smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592896667 979798190 /nfs/dbraw/zinc/79/81/90/979798190.db2.gz RFDKXYYXGGAOMD-NEPJUHHUSA-N -1 3 317.360 3.511 20 10 DHCDHM CC[C@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1ccc(C)cc1[O-] ZINC001595305527 980447955 /nfs/dbraw/zinc/44/79/55/980447955.db2.gz QZESDWIIIGSELQ-KRWDZBQOSA-N -1 3 313.397 3.569 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@H](C)CC2)c1[O-] ZINC000192178625 1014710521 /nfs/dbraw/zinc/71/05/21/1014710521.db2.gz QHZXYSHNCYXRAY-SNVBAGLBSA-N -1 3 313.850 3.576 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@H](C)c2ccncc2)c1[O-] ZINC000091989032 1014799809 /nfs/dbraw/zinc/79/98/09/1014799809.db2.gz JTKGLRLDNOQQJQ-LLVKDONJSA-N -1 3 318.804 3.836 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCC[C@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599841216 988836719 /nfs/dbraw/zinc/83/67/19/988836719.db2.gz RRYTWRDWOOXZGC-KFWWJZLASA-N -1 3 305.418 3.857 20 10 DHCDHM CC[C@H](C)c1nc([C@H](C)N[C@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000276816325 1015679866 /nfs/dbraw/zinc/67/98/66/1015679866.db2.gz AGZILKAEYIZTBO-AEJSXWLSSA-N -1 3 324.375 3.714 20 10 DHCDHM C=Cc1cnc(NCc2cc(Cl)c3cccnc3c2[O-])nc1 ZINC001168528202 1016936620 /nfs/dbraw/zinc/93/66/20/1016936620.db2.gz PJFVVSWJGHEPHM-UHFFFAOYSA-N -1 3 312.760 3.639 20 10 DHCDHM C[C@@H](N[C@H](C)c1cc(Cl)c(Cl)cc1[O-])c1ccn(C)n1 ZINC000840815274 1017078159 /nfs/dbraw/zinc/07/81/59/1017078159.db2.gz DHUMPUXLMKEEQY-RKDXNWHRSA-N -1 3 314.216 3.844 20 10 DHCDHM CC(C)N(Cc1c([O-])cccc1Br)CC(F)F ZINC000707167346 1018791216 /nfs/dbraw/zinc/79/12/16/1018791216.db2.gz XZHZXBXGOVPIKE-UHFFFAOYSA-N -1 3 308.166 3.630 20 10 DHCDHM CCc1onc(C)c1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000922987198 1018966145 /nfs/dbraw/zinc/96/61/45/1018966145.db2.gz BMAUSPHPQXQBEZ-UHFFFAOYSA-N -1 3 315.200 3.848 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@H]2c2ccnn2C)cc1Cl ZINC000825768511 1032798744 /nfs/dbraw/zinc/79/87/44/1032798744.db2.gz PIFUQVDTNTZRFB-INIZCTEOSA-N -1 3 319.836 3.815 20 10 DHCDHM COCCOc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1 ZINC000170789423 1019435636 /nfs/dbraw/zinc/43/56/36/1019435636.db2.gz MQWNHEHRSFVMOF-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM Cc1ccc(C(=O)N(C)c2ccc(C)c(Cl)c2)c([O-])c1O ZINC000179497185 1020359479 /nfs/dbraw/zinc/35/94/79/1020359479.db2.gz SFPOHDBTZVFBNY-UHFFFAOYSA-N -1 3 305.761 3.645 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN[C@H](C)c2cscn2)c1[O-] ZINC000852417771 1022120370 /nfs/dbraw/zinc/12/03/70/1022120370.db2.gz NNUGQXVUDJERBW-MRVPVSSYSA-N -1 3 310.806 3.556 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCc2sccc2C1 ZINC000768227978 1022928487 /nfs/dbraw/zinc/92/84/87/1022928487.db2.gz XBQBHYHOEVJLMI-UHFFFAOYSA-N -1 3 324.243 3.775 20 10 DHCDHM C[C@]1(c2ccccc2)CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000769399877 1023139205 /nfs/dbraw/zinc/13/92/05/1023139205.db2.gz WOHDAOJGPPYFDP-GOSISDBHSA-N -1 3 317.816 3.793 20 10 DHCDHM CC(C)(O)COc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000770579566 1023327505 /nfs/dbraw/zinc/32/75/05/1023327505.db2.gz QEIWVXLDSLONKA-UHFFFAOYSA-N -1 3 321.804 3.807 20 10 DHCDHM Cc1cccc([C@H]2CCCN2Cc2ccc(F)c(F)c2[O-])n1 ZINC000876739509 1033130981 /nfs/dbraw/zinc/13/09/81/1033130981.db2.gz JGISHYCQQVKYFO-OAHLLOKOSA-N -1 3 304.340 3.711 20 10 DHCDHM Cn1c(=O)ccc2ccc(NCc3c([O-])cccc3Cl)cc21 ZINC000785534219 1023587505 /nfs/dbraw/zinc/58/75/05/1023587505.db2.gz LHOBZEWENGIJBB-UHFFFAOYSA-N -1 3 314.772 3.510 20 10 DHCDHM CCN(Cc1cc(Cl)cc(C(C)=O)c1[O-])c1cccc(O)c1 ZINC000789456763 1024088381 /nfs/dbraw/zinc/08/83/81/1024088381.db2.gz ROVCFGQQOYCUQB-UHFFFAOYSA-N -1 3 319.788 3.980 20 10 DHCDHM COc1ccc(F)cc1[C@@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000882899476 1024164126 /nfs/dbraw/zinc/16/41/26/1024164126.db2.gz NYLFWBGALWHGNX-SECBINFHSA-N -1 3 311.303 3.669 20 10 DHCDHM CCCCOc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000790570258 1024327534 /nfs/dbraw/zinc/32/75/34/1024327534.db2.gz LEXRRJBSUGDJOJ-UHFFFAOYSA-N -1 3 301.342 3.529 20 10 DHCDHM Cc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c(Cl)n1 ZINC000883301713 1024357295 /nfs/dbraw/zinc/35/72/95/1024357295.db2.gz HIHWXEZJLIABCF-JTQLQIEISA-N -1 3 321.764 3.508 20 10 DHCDHM Cc1cccc(CN(CC(C)C)C(=O)c2cccc(O)c2[O-])c1 ZINC000790749189 1024370126 /nfs/dbraw/zinc/37/01/26/1024370126.db2.gz DRDUZJZZYNFILS-UHFFFAOYSA-N -1 3 313.397 3.705 20 10 DHCDHM CC(C)n1cc([C@@H](C)NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790958725 1024404724 /nfs/dbraw/zinc/40/47/24/1024404724.db2.gz MCWUOEFUGGYYDK-SNVBAGLBSA-N -1 3 311.788 3.813 20 10 DHCDHM CC(C)n1ncc2cc(NCc3c([O-])cccc3Cl)cnc21 ZINC000317462613 1024542930 /nfs/dbraw/zinc/54/29/30/1024542930.db2.gz VTWUVQJQERNSTM-UHFFFAOYSA-N -1 3 316.792 3.983 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H](OCC2CC2)C1 ZINC000792179068 1024644580 /nfs/dbraw/zinc/64/45/80/1024644580.db2.gz FOCXEJOFLZRHPZ-GFCCVEGCSA-N -1 3 313.800 3.576 20 10 DHCDHM C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000804526014 1025338765 /nfs/dbraw/zinc/33/87/65/1025338765.db2.gz IWFOUMFVIVEQGO-BBRMVZONSA-N -1 3 311.381 3.711 20 10 DHCDHM CC(C)Oc1ncccc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886505032 1025659054 /nfs/dbraw/zinc/65/90/54/1025659054.db2.gz FZCOOSALHHAEBS-LBPRGKRZSA-N -1 3 304.365 3.564 20 10 DHCDHM C[C@@H](N[C@@H]1CCOc2ccc(F)cc21)c1c([O-])cccc1F ZINC000886547311 1025695232 /nfs/dbraw/zinc/69/52/32/1025695232.db2.gz IZXKZPNGMAHXOM-QMTHXVAHSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](Nc1cccc(N2CCCC2=O)c1)c1c([O-])cccc1F ZINC000886564139 1025709897 /nfs/dbraw/zinc/70/98/97/1025709897.db2.gz OEACOHWXMPDKSD-GFCCVEGCSA-N -1 3 314.360 3.831 20 10 DHCDHM C[C@@H](Nc1cccc(N2CCOCC2)c1)c1c([O-])cccc1F ZINC000886568520 1025713263 /nfs/dbraw/zinc/71/32/63/1025713263.db2.gz MQSFIWNUJPLTPN-CYBMUJFWSA-N -1 3 316.376 3.541 20 10 DHCDHM COCCOc1ccccc1N[C@H](C)c1c([O-])cccc1F ZINC000886584450 1025719757 /nfs/dbraw/zinc/71/97/57/1025719757.db2.gz PBKKACGVWGIURI-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM CC1(O)C[C@H]2CC[C@@H](C1)N2Cc1cc(Cl)cc(Cl)c1[O-] ZINC000359892212 1025723398 /nfs/dbraw/zinc/72/33/98/1025723398.db2.gz AWDXRVBLLYWJIK-ODOQXGPZSA-N -1 3 316.228 3.577 20 10 DHCDHM C[C@H](N[C@H]1CCOc2c(F)cccc21)c1c([O-])cccc1F ZINC000886597083 1025731429 /nfs/dbraw/zinc/73/14/29/1025731429.db2.gz VXIPSANVUWPRDJ-HZMBPMFUSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](Nc1cccc([C@@H]2CCC(=O)N2)c1)c1c([O-])cccc1F ZINC000886626575 1025746370 /nfs/dbraw/zinc/74/63/70/1025746370.db2.gz GHFXAWQQZUHFOG-ABAIWWIYSA-N -1 3 314.360 3.656 20 10 DHCDHM C[C@H](Nc1cccc([C@@H]2CCC(=O)N2)c1)c1c([O-])cccc1F ZINC000886626577 1025748632 /nfs/dbraw/zinc/74/86/32/1025748632.db2.gz GHFXAWQQZUHFOG-NHYWBVRUSA-N -1 3 314.360 3.656 20 10 DHCDHM C[C@@H](N[C@@H](CCO)C(F)(F)F)c1ccc2ccccc2c1[O-] ZINC000886800954 1025918802 /nfs/dbraw/zinc/91/88/02/1025918802.db2.gz FKXXCNINCXVHQA-YGRLFVJLSA-N -1 3 313.319 3.509 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@@H]1NCc1cc(Cl)cc(F)c1[O-] ZINC000809787456 1026626211 /nfs/dbraw/zinc/62/62/11/1026626211.db2.gz DLSPBZDSVNWLFM-BJOHPYRUSA-N -1 3 307.752 3.797 20 10 DHCDHM CC[C@H](NCc1cocn1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810232028 1026715309 /nfs/dbraw/zinc/71/53/09/1026715309.db2.gz USOIZPGWPHTDMB-LBPRGKRZSA-N -1 3 300.280 3.640 20 10 DHCDHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126396586 1027550482 /nfs/dbraw/zinc/55/04/82/1027550482.db2.gz CNOAMQDAQBYLDH-SNVBAGLBSA-N -1 3 305.761 3.584 20 10 DHCDHM CCOC1(C)CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000814170558 1027925379 /nfs/dbraw/zinc/92/53/79/1027925379.db2.gz YSAHAMHJONECSL-UHFFFAOYSA-N -1 3 301.789 3.576 20 10 DHCDHM Cc1n[nH]c(C)c1[C@@H]1CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000367722616 1028230224 /nfs/dbraw/zinc/23/02/24/1028230224.db2.gz AYGVHSCXKFTGPJ-ZDUSSCGKSA-N -1 3 323.799 3.862 20 10 DHCDHM C[C@@H](NCc1ccc(F)cn1)c1cccc(C(F)(F)F)c1[O-] ZINC000815589388 1028559517 /nfs/dbraw/zinc/55/95/17/1028559517.db2.gz QPJAYXOXZNKKES-SECBINFHSA-N -1 3 314.282 3.796 20 10 DHCDHM Cc1csc([C@@H](C)NCc2cc(Cl)c(F)cc2[O-])n1 ZINC000816546145 1028930600 /nfs/dbraw/zinc/93/06/00/1028930600.db2.gz YLORQFFWBDKTRE-MRVPVSSYSA-N -1 3 300.786 3.800 20 10 DHCDHM C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816594754 1028956280 /nfs/dbraw/zinc/95/62/80/1028956280.db2.gz OGSDGCXSWYGKJE-CBAPKCEASA-N -1 3 311.706 3.957 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000290896166 1030241565 /nfs/dbraw/zinc/24/15/65/1030241565.db2.gz LUJBBMZENHIDOF-HOCLYGCPSA-N -1 3 307.821 3.579 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@@H](c3ccco3)C2)cc1Cl ZINC000824905758 1030663177 /nfs/dbraw/zinc/66/31/77/1030663177.db2.gz BYTYWMXJUWOXNO-MRXNPFEDSA-N -1 3 307.777 3.521 20 10 DHCDHM Cc1ccc(CCCC(=O)NCc2c([O-])cccc2F)s1 ZINC000928705181 1031363465 /nfs/dbraw/zinc/36/34/65/1031363465.db2.gz GVVVNSUFGSWLKN-UHFFFAOYSA-N -1 3 307.390 3.540 20 10 DHCDHM Cc1cc([O-])c(CNCc2ncc(Cl)s2)c(Cl)c1 ZINC000873164299 1031733801 /nfs/dbraw/zinc/73/38/01/1031733801.db2.gz GFJVCTLUBKDGCB-UHFFFAOYSA-N -1 3 303.214 3.754 20 10 DHCDHM Cc1ccc(CN(C)Cc2c([O-])cccc2Br)o1 ZINC000862213895 1033781349 /nfs/dbraw/zinc/78/13/49/1033781349.db2.gz XWPNPPGDAKYEEB-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM C[C@H](NCc1cc(Cl)ccc1[O-])c1nc(C(C)(C)C)no1 ZINC000174662589 1035813942 /nfs/dbraw/zinc/81/39/42/1035813942.db2.gz NMKHHVAOIHXMDC-VIFPVBQESA-N -1 3 309.797 3.577 20 10 DHCDHM CC[C@H](C)OC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001195144260 1036150131 /nfs/dbraw/zinc/15/01/31/1036150131.db2.gz LFONYIOUQHOPOD-VIFPVBQESA-N -1 3 308.765 3.619 20 10 DHCDHM [O-]c1ccc(F)cc1CN[C@H](CCc1ccccc1)C(F)F ZINC001182908806 1036483026 /nfs/dbraw/zinc/48/30/26/1036483026.db2.gz AWKFCOQIFLZUIV-OAHLLOKOSA-N -1 3 309.331 3.887 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1cn2cc(Cl)ccc2n1 ZINC000775950086 1037237845 /nfs/dbraw/zinc/23/78/45/1037237845.db2.gz VWXNGQXUNAKYLZ-UHFFFAOYSA-N -1 3 322.195 3.637 20 10 DHCDHM COc1c([O-])c(CNc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000774930491 1037239068 /nfs/dbraw/zinc/23/90/68/1037239068.db2.gz SRZHHMLEMBXFIC-UHFFFAOYSA-N -1 3 308.721 3.575 20 10 DHCDHM O=C1CCCc2cc(NCc3c([O-])cccc3Cl)ccc2N1 ZINC000130450082 1037558811 /nfs/dbraw/zinc/55/88/11/1037558811.db2.gz OJAFPIZVXOEMKN-UHFFFAOYSA-N -1 3 316.788 3.933 20 10 DHCDHM CCCNC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000775184049 1037951251 /nfs/dbraw/zinc/95/12/51/1037951251.db2.gz UCMKWKHTEYRSFY-UHFFFAOYSA-N -1 3 318.804 3.798 20 10 DHCDHM Cc1cnc(NCc2cc(Cl)c3cccnc3c2[O-])nc1C ZINC001168521786 1037997046 /nfs/dbraw/zinc/99/70/46/1037997046.db2.gz KNDNOVUHCQDERG-UHFFFAOYSA-N -1 3 314.776 3.613 20 10 DHCDHM [O-]c1c(CNc2cnc(Cl)cn2)cc(Cl)c2cccnc12 ZINC001168522244 1038029553 /nfs/dbraw/zinc/02/95/53/1038029553.db2.gz CPVZVVARXFXNJR-UHFFFAOYSA-N -1 3 321.167 3.649 20 10 DHCDHM COc1ccc(N(C)Cc2c([O-])cccc2Cl)cc1OC ZINC000761220718 1040762659 /nfs/dbraw/zinc/76/26/59/1040762659.db2.gz JSKHSCPDJJODLH-UHFFFAOYSA-N -1 3 307.777 3.699 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@H](C)c2ccc(C)cc2[O-])cs1 ZINC000273367549 130112998 /nfs/dbraw/zinc/11/29/98/130112998.db2.gz BSSXCFKFAYEWMY-NEPJUHHUSA-N -1 3 306.431 3.715 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)N[C@@H]2CCCc3occc32)c1 ZINC000273437056 130122186 /nfs/dbraw/zinc/12/21/86/130122186.db2.gz XDTOITOLTNSCCF-XHDPSFHLSA-N -1 3 315.369 3.500 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cn[nH]c1 ZINC000273484366 130126107 /nfs/dbraw/zinc/12/61/07/130126107.db2.gz MYOHAJDUFMCQNI-SFYZADRCSA-N -1 3 300.189 3.834 20 10 DHCDHM C[C@H](N[C@H](CO)c1ccc(F)cc1)c1cc(Cl)ccc1[O-] ZINC000273491771 130127882 /nfs/dbraw/zinc/12/78/82/130127882.db2.gz OJGUBLZLUGGBBD-ZUZCIYMTSA-N -1 3 309.768 3.569 20 10 DHCDHM CC[C@@H](N[C@H](CCOC)c1ccco1)c1ccc(F)cc1[O-] ZINC000286302518 131228665 /nfs/dbraw/zinc/22/86/65/131228665.db2.gz XBKJXJPLSDPZFP-HUUCEWRRSA-N -1 3 307.365 3.943 20 10 DHCDHM CC[C@H](N[C@@H](CO)c1ccccc1)c1cccc(Cl)c1[O-] ZINC000287292269 131273362 /nfs/dbraw/zinc/27/33/62/131273362.db2.gz BZBAULLJKAZUFW-HOTGVXAUSA-N -1 3 305.805 3.820 20 10 DHCDHM CC[C@@H](NCc1ccnn1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287319695 131275128 /nfs/dbraw/zinc/27/51/28/131275128.db2.gz DIRYFBIOAHXMEY-CYBMUJFWSA-N -1 3 314.216 3.673 20 10 DHCDHM [O-]c1ccccc1CN1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000289141965 131361765 /nfs/dbraw/zinc/36/17/65/131361765.db2.gz AJTUYIUBOOCYGV-OAHLLOKOSA-N -1 3 313.401 3.770 20 10 DHCDHM CC(C)COC[C@H](N[C@@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000297831610 132035853 /nfs/dbraw/zinc/03/58/53/132035853.db2.gz RXZDQMDTRKJKPR-CVEARBPZSA-N -1 3 315.413 3.976 20 10 DHCDHM CC[C@H](N[C@H](C)c1nnc2n1CCCCC2)c1ccccc1[O-] ZINC000375875145 332964900 /nfs/dbraw/zinc/96/49/00/332964900.db2.gz NPDHORUTMSUCSE-HIFRSBDPSA-N -1 3 314.433 3.512 20 10 DHCDHM CC[C@@H](N[C@H](C)c1nnc2n1CCCCC2)c1ccccc1[O-] ZINC000375875147 332964979 /nfs/dbraw/zinc/96/49/79/332964979.db2.gz NPDHORUTMSUCSE-UKRRQHHQSA-N -1 3 314.433 3.512 20 10 DHCDHM CCCNC(=O)c1cccc(N[C@@H](C)c2cc(F)ccc2[O-])c1 ZINC000176982555 332966719 /nfs/dbraw/zinc/96/67/19/332966719.db2.gz VIJGIRMTBLQOOS-LBPRGKRZSA-N -1 3 316.376 3.844 20 10 DHCDHM C[C@@H](NCc1ccc(OCC2CC2)nc1)c1ccc(F)cc1[O-] ZINC000185261872 333206446 /nfs/dbraw/zinc/20/64/46/333206446.db2.gz CEFBEKYUXNVNPP-GFCCVEGCSA-N -1 3 316.376 3.566 20 10 DHCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC000295160935 335130765 /nfs/dbraw/zinc/13/07/65/335130765.db2.gz DLCHIYOXRJIESB-UHFFFAOYSA-N -1 3 317.410 3.633 20 10 DHCDHM CC[C@H](Nc1ccc(CNC(C)=O)cc1)c1ccc(F)cc1[O-] ZINC000286242656 334152248 /nfs/dbraw/zinc/15/22/48/334152248.db2.gz UETUPVBMVSOGMC-KRWDZBQOSA-N -1 3 316.376 3.731 20 10 DHCDHM Cc1nn(C)cc1[C@H]1CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000377198159 337048643 /nfs/dbraw/zinc/04/86/43/337048643.db2.gz OASCANNFKIORAR-CQSZACIVSA-N -1 3 323.799 3.564 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(Nc2cccnc2)CC1 ZINC000377620786 337056559 /nfs/dbraw/zinc/05/65/59/337056559.db2.gz GUODGPFWJTVWNA-UHFFFAOYSA-N -1 3 317.820 3.517 20 10 DHCDHM C[C@@H](NCc1ncc(-c2ccccc2)cn1)c1ccc(F)cc1[O-] ZINC000186063310 337253343 /nfs/dbraw/zinc/25/33/43/337253343.db2.gz WCSWGSCFOFBJMZ-CYBMUJFWSA-N -1 3 323.371 3.839 20 10 DHCDHM Cc1coc(-c2ccc(C)c(NC(=O)c3cccc(O)c3[O-])c2)n1 ZINC000193133718 337309778 /nfs/dbraw/zinc/30/97/78/337309778.db2.gz FSUHILAJIPYVDO-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCC(OC2CCCC2)CC1 ZINC000092758755 337908009 /nfs/dbraw/zinc/90/80/09/337908009.db2.gz FYKQOCDFWMYWAW-UHFFFAOYSA-N -1 3 309.837 3.969 20 10 DHCDHM CCN(Cc1cccc(F)c1[O-])[C@H]1CCCc2cccnc21 ZINC000365002903 521349196 /nfs/dbraw/zinc/34/91/96/521349196.db2.gz PTHAVALKGGOZSY-INIZCTEOSA-N -1 3 300.377 3.826 20 10 DHCDHM CC[C@@H](N[C@@H]1CCCn2nc(C(C)C)nc21)c1ccccc1[O-] ZINC000156317542 522924361 /nfs/dbraw/zinc/92/43/61/522924361.db2.gz KNMVURVDZIIFLV-HUUCEWRRSA-N -1 3 314.433 3.683 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@@H](CC)c2ccccc2[O-])o1 ZINC000156014103 524032153 /nfs/dbraw/zinc/03/21/53/524032153.db2.gz ABXHBMIVYCPLFL-JKSUJKDBSA-N -1 3 303.402 3.976 20 10 DHCDHM COc1ccc(CN[C@H](C)c2ccc(F)c(F)c2[O-])cc1F ZINC000191192328 524088805 /nfs/dbraw/zinc/08/88/05/524088805.db2.gz MHSZJGATXQMOKM-SECBINFHSA-N -1 3 311.303 3.669 20 10 DHCDHM CC[C@H](N[C@H](CO)c1ccc(F)cc1)c1cccc(Cl)c1[O-] ZINC000287572620 535944312 /nfs/dbraw/zinc/94/43/12/535944312.db2.gz GXJUNEYQMIOAAZ-JKSUJKDBSA-N -1 3 323.795 3.959 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@@H]1CCc2cccnc21 ZINC000894781134 1013488534 /nfs/dbraw/zinc/48/85/34/1013488534.db2.gz OEHWWBSHEKXOHV-CYBMUJFWSA-N -1 3 309.196 3.871 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)Nc1nc(C2CCC2)cs1 ZINC000931277738 1032087924 /nfs/dbraw/zinc/08/79/24/1032087924.db2.gz SAEXIKWBEIWXGZ-UHFFFAOYSA-N -1 3 321.377 3.577 20 10 DHCDHM C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592478096 978248885 /nfs/dbraw/zinc/24/88/85/978248885.db2.gz QPVWKHMWCFYUJY-ZJUUUORDSA-N -1 3 319.323 3.862 20 10 DHCDHM C[C@@H]([NH2+][C@@H](C)CCCC(F)(F)F)c1cc(C(=O)[O-])ccc1[O-] ZINC001592478095 978249025 /nfs/dbraw/zinc/24/90/25/978249025.db2.gz QPVWKHMWCFYUJY-VHSXEESVSA-N -1 3 319.323 3.862 20 10 DHCDHM CCc1ccc(C[NH2+][C@H](C)c2cc(C(=O)[O-])ccc2[O-])s1 ZINC001597530011 988178629 /nfs/dbraw/zinc/17/86/29/988178629.db2.gz AJKAFTIVTKMOAZ-SNVBAGLBSA-N -1 3 305.399 3.565 20 10 DHCDHM CCc1ccc(C[NH2+][C@@H](C)c2cc(C(=O)[O-])ccc2[O-])s1 ZINC001597530010 988179007 /nfs/dbraw/zinc/17/90/07/988179007.db2.gz AJKAFTIVTKMOAZ-JTQLQIEISA-N -1 3 305.399 3.565 20 10 DHCDHM CC[C@H](C)c1nc([C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000276816334 1015679023 /nfs/dbraw/zinc/67/90/23/1015679023.db2.gz AGZILKAEYIZTBO-LPEHRKFASA-N -1 3 324.375 3.714 20 10 DHCDHM COc1cccc(CNCc2c([O-])cccc2F)c1OC(C)C ZINC000896641459 1015695362 /nfs/dbraw/zinc/69/53/62/1015695362.db2.gz ROJOGCXMXFCGCW-UHFFFAOYSA-N -1 3 319.376 3.617 20 10 DHCDHM C[C@@H]([NH2+][C@H](C)C1CCC(F)CC1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593195271 994146854 /nfs/dbraw/zinc/14/68/54/994146854.db2.gz CPCDWHVBPKAMEB-IBQNZTRDSA-N -1 3 309.381 3.658 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593219439 994299732 /nfs/dbraw/zinc/29/97/32/994299732.db2.gz OEYVWSNVJKZYFX-PXAZEXFGSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@H](NCc1ccccc1Cl)c1cc(C(=O)[O-])ccc1O ZINC001593304579 994749235 /nfs/dbraw/zinc/74/92/35/994749235.db2.gz OIZHLGONSOJNDJ-JTQLQIEISA-N -1 3 305.761 3.595 20 10 DHCDHM C[C@H](NCc1cscc1Cl)c1cc(C(=O)[O-])ccc1O ZINC001593312338 994799745 /nfs/dbraw/zinc/79/97/45/994799745.db2.gz UDTVYPYUFYRDSD-QMMMGPOBSA-N -1 3 311.790 3.656 20 10 DHCDHM CCc1ccnc(NCc2cc(Cl)c3cccnc3c2[O-])n1 ZINC001168527395 1016725643 /nfs/dbraw/zinc/72/56/43/1016725643.db2.gz GCMSMVWBEKEPLI-UHFFFAOYSA-N -1 3 314.776 3.558 20 10 DHCDHM O=C1CCc2cc(NCc3c([O-])cccc3Cl)c(F)cc2N1 ZINC000121829681 1017010667 /nfs/dbraw/zinc/01/06/67/1017010667.db2.gz JZIXEFBTNJJWFX-UHFFFAOYSA-N -1 3 320.751 3.682 20 10 DHCDHM Cc1cc(NC(=O)c2cccc(O)c2[O-])cc(C(F)(F)F)c1 ZINC001146375815 1032216336 /nfs/dbraw/zinc/21/63/36/1032216336.db2.gz OOPMJUMYMQKVNO-UHFFFAOYSA-N -1 3 311.259 3.677 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-])c1ccn(C)n1 ZINC000840815272 1017077022 /nfs/dbraw/zinc/07/70/22/1017077022.db2.gz DHUMPUXLMKEEQY-DTWKUNHWSA-N -1 3 314.216 3.844 20 10 DHCDHM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cccc(O)c1[O-] ZINC001148224552 1032375772 /nfs/dbraw/zinc/37/57/72/1032375772.db2.gz PHDRSRMMBDBRNV-KRWDZBQOSA-N -1 3 311.381 3.759 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2ccc(C)o2)c1[O-] ZINC000050133843 1017117258 /nfs/dbraw/zinc/11/72/58/1017117258.db2.gz RXGGTENOYFVTGX-UHFFFAOYSA-N -1 3 307.777 3.782 20 10 DHCDHM CCN(Cc1c([O-])cccc1Br)CC(F)(F)F ZINC000707165349 1018789696 /nfs/dbraw/zinc/78/96/96/1018789696.db2.gz AFCREWWOMKQMPC-UHFFFAOYSA-N -1 3 312.129 3.539 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1CC1CCCCC1 ZINC000187046302 1018936887 /nfs/dbraw/zinc/93/68/87/1018936887.db2.gz BMXGEBUMEIQZDJ-AWEZNQCLSA-N -1 3 303.402 3.673 20 10 DHCDHM CCC1CCN(Cc2cc(Br)cc(F)c2[O-])CC1 ZINC000715713150 1018949904 /nfs/dbraw/zinc/94/99/04/1018949904.db2.gz OSKQRPJHIDGKNB-UHFFFAOYSA-N -1 3 316.214 3.916 20 10 DHCDHM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c(C)c1 ZINC000187059052 1018979492 /nfs/dbraw/zinc/97/94/92/1018979492.db2.gz HZLNSNKGVVRASH-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c1 ZINC000187060689 