C@H](C)C(=O)N(C)CC)c1ccc(C)cc1[O-] ZINC000280014686 280195380 /nfs/dbraw/zinc/19/53/80/280195380.db2.gz GXBDPXCNPAWZHV-TZMCWYRMSA-N 0 3 278.396 2.608 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)Cn2cccn2)c1 ZINC000037155952 280920822 /nfs/dbraw/zinc/92/08/22/280920822.db2.gz LKRNKIGNYOBQKM-OLZOCXBDSA-N 0 3 259.353 2.636 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@@H]2COc3ccccc3[C@H]2O)c1 ZINC000290300943 280920836 /nfs/dbraw/zinc/92/08/36/280920836.db2.gz NPNJNCYEAKUFDH-WBHUJUFNSA-N 0 3 299.370 2.846 20 10 CFCDHN Cc1c([C@@H](C)[NH2+][C@H]2CCc3cccc([O-])c32)cnn1C ZINC000296179855 300992168 /nfs/dbraw/zinc/99/21/68/300992168.db2.gz YALBKNTZGJIWEM-YGRLFVJLSA-N 0 3 271.364 2.772 20 10 CFCDHN Cc1ccc([O-])c([C@H](C)[NH2+][C@H](C)CC[S@](C)=O)c1 ZINC000168839139 301654786 /nfs/dbraw/zinc/65/47/86/301654786.db2.gz JCEHAGNKGJBIBC-FTLABTOESA-N 0 3 269.410 2.508 20 10 CFCDHN Cn1ncc2c1CCC[C@@H]2[NH2+][C@H]1CCc2cccc([O-])c21 ZINC000295926001 303056578 /nfs/dbraw/zinc/05/65/78/303056578.db2.gz JYVASZFKKGNBLN-KBPBESRZSA-N 0 3 283.375 2.780 20 10 CFCDHN [O-]c1cccc2c1[C@H]([NH2+][C@@H]1CCC[C@H]3OCC[C@H]31)CC2 ZINC000296264453 328289801 /nfs/dbraw/zinc/28/98/01/328289801.db2.gz BQIUMECKZBIXOS-DSJMHWKBSA-N 0 3 273.376 2.927 20 10 CFCDHN CCn1cncc1CNCc1c(C)c2ccccc2n1C ZINC000418039447 328853084 /nfs/dbraw/zinc/85/30/84/328853084.db2.gz ZWNLVFDWYFLGLB-UHFFFAOYSA-N 0 3 282.391 2.993 20 10 CFCDHN [O-]c1ccccc1C[NH2+]C[C@H]1CCN1C1CCCCC1 ZINC000527752112 330281135 /nfs/dbraw/zinc/28/11/35/330281135.db2.gz MKYMASFXZRGBBU-MRXNPFEDSA-N 0 3 274.408 2.889 20 10 CFCDHN Cn1cc2ccc(CNCc3ccc4c(c3)CCO4)cc2n1 ZINC000527760269 330281285 /nfs/dbraw/zinc/28/12/85/330281285.db2.gz BCMSDSNWCVKDGJ-UHFFFAOYSA-N 0 3 293.370 2.798 20 10 CFCDHN Cc1ccc(O)c([C@@H](C)N[C@@H]2Cc3ccccc3NC2=O)c1 ZINC000528000000 330299986 /nfs/dbraw/zinc/29/99/86/330299986.db2.gz MIYLRSSNMAPNFL-MLGOLLRUSA-N 0 3 296.370 2.915 20 10 CFCDHN