1018982831 /nfs/dbraw/zinc/98/28/31/1018982831.db2.gz NWIABUUZXWGPQJ-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM CC1CCN(c2ccc(CNC(=O)c3ccccc3[O-])cc2)CC1 ZINC000731053869 1020061130 /nfs/dbraw/zinc/06/11/30/1020061130.db2.gz ZLHPWBQXXJZAPQ-UHFFFAOYSA-N -1 3 324.424 3.559 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@@H]1c2ccccc2OC[C@H]1F ZINC000922525274 1020114638 /nfs/dbraw/zinc/11/46/38/1020114638.db2.gz KWNNJLLNSDVEDS-CZUORRHYSA-N -1 3 307.752 3.607 20 10 DHCDHM C[C@H](Nc1cnn(CCF)c1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491858 1032917872 /nfs/dbraw/zinc/91/78/72/1032917872.db2.gz PNOMSXVQYRNVPZ-VIFPVBQESA-N -1 3 317.286 3.750 20 10 DHCDHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(O)cc1C ZINC000743259542 1021251074 /nfs/dbraw/zinc/25/10/74/1021251074.db2.gz CLOWHYBWVBLMEI-UHFFFAOYSA-N -1 3 319.426 3.626 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H](C)O1 ZINC000694870458 1021387444 /nfs/dbraw/zinc/38/74/44/1021387444.db2.gz JYNNWUWAIHYFQD-ZJUUUORDSA-N -1 3 304.217 3.698 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2C[C@@H](C)S[C@@H](C)C2)c1[O-] ZINC000070384284 1021658185 /nfs/dbraw/zinc/65/81/85/1021658185.db2.gz ZXSGLFATMWWIFB-AOOOYVTPSA-N -1 3 313.850 3.574 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)ccc1O ZINC000182475539 1021681686 /nfs/dbraw/zinc/68/16/86/1021681686.db2.gz AIYRJBOETWXRIN-UHFFFAOYSA-N -1 3 305.399 3.625 20 10 DHCDHM Cc1ccc([O-])c(C(=O)Nc2cccc(N3CCCCC3)c2)c1 ZINC000919823540 1021924803 /nfs/dbraw/zinc/92/48/03/1021924803.db2.gz KDFXYARTYAIDAY-UHFFFAOYSA-N -1 3 310.397 3.943 20 10 DHCDHM CC(C)Oc1ncccc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756425379 1022351948 /nfs/dbraw/zinc/35/19/48/1022351948.db2.gz ZTLOZOUFCDCOBW-NSHDSACASA-N -1 3 322.355 3.703 20 10 DHCDHM Nc1ccc(F)c(NCc2cc(Cl)c3cccnc3c2[O-])c1 ZINC001168525967 1023070154 /nfs/dbraw/zinc/07/01/54/1023070154.db2.gz NHIWLHBOAIEKNT-UHFFFAOYSA-N -1 3 317.751 3.927 20 10 DHCDHM [O-]c1c(CN2CCC[C@@H]2c2ccc(O)cc2)ccc(F)c1F ZINC000876636257 1033111235 /nfs/dbraw/zinc/11/12/35/1033111235.db2.gz DAPXICNNCFMGBK-OAHLLOKOSA-N -1 3 305.324 3.713 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@@H]1c1ccccc1 ZINC000769502836 1023167801 /nfs/dbraw/zinc/16/78/01/1023167801.db2.gz AUFCURFBCKFBMT-MRXNPFEDSA-N -1 3 303.789 3.619 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(N(C)C(C)C)c2)c([O-])c1O ZINC000770488615 1023320735 /nfs/dbraw/zinc/32/07/35/1023320735.db2.gz LHECTUVCADNVHV-UHFFFAOYSA-N -1 3 314.385 3.503 20 10 DHCDHM O=C(Nc1ccc(-c2ccco2)cc1F)c1cccc(O)c1[O-] ZINC000787724205 1023817035 /nfs/dbraw/zinc/81/70/35/1023817035.db2.gz XSWZLKRHXKYGBZ-UHFFFAOYSA-N -1 3 313.284 3.749 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@@H]1CCCOc2ccc(F)cc21 ZINC000882915616 1024171587 /nfs/dbraw/zinc/17/15/87/1024171587.db2.gz VLRWDLCGHMBTFA-OAHLLOKOSA-N -1 3 323.314 3.813 20 10 DHCDHM CC(C)n1cc2c(n1)[C@@H](NCc1cc(F)cc(F)c1[O-])CCC2 ZINC000883085477 1024237792 /nfs/dbraw/zinc/23/77/92/1024237792.db2.gz SCFRLFSPVCQLCD-HNNXBMFYSA-N -1 3 321.371 3.615 20 10 DHCDHM CCN(Cc1ccc2ccccc2c1)C(=O)c1cccc(O)c1[O-] ZINC000790523743 1024318629 /nfs/dbraw/zinc/31/86/29/1024318629.db2.gz WHKZEMKEEKSNJJ-UHFFFAOYSA-N -1 3 321.376 3.913 20 10 DHCDHM Cc1ccc([C@@H]2CCCN2C(=O)c2cccc(O)c2[O-])cc1C ZINC000790581072 1024328829 /nfs/dbraw/zinc/32/88/29/1024328829.db2.gz YMWYEPCLGMFVEZ-INIZCTEOSA-N -1 3 311.381 3.692 20 10 DHCDHM Cc1ccc([C@H]2CCCN2C(=O)c2cccc(O)c2[O-])cc1C ZINC000790581074 1024330109 /nfs/dbraw/zinc/33/01/09/1024330109.db2.gz YMWYEPCLGMFVEZ-MRXNPFEDSA-N -1 3 311.381 3.692 20 10 DHCDHM CC[C@H](C)Oc1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790573203 1024330172 /nfs/dbraw/zinc/33/01/72/1024330172.db2.gz MTJBFGDAPBFOMY-NSHDSACASA-N -1 3 301.342 3.527 20 10 DHCDHM Cn1ccc2ccc(NCc3c([O-])cccc3Cl)cc2c1=O ZINC000790652611 1024353391 /nfs/dbraw/zinc/35/33/91/1024353391.db2.gz MIKDDEDYJKFKSX-UHFFFAOYSA-N -1 3 314.772 3.510 20 10 DHCDHM C[C@H](NC1(c2ncccn2)CCC1)c1ccc(Cl)cc1[O-] ZINC000883311854 1024363983 /nfs/dbraw/zinc/36/39/83/1024363983.db2.gz MODNVIALGCRQDK-NSHDSACASA-N -1 3 303.793 3.566 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1ccc(F)cc1F ZINC000790962206 1024407075 /nfs/dbraw/zinc/40/70/75/1024407075.db2.gz IJJAGGVBCQEDAY-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM Cc1c(CNCc2c([O-])ccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000790998297 1024415181 /nfs/dbraw/zinc/41/51/81/1024415181.db2.gz IQNOORYJVDDVRL-UHFFFAOYSA-N -1 3 324.739 3.691 20 10 DHCDHM COc1cccc(CN(C)Cc2c([O-])ccc(Cl)c2F)c1 ZINC000792156422 1024637481 /nfs/dbraw/zinc/63/74/81/1024637481.db2.gz DNQSEKSOPCJWGB-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM CCn1ccc(CN(C)Cc2cc(Cl)cc(C(C)=O)c2[O-])c1 ZINC000792313696 1024661574 /nfs/dbraw/zinc/66/15/74/1024661574.db2.gz NDDNTNGHYXGUSY-UHFFFAOYSA-N -1 3 320.820 3.702 20 10 DHCDHM [O-]c1cc(Br)ccc1CNC1(C(F)F)CCCC1 ZINC000825943291 1033260984 /nfs/dbraw/zinc/26/09/84/1033260984.db2.gz BQGYEENNRHIHKL-UHFFFAOYSA-N -1 3 320.177 3.822 20 10 DHCDHM COc1ccc2c(c1)OCC[C@@H]2N[C@H](C)c1c([O-])cccc1F ZINC000886533141 1025680153 /nfs/dbraw/zinc/68/01/53/1025680153.db2.gz VTKXNEXZWSAXFD-ABAIWWIYSA-N -1 3 317.360 3.714 20 10 DHCDHM COCCOc1ccccc1N[C@@H](C)c1c([O-])cccc1F ZINC000886584451 1025718513 /nfs/dbraw/zinc/71/85/13/1025718513.db2.gz PBKKACGVWGIURI-LBPRGKRZSA-N -1 3 305.349 3.730 20 10 DHCDHM C[C@H](NCc1cnccc1C(F)(F)F)c1c([O-])cccc1F ZINC000886639931 1025754964 /nfs/dbraw/zinc/75/49/64/1025754964.db2.gz NWJJACFDRZDIAA-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM CO[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CC[C@@H]1C ZINC000221275300 1025770244 /nfs/dbraw/zinc/77/02/44/1025770244.db2.gz WYMJDNAIUNXDDY-TVQRCGJNSA-N -1 3 304.217 3.556 20 10 DHCDHM C[C@H](N[C@H](CCO)C(F)(F)F)c1ccc2ccccc2c1[O-] ZINC000886800952 1025917854 /nfs/dbraw/zinc/91/78/54/1025917854.db2.gz FKXXCNINCXVHQA-IINYFYTJSA-N -1 3 313.319 3.509 20 10 DHCDHM [O-]c1c(Br)cccc1CNC1(C(F)F)CCCC1 ZINC000808451871 1026292772 /nfs/dbraw/zinc/29/27/72/1026292772.db2.gz ZDHBVGPQPHUQHJ-UHFFFAOYSA-N -1 3 320.177 3.822 20 10 DHCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)[C@@H]1[C@@H]1CCCO1 ZINC000811510317 1027027082 /nfs/dbraw/zinc/02/70/82/1027027082.db2.gz CARXCQXGIJRCOX-DZGCQCFKSA-N -1 3 313.800 3.574 20 10 DHCDHM O=C1N[C@@H](c2cc(Cl)ccc2[O-])Nc2cc(Cl)ccc21 ZINC000048447859 1028084805 /nfs/dbraw/zinc/08/48/05/1028084805.db2.gz ZAFPQFGMEOZYNE-ZDUSSCGKSA-N -1 3 309.152 3.553 20 10 DHCDHM C[C@H](NCc1nccs1)c1cccc(C(F)(F)F)c1[O-] ZINC000815563066 1028544573 /nfs/dbraw/zinc/54/45/73/1028544573.db2.gz SRXMPBIRUQKQDB-QMMMGPOBSA-N -1 3 302.321 3.718 20 10 DHCDHM CC[C@H](Nc1ccc(F)c(NC(N)=O)c1)c1ccc(F)cc1[O-] ZINC000815632268 1028579853 /nfs/dbraw/zinc/57/98/53/1028579853.db2.gz IPARIIZMAAIIRO-ZDUSSCGKSA-N -1 3 321.327 3.724 20 10 DHCDHM Cc1csc([C@H](C)NCc2cc(Cl)c(F)cc2[O-])n1 ZINC000816546146 1028929863 /nfs/dbraw/zinc/92/98/63/1028929863.db2.gz YLORQFFWBDKTRE-QMMMGPOBSA-N -1 3 300.786 3.800 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@@H]1NCc1cc(Cl)c(F)cc1[O-] ZINC000816613223 1028965716 /nfs/dbraw/zinc/96/57/16/1028965716.db2.gz MTHKBPYTXOUSDN-XXFAHNHDSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@H](N[C@H]1C[C@@]1(F)c1ccccc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000818355444 1029381930 /nfs/dbraw/zinc/38/19/30/1029381930.db2.gz FXRNOIJHXBNQPS-MZPVMMEZSA-N -1 3 316.332 3.588 20 10 DHCDHM CCC[C@@]1(CO)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000290124263 1029903204 /nfs/dbraw/zinc/90/32/04/1029903204.db2.gz JDOZPVSQUVPZTO-OAHLLOKOSA-N -1 3 318.244 3.684 20 10 DHCDHM CCC[C@]1(CO)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000290124261 1029904842 /nfs/dbraw/zinc/90/48/42/1029904842.db2.gz JDOZPVSQUVPZTO-HNNXBMFYSA-N -1 3 318.244 3.684 20 10 DHCDHM Cc1cc(Br)c([O-])c(CN2CC(CC(F)F)C2)c1 ZINC000822521136 1030041288 /nfs/dbraw/zinc/04/12/88/1030041288.db2.gz XCHIDHNWCLCPSD-UHFFFAOYSA-N -1 3 320.177 3.550 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Br)c(F)cc2[O-])[C@@H](C)C1 ZINC001144306479 1031453328 /nfs/dbraw/zinc/45/33/28/1031453328.db2.gz DARJJORCHWHBQL-ZJUUUORDSA-N -1 3 316.214 3.914 20 10 DHCDHM Cc1nnsc1CN[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000293751305 1031601340 /nfs/dbraw/zinc/60/13/40/1031601340.db2.gz RLDDVNIVHPEOCG-ZCFIWIBFSA-N -1 3 318.229 3.710 20 10 DHCDHM Cc1nnsc1CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000293846099 1031655094 /nfs/dbraw/zinc/65/50/94/1031655094.db2.gz XCBXDPUFMVBCDL-ZCFIWIBFSA-N -1 3 318.229 3.710 20 10 DHCDHM CC(C)(NCc1ccc(F)c(F)c1[O-])c1ccccc1[N+](=O)[O-] ZINC000877545361 1033350469 /nfs/dbraw/zinc/35/04/69/1033350469.db2.gz GRYNBKOSCCHURG-UHFFFAOYSA-N -1 3 322.311 3.604 20 10 DHCDHM Cc1cc([O-])c(CN2CC(C)(C)[C@H]2c2nccn2C)cc1Cl ZINC000826043742 1033733264 /nfs/dbraw/zinc/73/32/64/1033733264.db2.gz QAZAYDSSAMRFHG-OAHLLOKOSA-N -1 3 319.836 3.671 20 10 DHCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@H](C)C1(F)F ZINC000862443427 1033854688 /nfs/dbraw/zinc/85/46/88/1033854688.db2.gz PASRUNLABPXWIK-DTORHVGOSA-N -1 3 307.743 3.908 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(C)[C@H](C)c2cccc(O)c2)c1[O-] ZINC000177280787 1034150033 /nfs/dbraw/zinc/15/00/33/1034150033.db2.gz NAEDIYGXLWOECV-LLVKDONJSA-N -1 3 317.360 3.633 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@](C)(C(F)(F)F)C2)c1[O-] ZINC000880000765 1034177786 /nfs/dbraw/zinc/17/77/86/1034177786.db2.gz KJZNCKRLQZOSKL-AWEZNQCLSA-N -1 3 319.298 3.508 20 10 DHCDHM COCCOc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1F ZINC000186288581 1034615030 /nfs/dbraw/zinc/61/50/30/1034615030.db2.gz HNIUZUZKORTLCN-NSHDSACASA-N -1 3 323.339 3.869 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)N(C)CCO2)c1ccc(F)cc1[O-] ZINC000186458347 1034633576 /nfs/dbraw/zinc/63/35/76/1034633576.db2.gz NAPPTIPZTZSDMB-NSHDSACASA-N -1 3 302.349 3.533 20 10 DHCDHM Cc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1C(=O)N(C)C ZINC000186477911 1034634825 /nfs/dbraw/zinc/63/48/25/1034634825.db2.gz SNNKRVNXPSYLCO-GFCCVEGCSA-N -1 3 316.376 3.715 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])Cc1cc(F)c(F)cc1[O-] ZINC001180194366 1035627993 /nfs/dbraw/zinc/62/79/93/1035627993.db2.gz DDUSNKZEXYUHDB-UHFFFAOYSA-N -1 3 307.340 3.788 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])Cc1cc(F)c(F)cc1[O-] ZINC001180194366 1035627997 /nfs/dbraw/zinc/62/79/97/1035627997.db2.gz DDUSNKZEXYUHDB-UHFFFAOYSA-N -1 3 307.340 3.788 20 10 DHCDHM C[C@H]1[C@H](C(F)(F)F)CCCN1Cc1cc(F)cc(F)c1[O-] ZINC001180970701 1035800486 /nfs/dbraw/zinc/80/04/86/1035800486.db2.gz WBKRXVGVKNVVRO-GZMMTYOYSA-N -1 3 309.278 3.833 20 10 DHCDHM Cc1ccccc1CC1CN(Cc2cc(F)cc(F)c2[O-])C1 ZINC001182989737 1036497129 /nfs/dbraw/zinc/49/71/29/1036497129.db2.gz KAGHNRQXRKSYGS-UHFFFAOYSA-N -1 3 303.352 3.653 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC(c2nc3ccccc3[nH]2)C1 ZINC000775716209 1036533346 /nfs/dbraw/zinc/53/33/46/1036533346.db2.gz RWPBAYJGONMSCT-UHFFFAOYSA-N -1 3 313.788 3.521 20 10 DHCDHM CC(C)(C)Oc1cccc(CNCc2cccc(Cl)c2[O-])n1 ZINC000776253692 1038073321 /nfs/dbraw/zinc/07/33/21/1038073321.db2.gz OEPUCSAAQKQAOL-UHFFFAOYSA-N -1 3 320.820 3.908 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@@H](C)c2ccc(C)cc2[O-])cs1 ZINC000273367555 130113216 /nfs/dbraw/zinc/11/32/16/130113216.db2.gz BSSXCFKFAYEWMY-RYUDHWBXSA-N -1 3 306.431 3.715 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCC(O)(c2ccccc2)CC1 ZINC000274333874 130226990 /nfs/dbraw/zinc/22/69/90/130226990.db2.gz DQILXXNSGNNQMI-UHFFFAOYSA-N -1 3 317.816 3.529 20 10 DHCDHM CC[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1[O-] ZINC000286100618 131219721 /nfs/dbraw/zinc/21/97/21/131219721.db2.gz NGJZTQXPNPOTBZ-CQSZACIVSA-N -1 3 304.321 3.680 20 10 DHCDHM CC[C@H](N[C@H](CCOC)c1ccco1)c1ccc(F)cc1[O-] ZINC000286302524 131228928 /nfs/dbraw/zinc/22/89/28/131228928.db2.gz XBKJXJPLSDPZFP-LSDHHAIUSA-N -1 3 307.365 3.943 20 10 DHCDHM CC[C@H](NCc1ccnn1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287319704 131275242 /nfs/dbraw/zinc/27/52/42/131275242.db2.gz DIRYFBIOAHXMEY-ZDUSSCGKSA-N -1 3 314.216 3.673 20 10 DHCDHM CC[C@H](N[C@H](CCO)c1ccco1)c1cccc(Cl)c1[O-] ZINC000287842979 131302710 /nfs/dbraw/zinc/30/27/10/131302710.db2.gz WJFHMCXXERXMPR-UONOGXRCSA-N -1 3 309.793 3.803 20 10 DHCDHM [O-]c1ccc(Br)cc1CN[C@H](C1CC1)C(F)(F)F ZINC000288474956 131327298 /nfs/dbraw/zinc/32/72/98/131327298.db2.gz PGXLWYCNPPNKGI-LLVKDONJSA-N -1 3 324.140 3.585 20 10 DHCDHM Cc1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2[O-])on1 ZINC000185357599 333207463 /nfs/dbraw/zinc/20/74/63/333207463.db2.gz KNOXCKLBBVTYNV-MRVPVSSYSA-N -1 3 301.173 3.846 20 10 DHCDHM CCCOc1ccc(CN[C@H](C)c2ccc(F)cc2[O-])cn1 ZINC000185397842 333208114 /nfs/dbraw/zinc/20/81/14/333208114.db2.gz RIECYQSAHCNULB-GFCCVEGCSA-N -1 3 304.365 3.566 20 10 DHCDHM Cc1cc(Cl)cc(CN[C@@H](C)c2c(F)cncc2F)c1[O-] ZINC000289524039 334166055 /nfs/dbraw/zinc/16/60/55/334166055.db2.gz HFZVMMJSJFYPHT-VIFPVBQESA-N -1 3 312.747 3.878 20 10 DHCDHM CC[C@@H](N[C@H]1COc2cccc(F)c21)c1ccc(F)cc1[O-] ZINC000367620532 336826790 /nfs/dbraw/zinc/82/67/90/336826790.db2.gz YFCUKPDANWSEQX-KGLIPLIRSA-N -1 3 305.324 3.845 20 10 DHCDHM Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])CO2 ZINC000372621751 336936437 /nfs/dbraw/zinc/93/64/37/336936437.db2.gz SDXLPLCJTHECJD-IINYFYTJSA-N -1 3 305.324 3.763 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC(Nc2ccccc2F)CC1 ZINC000378491202 337074250 /nfs/dbraw/zinc/07/42/50/337074250.db2.gz FXEPSPZDBCCSQU-UHFFFAOYSA-N -1 3 318.367 3.747 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@H]2CCCn3nc(C(C)C)nc32)c([O-])c1 ZINC000185684550 337250112 /nfs/dbraw/zinc/25/01/12/337250112.db2.gz JMLZGGXNUALAHV-HIFRSBDPSA-N -1 3 314.433 3.601 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@@H]2CCCn3nc(C(C)C)nc32)c([O-])c1 ZINC000185684512 337250179 /nfs/dbraw/zinc/25/01/79/337250179.db2.gz JMLZGGXNUALAHV-UKRRQHHQSA-N -1 3 314.433 3.601 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)CN(C)C(=O)N2)c1cc(F)ccc1[O-] ZINC000186535288 337257383 /nfs/dbraw/zinc/25/73/83/337257383.db2.gz MPCISQSUNQVWFN-JTQLQIEISA-N -1 3 315.348 3.682 20 10 DHCDHM COC[C@H](NCc1cc(Cl)cc(C)c1[O-])c1ccc(C)o1 ZINC000182530138 522748586 /nfs/dbraw/zinc/74/85/86/522748586.db2.gz SZSCGEXPHKSAAV-AWEZNQCLSA-N -1 3 309.793 3.733 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCC[C@H]1c1ccc[nH]1 ZINC000127478297 526340968 /nfs/dbraw/zinc/34/09/68/526340968.db2.gz WYLKWZUBPGNXDQ-AWEZNQCLSA-N -1 3 321.218 3.820 20 10 DHCDHM CC[C@@H](NCc1csc([C@H](C)OC)n1)c1ccc(F)cc1[O-] ZINC000285937434 535806469 /nfs/dbraw/zinc/80/64/69/535806469.db2.gz FNTSCQJOWNEMDD-IINYFYTJSA-N -1 3 324.421 3.936 20 10 DHCDHM C[C@@H]1[C@@H](C)CCCN1Cc1cc(Br)cc(F)c1[O-] ZINC000715712542 1018950704 /nfs/dbraw/zinc/95/07/04/1018950704.db2.gz LTBCSRAJMKTZKE-VHSXEESVSA-N -1 3 316.214 3.914 20 10 DHCDHM C[C@H]1CC[C@H](C)N(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715718469 1018951679 /nfs/dbraw/zinc/95/16/79/1018951679.db2.gz NSUQYEANYDVUJZ-UWVGGRQHSA-N -1 3 316.214 3.914 20 10 DHCDHM C[C@H](C[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])c1cccc(F)c1 ZINC001592704916 979165433 /nfs/dbraw/zinc/16/54/33/979165433.db2.gz AEMJBXQQZUENJD-NEPJUHHUSA-N -1 3 317.360 3.684 20 10 DHCDHM C[C@@H](NCc1cscc1Cl)c1cc(C(=O)[O-])ccc1O ZINC001593312337 994798614 /nfs/dbraw/zinc/79/86/14/994798614.db2.gz UDTVYPYUFYRDSD-MRVPVSSYSA-N -1 3 311.790 3.656 20 10 DHCDHM Nc1ccc(-c2ccc(NC(=O)c3cccc(O)c3[O-])cc2)cc1 ZINC001148219401 1032374855 /nfs/dbraw/zinc/37/48/55/1032374855.db2.gz XVRCZMBRJMULNK-UHFFFAOYSA-N -1 3 320.348 3.599 20 10 DHCDHM CCN(CC)c1ccc(NC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC001148218700 1032375535 /nfs/dbraw/zinc/37/55/35/1032375535.db2.gz HRXWKSNQNBDFKP-UHFFFAOYSA-N -1 3 314.385 3.505 20 10 DHCDHM CC(C)n1ccc(NCc2cc3ccccc3cc2[O-])cc1=O ZINC001171406654 1032599294 /nfs/dbraw/zinc/59/92/94/1032599294.db2.gz CAPBUNPGRFDQTI-UHFFFAOYSA-N -1 3 308.381 3.900 20 10 DHCDHM CC(C)c1ncc(CN(C)Cc2cccc(Cl)c2[O-])cn1 ZINC000799737096 1012627204 /nfs/dbraw/zinc/62/72/04/1012627204.db2.gz VUTBQDGTYVZARB-UHFFFAOYSA-N -1 3 305.809 3.591 20 10 DHCDHM Cc1ccc([C@H]2CCCCCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185707087 1017119806 /nfs/dbraw/zinc/11/98/06/1017119806.db2.gz DYXRIBNKDSXQKW-CQSZACIVSA-N -1 3 315.369 3.757 20 10 DHCDHM Cc1cccc([C@@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1C ZINC000185724638 1017132419 /nfs/dbraw/zinc/13/24/19/1017132419.db2.gz ATCFUDMPXJEMBW-INIZCTEOSA-N -1 3 311.381 3.692 20 10 DHCDHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000186877073 1020519546 /nfs/dbraw/zinc/51/95/46/1020519546.db2.gz QRHJQWASDRDIFR-LLVKDONJSA-N -1 3 311.337 3.677 20 10 DHCDHM CCCN1C(=O)C2(CCCCC2)N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000742441997 1021121316 /nfs/dbraw/zinc/12/13/16/1021121316.db2.gz BNDKDHBTQIUUIC-HNNXBMFYSA-N -1 3 322.836 3.589 20 10 DHCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000743259898 1021246733 /nfs/dbraw/zinc/24/67/33/1021246733.db2.gz PBBBWYRLAGWNMW-UHFFFAOYSA-N -1 3 305.399 3.625 20 10 DHCDHM O=C(Nc1cccc(OC2CCCC2)c1)c1cccc(O)c1[O-] ZINC000776327271 1021286457 /nfs/dbraw/zinc/28/64/57/1021286457.db2.gz FYKPKICOINKSRH-UHFFFAOYSA-N -1 3 313.353 3.672 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CCc2ccc(O)cc21 ZINC000850386991 1021502335 /nfs/dbraw/zinc/50/23/35/1021502335.db2.gz OCOLIHZUXKESOD-CQSZACIVSA-N -1 3 307.752 3.667 20 10 DHCDHM Cc1nc(C)c(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000311865735 1021536494 /nfs/dbraw/zinc/53/64/94/1021536494.db2.gz SQFFUXOMMWQSPQ-UHFFFAOYSA-N -1 3 301.173 3.594 20 10 DHCDHM O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccc(O)c1[O-] ZINC000776617140 1022156411 /nfs/dbraw/zinc/15/64/11/1022156411.db2.gz SOIWCYOBLGHRBA-OAHLLOKOSA-N -1 3 317.772 3.632 20 10 DHCDHM CC(C)(C)c1cnc(Sc2cc[n-]c(=O)c2[N+](=O)[O-])s1 ZINC000853446858 1022276015 /nfs/dbraw/zinc/27/60/15/1022276015.db2.gz PRQSQFIYUDELFG-UHFFFAOYSA-N -1 3 311.388 3.601 20 10 DHCDHM Cc1ccc(C(=O)Nc2cc(F)ccc2NC(C)C)c([O-])c1O ZINC000770500293 1023315922 /nfs/dbraw/zinc/31/59/22/1023315922.db2.gz AUCLSGRJMWQAHN-UHFFFAOYSA-N -1 3 318.348 3.618 20 10 DHCDHM Cc1cccc([C@@H]2CCCN2Cc2ccc(F)c(F)c2[O-])n1 ZINC000876739507 1033131532 /nfs/dbraw/zinc/13/15/32/1033131532.db2.gz JGISHYCQQVKYFO-HNNXBMFYSA-N -1 3 304.340 3.711 20 10 DHCDHM Cc1csc([C@@H](NCc2cc(F)cc(F)c2[O-])C2CC2)n1 ZINC000883018613 1024213038 /nfs/dbraw/zinc/21/30/38/1024213038.db2.gz JNLABMZAOOCPEK-ZDUSSCGKSA-N -1 3 310.369 3.676 20 10 DHCDHM CCCCCn1cc(CNCc2cc(F)cc(F)c2[O-])c(C)n1 ZINC000883079768 1024231809 /nfs/dbraw/zinc/23/18/09/1024231809.db2.gz DDQJNGYUDVMBFM-UHFFFAOYSA-N -1 3 323.387 3.655 20 10 DHCDHM Cc1ccc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])c(Cl)n1 ZINC000883301907 1024358571 /nfs/dbraw/zinc/35/85/71/1024358571.db2.gz LNOXQXMLWCPJKX-VIFPVBQESA-N -1 3 312.747 3.878 20 10 DHCDHM [O-]c1c(CNC2(c3nccs3)CCCC2)ccc(F)c1F ZINC000877041017 1033215168 /nfs/dbraw/zinc/21/51/68/1033215168.db2.gz BDXQBWMELSNOGL-UHFFFAOYSA-N -1 3 310.369 3.686 20 10 DHCDHM C[C@H](O)CN(Cc1ccccc1)Cc1c([O-])ccc(Cl)c1F ZINC000792166638 1024640524 /nfs/dbraw/zinc/64/05/24/1024640524.db2.gz FDFPGOPBFZBDDL-LBPRGKRZSA-N -1 3 323.795 3.568 20 10 DHCDHM CN(C)c1cccc(CN(C)Cc2c([O-])ccc(Cl)c2F)c1 ZINC000792169947 1024641427 /nfs/dbraw/zinc/64/14/27/1024641427.db2.gz NSSFYTLKRPVDAY-UHFFFAOYSA-N -1 3 322.811 3.883 20 10 DHCDHM CC1(C)C[C@@H](c2ccccc2)CN1C(=O)c1cccc(O)c1[O-] ZINC000885234030 1025291237 /nfs/dbraw/zinc/29/12/37/1025291237.db2.gz ISNPDKHFDPEBTI-CQSZACIVSA-N -1 3 311.381 3.506 20 10 DHCDHM C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000804526015 1025337793 /nfs/dbraw/zinc/33/77/93/1025337793.db2.gz IWFOUMFVIVEQGO-CJNGLKHVSA-N -1 3 311.381 3.711 20 10 DHCDHM C[C@H](N[C@@H]1COc2c1cccc2Cl)c1c([O-])cccc1F ZINC000886552328 1025700759 /nfs/dbraw/zinc/70/07/59/1025700759.db2.gz ZBJLGYGWXVPUPS-TVQRCGJNSA-N -1 3 307.752 3.969 20 10 DHCDHM COCCOc1ccc(F)cc1N[C@@H](C)c1c([O-])cccc1F ZINC000886584032 1025719025 /nfs/dbraw/zinc/71/90/25/1025719025.db2.gz HMKJEGMFAPBFKR-NSHDSACASA-N -1 3 323.339 3.869 20 10 DHCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)[C@@H]1[C@H]1CCCO1 ZINC000811510319 1027027409 /nfs/dbraw/zinc/02/74/09/1027027409.db2.gz CARXCQXGIJRCOX-UKRRQHHQSA-N -1 3 313.800 3.574 20 10 DHCDHM CC1(C)CN(Cc2c([O-])cccc2Cl)C[C@H](C(F)(F)F)O1 ZINC000814176624 1027911912 /nfs/dbraw/zinc/91/19/12/1027911912.db2.gz SKRNETUSHUTDHG-GFCCVEGCSA-N -1 3 323.742 3.587 20 10 DHCDHM CC(C)CCc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)cc1 ZINC000216473107 1028455877 /nfs/dbraw/zinc/45/58/77/1028455877.db2.gz ZZTMEJYWVFQYBO-UHFFFAOYSA-N -1 3 319.426 3.782 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCN(c2ccccc2)CC1 ZINC000816480248 1028889394 /nfs/dbraw/zinc/88/93/94/1028889394.db2.gz HXEJJIAJJSVKCK-UHFFFAOYSA-N -1 3 320.795 3.507 20 10 DHCDHM C[C@H](N[C@H]1C[C@]1(F)c1ccccc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000818355442 1029383272 /nfs/dbraw/zinc/38/32/72/1029383272.db2.gz FXRNOIJHXBNQPS-GOPGUHFVSA-N -1 3 316.332 3.588 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@H](O)c2ccccc2C1 ZINC000373822016 1029824758 /nfs/dbraw/zinc/82/47/58/1029824758.db2.gz WLXNYRPXQDWFMH-MRXNPFEDSA-N -1 3 321.779 3.624 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@@H]2c2ncc[nH]2)cc1Cl ZINC000824649909 1030601310 /nfs/dbraw/zinc/60/13/10/1030601310.db2.gz IYOOEYZVRXNYSF-CQSZACIVSA-N -1 3 305.809 3.804 20 10 DHCDHM C[C@@H](NCc1nc2c(s1)CCCC2)c1ccc(F)cc1[O-] ZINC000926917847 1030992751 /nfs/dbraw/zinc/99/27/51/1030992751.db2.gz DNBWENNSJXRQRG-SNVBAGLBSA-N -1 3 306.406 3.717 20 10 DHCDHM [O-]c1c(CN2CCC(Cc3nccs3)CC2)ccc(F)c1F ZINC000877673979 1033407939 /nfs/dbraw/zinc/40/79/39/1033407939.db2.gz KOPUTOXYXVEQII-UHFFFAOYSA-N -1 3 324.396 3.582 20 10 DHCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877824986 1033475915 /nfs/dbraw/zinc/47/59/15/1033475915.db2.gz WAMJWXRBTODBDI-SKDRFNHKSA-N -1 3 323.742 3.587 20 10 DHCDHM C[C@H](c1ccncc1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000183712400 1034414080 /nfs/dbraw/zinc/41/40/80/1034414080.db2.gz VWIGKWBHFZZDGE-SNVBAGLBSA-N -1 3 321.764 3.542 20 10 DHCDHM C[C@H](Nc1ccc(O[C@H]2CCOC2)cc1)c1ccc(F)cc1[O-] ZINC000186320827 1034617521 /nfs/dbraw/zinc/61/75/21/1034617521.db2.gz VSJBPTJLLSSDQG-LRDDRELGSA-N -1 3 317.360 3.872 20 10 DHCDHM Cc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1C(=O)N(C)C ZINC000186477894 1034635730 /nfs/dbraw/zinc/63/57/30/1034635730.db2.gz SNNKRVNXPSYLCO-LBPRGKRZSA-N -1 3 316.376 3.715 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H]1C[C@@]1(F)c1ccccc1 ZINC001178998069 1035460144 /nfs/dbraw/zinc/46/01/44/1035460144.db2.gz BGGOKCCTRZFDBG-GDBMZVCRSA-N -1 3 309.743 3.912 20 10 DHCDHM COC(=O)Nc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000148914793 1035483809 /nfs/dbraw/zinc/48/38/09/1035483809.db2.gz KDBFGUKTBVJVQN-UHFFFAOYSA-N -1 3 306.749 3.836 20 10 DHCDHM [O-]c1cccc(Cl)c1CNCc1ccn(C2CCCC2)n1 ZINC000129023439 1035691200 /nfs/dbraw/zinc/69/12/00/1035691200.db2.gz PZJMOMMMHCKWGQ-UHFFFAOYSA-N -1 3 305.809 3.647 20 10 DHCDHM COC(=O)C(C)(C)c1ccc(NCc2cccc(F)c2[O-])cc1 ZINC001180788034 1035758457 /nfs/dbraw/zinc/75/84/57/1035758457.db2.gz SECMZAIRVRWPCE-UHFFFAOYSA-N -1 3 317.360 3.594 20 10 DHCDHM Cc1cc(NCc2ccc(Cl)cc2[O-])ccc1C(=O)N(C)C ZINC001180865704 1035777803 /nfs/dbraw/zinc/77/78/03/1035777803.db2.gz RJLFKDZRIBJJCE-UHFFFAOYSA-N -1 3 318.804 3.668 20 10 DHCDHM COc1nn(C)cc1N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774382930 1036310364 /nfs/dbraw/zinc/31/03/64/1036310364.db2.gz WWIXFIFMCNDPLM-ZETCQYMHSA-N -1 3 316.188 3.614 20 10 DHCDHM CCCCN1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC001203580467 1036731348 /nfs/dbraw/zinc/73/13/48/1036731348.db2.gz NIZQQJLIUIANJS-UHFFFAOYSA-N -1 3 317.260 3.617 20 10 DHCDHM COc1c([O-])c(CN(C)c2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000775063270 1037526542 /nfs/dbraw/zinc/52/65/42/1037526542.db2.gz PBKURCUUSDNONP-UHFFFAOYSA-N -1 3 316.357 3.562 20 10 DHCDHM Cc1ccn2cc(CN(C)Cc3cc(Cl)ccc3[O-])nc2c1 ZINC001203665841 1037686170 /nfs/dbraw/zinc/68/61/70/1037686170.db2.gz XUJCCABGCBJXQH-UHFFFAOYSA-N -1 3 315.804 3.634 20 10 DHCDHM O=[N+]([O-])c1ccc(NCc2c([O-])cccc2F)c2ncccc12 ZINC001187677648 1037689010 /nfs/dbraw/zinc/68/90/10/1037689010.db2.gz OEPIITGEMJFQDB-UHFFFAOYSA-N -1 3 313.288 3.600 20 10 DHCDHM COc1ccncc1NCc1cc(Cl)c2cccnc2c1[O-] ZINC001168521408 1037975463 /nfs/dbraw/zinc/97/54/63/1037975463.db2.gz BCNDQOJODJBABZ-UHFFFAOYSA-N -1 3 315.760 3.610 20 10 DHCDHM CO[C@@]1(C)CCCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000230300057 1039770055 /nfs/dbraw/zinc/77/00/55/1039770055.db2.gz OVSYDXQJFYLABN-AWEZNQCLSA-N -1 3 304.217 3.700 20 10 DHCDHM CC[C@@H](NCc1ccco1)c1cc(Br)ccc1[O-] ZINC000022169315 182311821 /nfs/dbraw/zinc/31/18/21/182311821.db2.gz XBDUNJDNEQZDGP-CYBMUJFWSA-N -1 3 310.191 3.989 20 10 DHCDHM CC[C@@H](N[C@@H](C)c1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000272864196 130069845 /nfs/dbraw/zinc/06/98/45/130069845.db2.gz NKPJJLPQIUBTFD-DZGCQCFKSA-N -1 3 314.433 3.512 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])ccc1F ZINC000273363789 130111342 /nfs/dbraw/zinc/11/13/42/130111342.db2.gz DPRJSMFGMHPDHL-NSHDSACASA-N -1 3 304.321 3.599 20 10 DHCDHM C[C@@H](NC1(c2ccccc2F)CC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273486816 130128079 /nfs/dbraw/zinc/12/80/79/130128079.db2.gz NIZHESMFSVSEFL-LLVKDONJSA-N -1 3 316.332 3.779 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cnn(C)c1 ZINC000273607930 130143821 /nfs/dbraw/zinc/14/38/21/130143821.db2.gz UVFGLCUYEISKRH-RKDXNWHRSA-N -1 3 314.216 3.844 20 10 DHCDHM COC[C@H](N[C@H](C)c1cc(Cl)ccc1[O-])c1ccc(C)o1 ZINC000185630172 333210771 /nfs/dbraw/zinc/21/07/71/333210771.db2.gz DOFMKLNRCAKQAI-RISCZKNCSA-N -1 3 309.793 3.985 20 10 DHCDHM COc1cc(Cl)cc(CNC(C)(C)c2nccs2)c1[O-] ZINC000184708098 333365840 /nfs/dbraw/zinc/36/58/40/333365840.db2.gz WQTGLADWZDREGU-UHFFFAOYSA-N -1 3 312.822 3.536 20 10 DHCDHM C[C@H](NCc1ncccc1N(C)C)c1ccc2ccccc2c1[O-] ZINC000289802834 334168093 /nfs/dbraw/zinc/16/80/93/334168093.db2.gz OBJVPGBMXVRDOW-AWEZNQCLSA-N -1 3 321.424 3.857 20 10 DHCDHM [O-]c1c(Cl)cccc1CN[C@@H]1COc2c1cccc2Cl ZINC000375038565 337001955 /nfs/dbraw/zinc/00/19/55/337001955.db2.gz LLMBUFOACMSVFX-CYBMUJFWSA-N -1 3 310.180 3.922 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccccc1[O-])c1nccn1-c1ccccc1 ZINC000376563427 337036899 /nfs/dbraw/zinc/03/68/99/337036899.db2.gz TXIHYYSBJCCKDL-GJZGRUSLSA-N -1 3 307.397 3.990 20 10 DHCDHM COc1cccc(-c2cnc(CN(C)Cc3ccccc3[O-])o2)c1 ZINC000376778252 337040901 /nfs/dbraw/zinc/04/09/01/337040901.db2.gz KTOBAQUJCACMJD-UHFFFAOYSA-N -1 3 324.380 3.688 20 10 DHCDHM Cc1ccc(C(=O)N2CCC(=Cc3ccccc3)CC2)c([O-])c1O ZINC000376848081 337042625 /nfs/dbraw/zinc/04/26/25/337042625.db2.gz ZRNPFEJAXLUUBX-UHFFFAOYSA-N -1 3 323.392 3.726 20 10 DHCDHM [O-]c1ccccc1CNCc1nc(-c2ccccc2F)cs1 ZINC000378132887 337066999 /nfs/dbraw/zinc/06/69/99/337066999.db2.gz YBTRDVDNJYYBRI-UHFFFAOYSA-N -1 3 314.385 3.945 20 10 DHCDHM CCSc1cc(CN[C@@H](C)c2ccc(F)cc2[O-])ccn1 ZINC000187799530 521734003 /nfs/dbraw/zinc/73/40/03/521734003.db2.gz OQSVKMUSFDCUMH-NSHDSACASA-N -1 3 306.406 3.889 20 10 DHCDHM CN(Cc1nc(C(F)(F)F)cs1)Cc1cc(F)ccc1[O-] ZINC000180230017 523553753 /nfs/dbraw/zinc/55/37/53/523553753.db2.gz PEWHCXHGGXNYEN-UHFFFAOYSA-N -1 3 320.311 3.639 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1cccc([N+](=O)[O-])c1 ZINC000191222978 525661242 /nfs/dbraw/zinc/66/12/42/525661242.db2.gz XJMXOLHIZZPPDV-NXEZZACHSA-N -1 3 322.311 3.990 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000365664663 526346062 /nfs/dbraw/zinc/34/60/62/526346062.db2.gz WJJFBCCQXBZUJX-JKSUJKDBSA-N -1 3 307.821 3.579 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000365664662 526346342 /nfs/dbraw/zinc/34/63/42/526346342.db2.gz WJJFBCCQXBZUJX-HZPDHXFCSA-N -1 3 307.821 3.579 20 10 DHCDHM CC[C@H](NCc1cccc(OC)c1OC)c1ccc(F)cc1[O-] ZINC000285989050 535920379 /nfs/dbraw/zinc/92/03/79/535920379.db2.gz IAELLDKUYKPZOO-HNNXBMFYSA-N -1 3 319.376 3.789 20 10 DHCDHM CC[C@H](N[C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1[O-] ZINC000286127152 535943494 /nfs/dbraw/zinc/94/34/94/535943494.db2.gz NWWJLYPPFKAYFU-MFKMUULPSA-N -1 3 306.385 3.575 20 10 DHCDHM COCC[C@H](N[C@H](C)c1ccc(F)cc1[O-])c1ccc(C)o1 ZINC000273478303 536817943 /nfs/dbraw/zinc/81/79/43/536817943.db2.gz TZDSSGKSFYJQQY-DOMZBBRYSA-N -1 3 307.365 3.861 20 10 DHCDHM C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816594756 1028956005 /nfs/dbraw/zinc/95/60/05/1028956005.db2.gz OGSDGCXSWYGKJE-VXNVDRBHSA-N -1 3 311.706 3.957 20 10 DHCDHM Cc1cc([O-])c(CN2CCc3nc[nH]c3C23CCC3)cc1Cl ZINC000895068810 1014232779 /nfs/dbraw/zinc/23/27/79/1014232779.db2.gz MFVAZVJMNRMIAD-UHFFFAOYSA-N -1 3 317.820 3.515 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCC[C@@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599902227 984857785 /nfs/dbraw/zinc/85/77/85/984857785.db2.gz RRYTWRDWOOXZGC-KKUMJFAQSA-N -1 3 305.418 3.857 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCC[C@@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599902229 984858094 /nfs/dbraw/zinc/85/80/94/984858094.db2.gz RRYTWRDWOOXZGC-SOUVJXGZSA-N -1 3 305.418 3.857 20 10 DHCDHM CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000276816329 1015679395 /nfs/dbraw/zinc/67/93/95/1015679395.db2.gz AGZILKAEYIZTBO-GUBZILKMSA-N -1 3 324.375 3.714 20 10 DHCDHM COCC[C@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1ccco1 ZINC000276867273 1015719835 /nfs/dbraw/zinc/71/98/35/1015719835.db2.gz DIVTZAIHJXZOET-MFKMUULPSA-N -1 3 311.328 3.692 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593231806 994378791 /nfs/dbraw/zinc/37/87/91/994378791.db2.gz LIENKBHWRMOMDJ-MGPLVRAMSA-N -1 3 315.344 3.568 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593231808 994378841 /nfs/dbraw/zinc/37/88/41/994378841.db2.gz LIENKBHWRMOMDJ-QFYYESIMSA-N -1 3 315.344 3.568 20 10 DHCDHM O=C(Nc1ccc2sc(Cl)nc2c1)c1cccc(O)c1[O-] ZINC001148218718 1032374275 /nfs/dbraw/zinc/37/42/75/1032374275.db2.gz ILRGNLUIHOLIOJ-UHFFFAOYSA-N -1 3 320.757 3.613 20 10 DHCDHM [O-]c1cccc(Cl)c1CNCc1nc(C(F)(F)F)cs1 ZINC000123314556 1032643311 /nfs/dbraw/zinc/64/33/11/1032643311.db2.gz KJMKIPPOWGHATP-UHFFFAOYSA-N -1 3 322.739 3.811 20 10 DHCDHM CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccccc1[O-] ZINC000024207812 1017556041 /nfs/dbraw/zinc/55/60/41/1017556041.db2.gz VEGVNJHEDSRUSW-UHFFFAOYSA-N -1 3 324.424 3.655 20 10 DHCDHM C[C@H]1CCCN1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708135169 1017668681 /nfs/dbraw/zinc/66/86/81/1017668681.db2.gz WVWALLJLIMMGQQ-QMMMGPOBSA-N -1 3 304.615 3.792 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCCC2(C1)CCCCCC2 ZINC000187146483 1019144807 /nfs/dbraw/zinc/14/48/07/1019144807.db2.gz CDBHTURBIHQDEM-UHFFFAOYSA-N -1 3 303.402 3.674 20 10 DHCDHM O=C(Nc1ccc2c(Cl)cccc2n1)c1cccc(O)c1[O-] ZINC000804250944 1019379242 /nfs/dbraw/zinc/37/92/42/1019379242.db2.gz XNSVEKXJEKJKMH-UHFFFAOYSA-N -1 3 314.728 3.552 20 10 DHCDHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(N(C)C)cc2)CC)n1 ZINC000588611138 1019621203 /nfs/dbraw/zinc/62/12/03/1019621203.db2.gz RNHCECYGQNDCLV-NTCAYCPXSA-N -1 3 311.429 3.739 20 10 DHCDHM O=C1CCCN1c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000378896187 1020523013 /nfs/dbraw/zinc/52/30/13/1020523013.db2.gz UXJDYWODVUZKSK-UHFFFAOYSA-N -1 3 316.788 3.785 20 10 DHCDHM CCC(F)(F)CN[C@@H](C)c1cc(Br)ccc1[O-] ZINC000858508194 1032926472 /nfs/dbraw/zinc/92/64/72/1032926472.db2.gz UDGWLEYCSQDBTH-QMMMGPOBSA-N -1 3 308.166 3.851 20 10 DHCDHM [O-]c1c(CNc2ccc(O)cc2)cc(Cl)c2cccnc12 ZINC001168523390 1021388243 /nfs/dbraw/zinc/38/82/43/1021388243.db2.gz NZTARSAGTJAJFU-UHFFFAOYSA-N -1 3 300.745 3.912 20 10 DHCDHM Cc1ncc(-c2ccc(NC(=O)c3ccc(C)c(O)c3[O-])cc2)o1 ZINC000181840497 1022243185 /nfs/dbraw/zinc/24/31/85/1022243185.db2.gz VKFYGPBTPDXVLK-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM C[C@@H]1c2cccn2CCN1Cc1cc(Br)ccc1[O-] ZINC000179563535 1022473553 /nfs/dbraw/zinc/47/35/53/1022473553.db2.gz URXBIHUDVSXTRQ-LLVKDONJSA-N -1 3 321.218 3.533 20 10 DHCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC(OC2CCC2)CC1 ZINC001237808191 1022880208 /nfs/dbraw/zinc/88/02/08/1022880208.db2.gz RXOCUZKOCDEKEK-UHFFFAOYSA-N -1 3 313.800 3.718 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2ccccc2)C1 ZINC000768235644 1022931161 /nfs/dbraw/zinc/93/11/61/1022931161.db2.gz BUQNUWFKTWSZCO-QGZVFWFLSA-N -1 3 303.789 3.619 20 10 DHCDHM [O-]c1c(CN2CCCO[C@@H](c3ccccc3)C2)ccc(F)c1F ZINC000876684983 1033123492 /nfs/dbraw/zinc/12/34/92/1033123492.db2.gz VTIAKJABRARWKT-MRXNPFEDSA-N -1 3 319.351 3.634 20 10 DHCDHM CC[C@](C)(NCc1cc(F)cc(F)c1[O-])c1nc(C)cs1 ZINC000883017776 1024213264 /nfs/dbraw/zinc/21/32/64/1024213264.db2.gz APXCSDURBLEYKS-HNNXBMFYSA-N -1 3 312.385 3.850 20 10 DHCDHM Cc1ccc(CN[C@H](C)c2cc(F)cc(F)c2[O-])c(Cl)n1 ZINC000883301906 1024357830 /nfs/dbraw/zinc/35/78/30/1024357830.db2.gz LNOXQXMLWCPJKX-SECBINFHSA-N -1 3 312.747 3.878 20 10 DHCDHM CC[C@@H](NC1(c2ncccn2)CCC1)c1cc(Cl)ccc1[O-] ZINC000883311448 1024363427 /nfs/dbraw/zinc/36/34/27/1024363427.db2.gz AFAGNDHYPGKMAO-CQSZACIVSA-N -1 3 317.820 3.956 20 10 DHCDHM O=C(Nc1ccc2cccc(Cl)c2n1)c1cccc(O)c1[O-] ZINC000790922703 1024397205 /nfs/dbraw/zinc/39/72/05/1024397205.db2.gz SSQROMHPDDGWBI-UHFFFAOYSA-N -1 3 314.728 3.552 20 10 DHCDHM CCC1(CC)CN(C(=O)c2cccc(O)c2[O-])c2ccccc21 ZINC000790904671 1024400495 /nfs/dbraw/zinc/40/04/95/1024400495.db2.gz XJOWILPQGORHIT-UHFFFAOYSA-N -1 3 311.381 3.816 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1CCc2c1cccc2O ZINC000790959052 1024406514 /nfs/dbraw/zinc/40/65/14/1024406514.db2.gz DMDGOSARWRSQCM-ZDUSSCGKSA-N -1 3 307.752 3.667 20 10 DHCDHM COc1ccccc1CN(C)Cc1c([O-])ccc(Cl)c1F ZINC000792156471 1024636636 /nfs/dbraw/zinc/63/66/36/1024636636.db2.gz HHVLQBXULHAJCN-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM CN(CCOCc1ccccc1)Cc1c([O-])ccc(Cl)c1F ZINC000792170116 1024640745 /nfs/dbraw/zinc/64/07/45/1024640745.db2.gz PJMPUMFSEIIJNF-UHFFFAOYSA-N -1 3 323.795 3.833 20 10 DHCDHM CC(C)N(Cc1ccccn1)Cc1c([O-])ccc(Cl)c1F ZINC000792167587 1024640792 /nfs/dbraw/zinc/64/07/92/1024640792.db2.gz WMGKGZQTHDCTGX-UHFFFAOYSA-N -1 3 308.784 3.990 20 10 DHCDHM C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000793232605 1024947527 /nfs/dbraw/zinc/94/75/27/1024947527.db2.gz ZIPYVUYQYIQKNB-XVKPBYJWSA-N -1 3 311.706 3.957 20 10 DHCDHM C[C@H](Nc1ccc2ccn(C)c(=O)c2c1)c1ccc(F)cc1[O-] ZINC000793564860 1025104601 /nfs/dbraw/zinc/10/46/01/1025104601.db2.gz OQGUTODVRLSNKM-NSHDSACASA-N -1 3 312.344 3.556 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@H]1[C@@H]1CCCO1 ZINC000793607998 1025126172 /nfs/dbraw/zinc/12/61/72/1025126172.db2.gz HAIWNCPQKFLDEK-KBPBESRZSA-N -1 3 316.228 3.842 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)ccc1O ZINC000136491675 1025449542 /nfs/dbraw/zinc/44/95/42/1025449542.db2.gz OXCNRNZPRVLOCG-UHFFFAOYSA-N -1 3 313.378 3.655 20 10 DHCDHM CCNC(=O)c1ccc(C)c(N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886584115 1025718114 /nfs/dbraw/zinc/71/81/14/1025718114.db2.gz IZBPCTYPBODIOQ-GFCCVEGCSA-N -1 3 316.376 3.763 20 10 DHCDHM CO[C@@H]1Cc2ccc(N[C@H](C)c3c([O-])cccc3F)cc2C1 ZINC000886589703 1025726086 /nfs/dbraw/zinc/72/60/86/1025726086.db2.gz BXEPLIFEOSICMK-IAQYHMDHSA-N -1 3 301.361 3.818 20 10 DHCDHM C[C@H](N[C@@H]1CCOc2c(F)cccc21)c1c([O-])cccc1F ZINC000886597084 1025731257 /nfs/dbraw/zinc/73/12/57/1025731257.db2.gz VXIPSANVUWPRDJ-IINYFYTJSA-N -1 3 305.324 3.845 20 10 DHCDHM COCc1ccc(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000809775484 1026607482 /nfs/dbraw/zinc/60/74/82/1026607482.db2.gz BXVQYBXMRJOROI-UHFFFAOYSA-N -1 3 316.184 3.728 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])[C@@H]1C1CC1 ZINC000811513907 1027029211 /nfs/dbraw/zinc/02/92/11/1027029211.db2.gz VODXUHVKIUEQJX-CQSZACIVSA-N -1 3 310.781 3.574 20 10 DHCDHM C[C@@H]1Oc2c(cccc2F)[C@H]1NCc1cccc(Cl)c1[O-] ZINC000369379982 1028481477 /nfs/dbraw/zinc/48/14/77/1028481477.db2.gz QHPZIDVTLDHLPC-XPTSAGLGSA-N -1 3 307.752 3.797 20 10 DHCDHM CCc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2[O-])on1 ZINC000815582597 1028554156 /nfs/dbraw/zinc/55/41/56/1028554156.db2.gz KRHJFUJOWZDSHA-VIFPVBQESA-N -1 3 314.307 3.812 20 10 DHCDHM Cn1cccc1[C@@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816482305 1028895010 /nfs/dbraw/zinc/89/50/10/1028895010.db2.gz BBCBAHBSECCGNF-HNNXBMFYSA-N -1 3 308.784 3.860 20 10 DHCDHM Cc1ccc(NCc2cc(Cl)c(F)cc2[O-])c(N(C)C)n1 ZINC000816559872 1028944742 /nfs/dbraw/zinc/94/47/42/1028944742.db2.gz XYEDKURPIZUPFZ-UHFFFAOYSA-N -1 3 309.772 3.566 20 10 DHCDHM COc1ccc(F)cc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000816574629 1028952073 /nfs/dbraw/zinc/95/20/73/1028952073.db2.gz NWICZOUFPXAIQA-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM Cc1cc(Cl)nc(CNCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816599697 1028956775 /nfs/dbraw/zinc/95/67/75/1028956775.db2.gz VINXITAIZSIPDL-UHFFFAOYSA-N -1 3 315.175 3.831 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])[C@@H]1[C@@H]1CCCO1 ZINC000816613808 1028965548 /nfs/dbraw/zinc/96/55/48/1028965548.db2.gz FVCGCBCXOJHIGO-LSDHHAIUSA-N -1 3 313.800 3.574 20 10 DHCDHM CC(C)n1cc2c(n1)[C@@H](NCc1c([O-])cccc1Cl)CCC2 ZINC000824176350 1030492393 /nfs/dbraw/zinc/49/23/93/1030492393.db2.gz MVQHPIAVFNDDPQ-HNNXBMFYSA-N -1 3 319.836 3.990 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCC2(CCC2)C1 ZINC001144306840 1031455404 /nfs/dbraw/zinc/45/54/04/1031455404.db2.gz SQPLXOAXHNXECO-UHFFFAOYSA-N -1 3 314.198 3.670 20 10 DHCDHM COC[C@H](NCc1cc(Cl)c(F)cc1[O-])c1ccc(C)o1 ZINC000293513266 1031496711 /nfs/dbraw/zinc/49/67/11/1031496711.db2.gz CHWRHPRXIWDNHH-ZDUSSCGKSA-N -1 3 313.756 3.563 20 10 DHCDHM CC(C)O[C@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000846013485 1031807840 /nfs/dbraw/zinc/80/78/40/1031807840.db2.gz BTNZAPMHRFJBSU-NSHDSACASA-N -1 3 301.789 3.574 20 10 DHCDHM CCN(Cc1ccc(N(C)C)cc1)Cc1cc(F)c([O-])cc1F ZINC001144659914 1031817700 /nfs/dbraw/zinc/81/77/00/1031817700.db2.gz QVUHGTYXWPLLSY-UHFFFAOYSA-N -1 3 320.383 3.759 20 10 DHCDHM CCOC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000127248450 1033781521 /nfs/dbraw/zinc/78/15/21/1033781521.db2.gz DBXAQWOVQPOGBM-UHFFFAOYSA-N -1 3 305.761 3.834 20 10 DHCDHM CCn1ccc(CN(C)Cc2c([O-])cccc2Br)c1 ZINC000862341372 1033821901 /nfs/dbraw/zinc/82/19/01/1033821901.db2.gz VROCXNQBUABHEM-UHFFFAOYSA-N -1 3 323.234 3.608 20 10 DHCDHM CC[C@H](Nc1cccc(-n2nccn2)c1)c1ccc(F)cc1[O-] ZINC000864022200 1034261411 /nfs/dbraw/zinc/26/14/11/1034261411.db2.gz IMUPZOYTPWZGTK-INIZCTEOSA-N -1 3 312.348 3.675 20 10 DHCDHM COc1cc(F)c(N[C@@H](C)c2ccc(F)cc2[O-])cc1OC ZINC000186362517 1034623835 /nfs/dbraw/zinc/62/38/35/1034623835.db2.gz JEMBPLDWUIDDCN-VIFPVBQESA-N -1 3 309.312 3.861 20 10 DHCDHM O=C(Cc1cccc2ccccc21)NCc1c([O-])cccc1F ZINC001178410541 1035428238 /nfs/dbraw/zinc/42/82/38/1035428238.db2.gz RVNNBJYKQPRNCJ-UHFFFAOYSA-N -1 3 309.340 3.543 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1C[C@@]1(F)c1ccccc1 ZINC001178998070 1035460082 /nfs/dbraw/zinc/46/00/82/1035460082.db2.gz BGGOKCCTRZFDBG-GOEBONIOSA-N -1 3 309.743 3.912 20 10 DHCDHM C[C@@H](NCc1cc(Cl)cc(F)c1[O-])c1ccccc1[N+](=O)[O-] ZINC001179512463 1035482748 /nfs/dbraw/zinc/48/27/48/1035482748.db2.gz UKCSWVNHRDHLEC-SECBINFHSA-N -1 3 324.739 3.944 20 10 DHCDHM C[C@@H](NCc1cc(Cl)ccc1[O-])c1nc(C(C)(C)C)no1 ZINC000174662598 1035816491 /nfs/dbraw/zinc/81/64/91/1035816491.db2.gz NMKHHVAOIHXMDC-SECBINFHSA-N -1 3 309.797 3.577 20 10 DHCDHM COc1cc(NCc2cccc(F)c2[O-])c(Cl)c(OC)c1 ZINC001182309073 1036207748 /nfs/dbraw/zinc/20/77/48/1036207748.db2.gz MCERIISRSCDFFZ-UHFFFAOYSA-N -1 3 311.740 3.814 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC[C@H](OCC(F)(F)F)C1 ZINC000775654917 1036237408 /nfs/dbraw/zinc/23/74/08/1036237408.db2.gz RAURVMXKLYLDMY-NSHDSACASA-N -1 3 323.742 3.589 20 10 DHCDHM [O-]c1c(F)cc(Br)cc1CN1CCC12CCCC2 ZINC001182755055 1036435491 /nfs/dbraw/zinc/43/54/91/1036435491.db2.gz PVHCXXIGDFQPPJ-UHFFFAOYSA-N -1 3 314.198 3.812 20 10 DHCDHM CC(C)(C)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])CCO1 ZINC001184373580 1036838016 /nfs/dbraw/zinc/83/80/16/1036838016.db2.gz AIFHYFIUCQQHBG-AWEZNQCLSA-N -1 3 315.816 3.822 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@H](CC(F)(F)F)C1 ZINC000775136872 1037684707 /nfs/dbraw/zinc/68/47/07/1037684707.db2.gz NIOQKZYQRXJJGL-QMMMGPOBSA-N -1 3 311.706 3.959 20 10 DHCDHM [O-]c1ccc2ccncc2c1CN(CC(F)F)CC1CCC1 ZINC000761289636 1038897386 /nfs/dbraw/zinc/89/73/86/1038897386.db2.gz FHKPZMBXVNTBMR-UHFFFAOYSA-N -1 3 306.356 3.808 20 10 DHCDHM CO[C@H]1Cc2ccc(N[C@@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000760879074 1038969482 /nfs/dbraw/zinc/96/94/82/1038969482.db2.gz CZFMJPVLLXZHBW-ZBEGNZNMSA-N -1 3 301.361 3.818 20 10 DHCDHM CCc1noc(CC)c1CN[C@H](CC)c1ccc(F)cc1[O-] ZINC000285520221 131177053 /nfs/dbraw/zinc/17/70/53/131177053.db2.gz BBZYYJMTRFQWLB-CQSZACIVSA-N -1 3 306.381 3.885 20 10 DHCDHM C[C@H](Nc1cccc(N2CCCC2=O)c1)c1cc(F)ccc1[O-] ZINC000176981778 332966564 /nfs/dbraw/zinc/96/65/64/332966564.db2.gz OXLSMOCZVOCKBB-LBPRGKRZSA-N -1 3 314.360 3.831 20 10 DHCDHM Cc1nn(C)c(C)c1N[C@H](C)c1cc(Br)ccc1[O-] ZINC000273472570 334047799 /nfs/dbraw/zinc/04/77/99/334047799.db2.gz SDPFLYWORDTANL-MRVPVSSYSA-N -1 3 324.222 3.678 20 10 DHCDHM COc1c([O-])c(CN(C)[C@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000278274749 334094442 /nfs/dbraw/zinc/09/44/42/334094442.db2.gz RZLVBWBASIGKOL-SNVBAGLBSA-N -1 3 322.386 3.564 20 10 DHCDHM CC[C@@H](Nc1ccc(CNC(C)=O)cc1)c1ccc(F)cc1[O-] ZINC000286242660 334152255 /nfs/dbraw/zinc/15/22/55/334152255.db2.gz UETUPVBMVSOGMC-QGZVFWFLSA-N -1 3 316.376 3.731 20 10 DHCDHM C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000370708659 336891651 /nfs/dbraw/zinc/89/16/51/336891651.db2.gz QKQCKIMFQRKVLT-UKRRQHHQSA-N -1 3 311.381 3.506 20 10 DHCDHM COc1cccc([C@@H](NCc2ccccc2[O-])c2ccccn2)c1 ZINC000375073278 337002600 /nfs/dbraw/zinc/00/26/00/337002600.db2.gz DUSLQVJDLXEFBM-HXUWFJFHSA-N -1 3 320.392 3.675 20 10 DHCDHM C[C@H](N[C@H]1COc2c1cccc2Cl)c1ccc(F)cc1[O-] ZINC000375242784 337006461 /nfs/dbraw/zinc/00/64/61/337006461.db2.gz QOIQESFTKJUYEH-XPTSAGLGSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@@H](N[C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1[O-] ZINC000375242785 337006506 /nfs/dbraw/zinc/00/65/06/337006506.db2.gz QOIQESFTKJUYEH-YMTOWFKASA-N -1 3 307.752 3.969 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCC(F)(c2cccnc2)CC1 ZINC000375301798 337007387 /nfs/dbraw/zinc/00/73/87/337007387.db2.gz IAQQMMQPDNNFGA-UHFFFAOYSA-N -1 3 320.795 3.901 20 10 DHCDHM [O-]c1c(F)cccc1CN1CC2(CCOCC2)c2ccccc21 ZINC000377311116 337050391 /nfs/dbraw/zinc/05/03/91/337050391.db2.gz YEWCPPBQBWDCEK-UHFFFAOYSA-N -1 3 313.372 3.600 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCC(Nc2cccnc2)CC1 ZINC000377617829 337056457 /nfs/dbraw/zinc/05/64/57/337056457.db2.gz BMJIBVJKCPEXEG-UHFFFAOYSA-N -1 3 317.820 3.517 20 10 DHCDHM Cc1cnn(-c2ccncc2NCc2cccc(Cl)c2[O-])c1 ZINC000182669936 337189388 /nfs/dbraw/zinc/18/93/88/337189388.db2.gz WLQNIPGQNNBRSA-UHFFFAOYSA-N -1 3 314.776 3.547 20 10 DHCDHM CN(Cc1cccc(Cl)c1[O-])[C@H]1CCCc2cccnc21 ZINC000365032756 523304805 /nfs/dbraw/zinc/30/48/05/523304805.db2.gz XINTYQZTFPGSDE-HNNXBMFYSA-N -1 3 302.805 3.950 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@H](CC)c2ccccc2[O-])o1 ZINC000156014429 524051528 /nfs/dbraw/zinc/05/15/28/524051528.db2.gz ABXHBMIVYCPLFL-CVEARBPZSA-N -1 3 303.402 3.976 20 10 DHCDHM C[C@H](N[C@@H]1CCOc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000191185752 525576288 /nfs/dbraw/zinc/57/62/88/525576288.db2.gz IUJYNFUFRIEVDD-IINYFYTJSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1[O-] ZINC000191222964 525613906 /nfs/dbraw/zinc/61/39/06/525613906.db2.gz XJMXOLHIZZPPDV-VHSXEESVSA-N -1 3 322.311 3.990 20 10 DHCDHM [O-]c1c(Cl)cccc1CN[C@H]1CCOc2c(F)cccc21 ZINC000191197029 526329133 /nfs/dbraw/zinc/32/91/33/526329133.db2.gz BCQDJZIDMXMZAW-AWEZNQCLSA-N -1 3 307.752 3.798 20 10 DHCDHM CC(C)(C)c1csc(CN[C@H]2CCc3cccc([O-])c32)n1 ZINC000297576180 535148929 /nfs/dbraw/zinc/14/89/29/535148929.db2.gz GWTJJQUBFZQZEE-LBPRGKRZSA-N -1 3 302.443 3.923 20 10 DHCDHM CC[C@@H](N[C@@H](COC)c1ccccc1)c1ccc(F)cc1[O-] ZINC000286000728 535808154 /nfs/dbraw/zinc/80/81/54/535808154.db2.gz HNMDYOZIGJDLDO-SJORKVTESA-N -1 3 303.377 3.960 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@@H](C)c2ccc(C)cc2[O-])cs1 ZINC000273367552 536511992 /nfs/dbraw/zinc/51/19/92/536511992.db2.gz BSSXCFKFAYEWMY-NWDGAFQWSA-N -1 3 306.431 3.715 20 10 DHCDHM CCOc1ccc(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000894515611 1013399113 /nfs/dbraw/zinc/39/91/13/1013399113.db2.gz WFKBKQKFPOAKEL-UHFFFAOYSA-N -1 3 316.184 3.981 20 10 DHCDHM [O-]c1c(F)cc(Br)cc1CN1CC2CCC1CC2 ZINC000715713530 1018951258 /nfs/dbraw/zinc/95/12/58/1018951258.db2.gz QTIXKJQSWLTUNN-UHFFFAOYSA-N -1 3 314.198 3.668 20 10 DHCDHM CC[C@@H](N[C@H](C)c1ncc(C(=O)[O-])s1)c1ccc(C)cc1O ZINC001595281292 980332370 /nfs/dbraw/zinc/33/23/70/980332370.db2.gz LMZDCLMEAPQEKK-ZYHUDNBSSA-N -1 3 320.414 3.657 20 10 DHCDHM Cc1ccc(CN(C)Cc2cccc(Br)c2[O-])o1 ZINC000160862885 1014727591 /nfs/dbraw/zinc/72/75/91/1014727591.db2.gz GOKCTZYKPROXOX-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCC[C@@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599841217 988836833 /nfs/dbraw/zinc/83/68/33/988836833.db2.gz RRYTWRDWOOXZGC-QLFBSQMISA-N -1 3 305.418 3.857 20 10 DHCDHM C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593251476 994496125 /nfs/dbraw/zinc/49/61/25/994496125.db2.gz GURLZIAYHIYAFA-MNOVXSKESA-N -1 3 313.344 3.567 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](c2cccs2)C1 ZINC000092593993 1032503741 /nfs/dbraw/zinc/50/37/41/1032503741.db2.gz RMLFHXJHICRQNM-CQSZACIVSA-N -1 3 309.818 3.681 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](c2ccsc2)C1 ZINC000093768349 1032553486 /nfs/dbraw/zinc/55/34/86/1032553486.db2.gz ZXORPTUHSUYZHR-HNNXBMFYSA-N -1 3 309.818 3.681 20 10 DHCDHM CC(C)(C)Nc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000760526243 1032680012 /nfs/dbraw/zinc/68/00/12/1032680012.db2.gz YUNQPOPJPSULJI-UHFFFAOYSA-N -1 3 300.358 3.561 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000928712622 1017697496 /nfs/dbraw/zinc/69/74/96/1017697496.db2.gz URXKTVYZDRQCLL-ZJUUUORDSA-N -1 3 319.298 3.516 20 10 DHCDHM C[C@@H]1CC[C@H](C)CN1Cc1cc(Br)cc(F)c1[O-] ZINC000715718470 1018951923 /nfs/dbraw/zinc/95/19/23/1018951923.db2.gz NSUQYEANYDVUJZ-VHSXEESVSA-N -1 3 316.214 3.914 20 10 DHCDHM CCc1ccccc1S(=O)(=O)[N-]c1cc(C)c(O)c(C)c1C ZINC000187650564 1019095741 /nfs/dbraw/zinc/09/57/41/1019095741.db2.gz MBSZPLQIHDSMCT-UHFFFAOYSA-N -1 3 319.426 3.681 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@@H]1c2ccccc2OC[C@H]1F ZINC000922519526 1020110005 /nfs/dbraw/zinc/11/00/05/1020110005.db2.gz CMQZUNVXAJLQOQ-CZUORRHYSA-N -1 3 307.752 3.607 20 10 DHCDHM CN(Cc1cc[nH]n1)Cc1cc2oc3ccccc3c2cc1[O-] ZINC000732670156 1020266336 /nfs/dbraw/zinc/26/63/36/1020266336.db2.gz NWEMQESXUSCOJC-UHFFFAOYSA-N -1 3 307.353 3.647 20 10 DHCDHM CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@H](C)C1 ZINC000282130978 1020867195 /nfs/dbraw/zinc/86/71/95/1020867195.db2.gz BKPGJGNBAMSTEV-SKDRFNHKSA-N -1 3 304.217 3.698 20 10 DHCDHM C[C@@H](N[C@@H](C)c1nccn1C)c1cccc(C(F)(F)F)c1[O-] ZINC000850573038 1021617311 /nfs/dbraw/zinc/61/73/11/1021617311.db2.gz SODZCZXZYXLTJW-ZJUUUORDSA-N -1 3 313.323 3.556 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H]2c2ccc(F)cc2)c1[O-] ZINC000852468381 1022124920 /nfs/dbraw/zinc/12/49/20/1022124920.db2.gz NJKGHGZHLXNUEI-QGZVFWFLSA-N -1 3 317.335 3.820 20 10 DHCDHM CCCOc1ccc(Cl)cc1NC(=O)c1cccc(O)c1[O-] ZINC000776634192 1022188592 /nfs/dbraw/zinc/18/85/92/1022188592.db2.gz WJMBPWLLJISRTB-UHFFFAOYSA-N -1 3 321.760 3.792 20 10 DHCDHM CN(Cc1cccc(F)c1)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000768161338 1022907362 /nfs/dbraw/zinc/90/73/62/1022907362.db2.gz ZBUYBRDKNNYPCB-UHFFFAOYSA-N -1 3 324.739 3.725 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)c([O-])c1O ZINC000770466802 1023314383 /nfs/dbraw/zinc/31/43/83/1023314383.db2.gz YWODQGNSPUVTKZ-UHFFFAOYSA-N -1 3 311.259 3.677 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)Nc2ccc3ccn(C)c3c2)c1 ZINC000785569854 1023596265 /nfs/dbraw/zinc/59/62/65/1023596265.db2.gz LSVJBRPWVNNMOG-GFCCVEGCSA-N -1 3 324.380 3.844 20 10 DHCDHM Cc1ccc2c(c1C)OC[C@@H]2NCc1ccc(F)c(F)c1[O-] ZINC000876876409 1033172986 /nfs/dbraw/zinc/17/29/86/1033172986.db2.gz PGQTUXFMNWSOTK-AWEZNQCLSA-N -1 3 305.324 3.511 20 10 DHCDHM Cc1csc(C2(NCc3cc(F)cc(F)c3[O-])CCC2)n1 ZINC000882950308 1024183892 /nfs/dbraw/zinc/18/38/92/1024183892.db2.gz FPQNQTZGLHOFLB-UHFFFAOYSA-N -1 3 310.369 3.604 20 10 DHCDHM Cc1ccc2c(c1)[C@H](NCc1c([O-])ccc(Cl)c1F)CO2 ZINC000790977988 1024421850 /nfs/dbraw/zinc/42/18/50/1024421850.db2.gz WODALRLIDMWLMZ-CYBMUJFWSA-N -1 3 307.752 3.716 20 10 DHCDHM CN(Cc1c([O-])ccc(Cl)c1F)[C@H](CCO)c1ccccc1 ZINC000792165855 1024641459 /nfs/dbraw/zinc/64/14/59/1024641459.db2.gz LQDCYPXYQNCBKM-OAHLLOKOSA-N -1 3 323.795 3.740 20 10 DHCDHM CCc1nc(C)c(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000291722782 1025296871 /nfs/dbraw/zinc/29/68/71/1025296871.db2.gz MUXPOWHFQLWBIQ-UHFFFAOYSA-N -1 3 315.200 3.848 20 10 DHCDHM CC[C@H](NCc1cn2ccccc2n1)c1cccc(Cl)c1[O-] ZINC000806127993 1025791133 /nfs/dbraw/zinc/79/11/33/1025791133.db2.gz LPMGGJDKRBZCOE-HNNXBMFYSA-N -1 3 315.804 3.934 20 10 DHCDHM C[C@@H](N[C@@H]1CCCC1(F)F)c1cc(Br)ccc1[O-] ZINC000806179222 1025834789 /nfs/dbraw/zinc/83/47/89/1025834789.db2.gz BJYVSPBJVKMNEL-PRHODGIISA-N -1 3 320.177 3.993 20 10 DHCDHM CC(C)(C)OC1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000295211206 1027144973 /nfs/dbraw/zinc/14/49/73/1027144973.db2.gz AOYFGDHFRALTME-UHFFFAOYSA-N -1 3 315.816 3.964 20 10 DHCDHM [O-]c1ccc(F)cc1CN1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000779000269 1027758250 /nfs/dbraw/zinc/75/82/50/1027758250.db2.gz SRNUXJDENUMCBB-UHFFFAOYSA-N -1 3 314.335 3.710 20 10 DHCDHM CC(C)c1ncc2c(n1)CCN(Cc1cc(Cl)ccc1[O-])C2 ZINC000527619731 1027786996 /nfs/dbraw/zinc/78/69/96/1027786996.db2.gz TUISMDBUNNEPRF-UHFFFAOYSA-N -1 3 317.820 3.517 20 10 DHCDHM C[C@@H]1Oc2c(cccc2F)[C@@H]1NCc1cccc(Cl)c1[O-] ZINC000369379980 1028480843 /nfs/dbraw/zinc/48/08/43/1028480843.db2.gz QHPZIDVTLDHLPC-LKFCYVNXSA-N -1 3 307.752 3.797 20 10 DHCDHM O=C(Nc1ccc(Oc2ccncc2)cc1)c1cccc(O)c1[O-] ZINC000188327075 1028507088 /nfs/dbraw/zinc/50/70/88/1028507088.db2.gz GBFFWXDNODMTCD-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1ccc(Br)o1 ZINC000188975291 1028542759 /nfs/dbraw/zinc/54/27/59/1028542759.db2.gz HJNPTZBJLLQHTI-UHFFFAOYSA-N -1 3 316.582 3.691 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2[O-])on1 ZINC000815576673 1028551898 /nfs/dbraw/zinc/55/18/98/1028551898.db2.gz WBKPXUKWPKUGRU-VIFPVBQESA-N -1 3 300.280 3.558 20 10 DHCDHM Cn1nccc1[C@@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000370201385 1028578516 /nfs/dbraw/zinc/57/85/16/1028578516.db2.gz KASANPPMLMCUSM-HNNXBMFYSA-N -1 3 305.809 3.506 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN[C@@H](C)c2ncccc2F)c1[O-] ZINC000528826939 1028841460 /nfs/dbraw/zinc/84/14/60/1028841460.db2.gz JDKMFMIRGGJUFL-VIFPVBQESA-N -1 3 322.767 3.633 20 10 DHCDHM CCN(CC)c1ccc(CNCc2c(F)ccc([O-])c2F)cc1 ZINC000816536200 1028924583 /nfs/dbraw/zinc/92/45/83/1028924583.db2.gz ODZMZVKUIBETJL-UHFFFAOYSA-N -1 3 320.383 3.806 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@H]1NCc1cc(Cl)c(F)cc1[O-] ZINC000816613220 1028966459 /nfs/dbraw/zinc/96/64/59/1028966459.db2.gz MTHKBPYTXOUSDN-ABKXIKBNSA-N -1 3 307.752 3.797 20 10 DHCDHM CC[C@@H](Nc1ccc(COCCO)cc1)c1ccc(F)cc1[O-] ZINC000818361992 1029386013 /nfs/dbraw/zinc/38/60/13/1029386013.db2.gz NBVKTJRPKFEFKQ-QGZVFWFLSA-N -1 3 319.376 3.603 20 10 DHCDHM O=C(Nc1cnccc1Oc1ccccc1)c1cccc(O)c1[O-] ZINC001136458369 1029851351 /nfs/dbraw/zinc/85/13/51/1029851351.db2.gz DRDWLQFOVUVKJZ-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM C[C@@H]1c2cccn2CCN1Cc1ccc(Br)cc1[O-] ZINC000824507688 1030579448 /nfs/dbraw/zinc/57/94/48/1030579448.db2.gz LVSATAOGSNLKEL-LLVKDONJSA-N -1 3 321.218 3.533 20 10 DHCDHM CCc1noc(CC)c1CNCc1cc(Cl)c(F)cc1[O-] ZINC000293613255 1031540925 /nfs/dbraw/zinc/54/09/25/1031540925.db2.gz LZYXCKOSHUVPCQ-UHFFFAOYSA-N -1 3 312.772 3.587 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@H](C(F)(F)F)CC2)cc1Cl ZINC000877819932 1033470685 /nfs/dbraw/zinc/47/06/85/1033470685.db2.gz BHHDSIFRPCUPQO-ZDUSSCGKSA-N -1 3 323.742 3.507 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccccc1O[C@@H]1CCOC1 ZINC000151685305 1033476163 /nfs/dbraw/zinc/47/61/63/1033476163.db2.gz ORLBOOMMAVXZPS-GFCCVEGCSA-N -1 3 319.788 3.825 20 10 DHCDHM C[C@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877824983 1033477165 /nfs/dbraw/zinc/47/71/65/1033477165.db2.gz WAMJWXRBTODBDI-CABZTGNLSA-N -1 3 323.742 3.587 20 10 DHCDHM COC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1F ZINC000864009429 1034249336 /nfs/dbraw/zinc/24/93/36/1034249336.db2.gz XCRJCOPQFQNVRZ-UHFFFAOYSA-N -1 3 309.724 3.583 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@H](CCO)c1ccco1 ZINC000184507625 1034481002 /nfs/dbraw/zinc/48/10/02/1034481002.db2.gz BCHSIGYUUACSKN-GFCCVEGCSA-N -1 3 316.184 3.505 20 10 DHCDHM CC[C@H](NC(=S)NCc1c([O-])cccc1F)c1cccs1 ZINC000905662098 1035601754 /nfs/dbraw/zinc/60/17/54/1035601754.db2.gz RTYUEUQIYXYFOF-LBPRGKRZSA-N -1 3 324.446 3.708 20 10 DHCDHM COc1ccccc1CN(Cc1cc(F)cc(F)c1[O-])C1CC1 ZINC001180557354 1035717842 /nfs/dbraw/zinc/71/78/42/1035717842.db2.gz CTZGOGUCGMFLHF-UHFFFAOYSA-N -1 3 319.351 3.844 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCN(CC2CC2)c2ccccc21 ZINC001180760008 1035755281 /nfs/dbraw/zinc/75/52/81/1035755281.db2.gz VTJCLNPNJFOGGC-UHFFFAOYSA-N -1 3 312.388 3.768 20 10 DHCDHM Cc1ccc(C(=O)N2c3ccc(Cl)cc3C[C@@H]2C)c([O-])c1O ZINC001181546611 1035939836 /nfs/dbraw/zinc/93/98/36/1035939836.db2.gz FTNVCOSYHOBIKJ-JTQLQIEISA-N -1 3 317.772 3.651 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2[O-])ncn1 ZINC000774266030 1036266687 /nfs/dbraw/zinc/26/66/87/1036266687.db2.gz MYJOREZWJCZIDW-VIFPVBQESA-N -1 3 312.200 3.648 20 10 DHCDHM CC(C)(C)OC1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775660062 1036269126 /nfs/dbraw/zinc/26/91/26/1036269126.db2.gz AAMMPFFWUZICSL-UHFFFAOYSA-N -1 3 315.816 3.964 20 10 DHCDHM CCCc1ccccc1NCc1ccc([N+](=O)[O-])c(OC)c1[O-] ZINC000774915806 1037227309 /nfs/dbraw/zinc/22/73/09/1037227309.db2.gz VUUFRFAWLKZUMT-UHFFFAOYSA-N -1 3 316.357 3.874 20 10 DHCDHM COc1c([O-])c(CNc2cc(C)ccc2Cl)ccc1[N+](=O)[O-] ZINC000774941005 1037247837 /nfs/dbraw/zinc/24/78/37/1037247837.db2.gz GLVBLWCASFWFOL-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM CC[C@@](C)(NCc1cc(F)cc(C(C)=O)c1[O-])c1nccs1 ZINC000079443618 185172034 /nfs/dbraw/zinc/17/20/34/185172034.db2.gz CGLHBFNWILFCFP-MRXNPFEDSA-N -1 3 322.405 3.605 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)c2cccnc2)c1[O-] ZINC000093227190 193219171 /nfs/dbraw/zinc/21/91/71/193219171.db2.gz FWTGXTOQPGNQLG-NSHDSACASA-N -1 3 318.804 3.836 20 10 DHCDHM C[C@H](N[C@@H]1CCc2c1cccc2F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273606026 130143960 /nfs/dbraw/zinc/14/39/60/130143960.db2.gz UDLUZADYJJUQDN-MGPLVRAMSA-N -1 3 316.332 3.778 20 10 DHCDHM CC[C@H](NCc1cc(OC)ccc1OC)c1ccc(F)cc1[O-] ZINC000285561228 131181186 /nfs/dbraw/zinc/18/11/86/131181186.db2.gz HGHBQAMPHUVDQJ-INIZCTEOSA-N -1 3 319.376 3.789 20 10 DHCDHM CC[C@H](NCc1c[nH]nc1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287535713 131286384 /nfs/dbraw/zinc/28/63/84/131286384.db2.gz DUJUSQLMHSBAAT-ZDUSSCGKSA-N -1 3 314.216 3.971 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@@H]2CCc3cccc([O-])c32)o1 ZINC000297861676 132037709 /nfs/dbraw/zinc/03/77/09/132037709.db2.gz UEHBYKVZNVMTDU-HUUCEWRRSA-N -1 3 301.386 3.512 20 10 DHCDHM COc1cc(Cl)cc(CN2CCC[C@@H](C(F)(F)F)C2)c1[O-] ZINC000184673398 333363816 /nfs/dbraw/zinc/36/38/16/333363816.db2.gz VZKFYUINZBYEBR-SNVBAGLBSA-N -1 3 323.742 3.829 20 10 DHCDHM C[C@H](N[C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1[O-] ZINC000375242782 337006367 /nfs/dbraw/zinc/00/63/67/337006367.db2.gz QOIQESFTKJUYEH-LKFCYVNXSA-N -1 3 307.752 3.969 20 10 DHCDHM Cc1n[nH]cc1C1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000375271500 337007110 /nfs/dbraw/zinc/00/71/10/337007110.db2.gz CJGUCUOPNQGIFB-UHFFFAOYSA-N -1 3 323.799 3.596 20 10 DHCDHM [O-]c1ccc(F)cc1CN1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000376164948 337028782 /nfs/dbraw/zinc/02/87/82/337028782.db2.gz HJMCJEWHSFCCKN-CQSZACIVSA-N -1 3 317.364 3.519 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1ncoc1-c1ccccc1 ZINC000378449595 337073127 /nfs/dbraw/zinc/07/31/27/337073127.db2.gz GHQQHXXIKXCYSJ-UHFFFAOYSA-N -1 3 314.772 3.990 20 10 DHCDHM CC[C@@H](N[C@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1[O-] ZINC000183339180 337191412 /nfs/dbraw/zinc/19/14/12/337191412.db2.gz DLODATFYCJUOHX-RHSMWYFYSA-N -1 3 322.412 3.775 20 10 DHCDHM CCn1ncc2c1CCC[C@@H]2N[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000364797310 523695772 /nfs/dbraw/zinc/69/57/72/523695772.db2.gz GUTMWPIDYKCBJU-YGRLFVJLSA-N -1 3 321.371 3.615 20 10 DHCDHM Cc1nc(C(C)(C)NCc2cc(-c3ccccc3)ccc2[O-])no1 ZINC000264368858 526663951 /nfs/dbraw/zinc/66/39/51/526663951.db2.gz HMANYKWYILNMEI-UHFFFAOYSA-N -1 3 323.396 3.776 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@@H](C)c2ccc(F)cc2[O-])cs1 ZINC000273551095 536512620 /nfs/dbraw/zinc/51/26/20/536512620.db2.gz FWIBANWYPFIFEA-VHSXEESVSA-N -1 3 310.394 3.546 20 10 DHCDHM O=C([O-])c1ccc(CNCc2cc(-c3ccccc3)ccc2O)o1 ZINC000740132998 600525099 /nfs/dbraw/zinc/52/50/99/600525099.db2.gz QWVIMSXJNZSTLA-UHFFFAOYSA-N -1 3 323.348 3.640 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2cccs2)c1[O-] ZINC000050134026 1017115636 /nfs/dbraw/zinc/11/56/36/1017115636.db2.gz SYGBBAQLEREIKG-UHFFFAOYSA-N -1 3 309.818 3.942 20 10 DHCDHM C[C@@H]([NH2+]CC[C@H](C)c1ccccc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001592519984 978366080 /nfs/dbraw/zinc/36/60/80/978366080.db2.gz LFVFAXAAQDKTJJ-UONOGXRCSA-N -1 3 313.397 3.935 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCC(C(F)F)CC1 ZINC000307875231 1014623215 /nfs/dbraw/zinc/62/32/15/1014623215.db2.gz DWRJOBGKIRIECH-UHFFFAOYSA-N -1 3 320.177 3.632 20 10 DHCDHM [O-]c1ccc(Cl)cc1CNCc1csc(C(F)(F)F)n1 ZINC000895155069 1014653865 /nfs/dbraw/zinc/65/38/65/1014653865.db2.gz CHRSSVLTEPIEGI-UHFFFAOYSA-N -1 3 322.739 3.811 20 10 DHCDHM COCC[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1ccco1 ZINC000276867263 1015719630 /nfs/dbraw/zinc/71/96/30/1015719630.db2.gz DIVTZAIHJXZOET-GWCFXTLKSA-N -1 3 311.328 3.692 20 10 DHCDHM C[C@@H]([NH2+][C@@H](C)C1CCC(F)CC1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593195273 994146932 /nfs/dbraw/zinc/14/69/32/994146932.db2.gz CPCDWHVBPKAMEB-QSZRKCJJSA-N -1 3 309.381 3.658 20 10 DHCDHM CO[C@]1(C)CCCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000230300059 1039768793 /nfs/dbraw/zinc/76/87/93/1039768793.db2.gz OVSYDXQJFYLABN-CQSZACIVSA-N -1 3 304.217 3.700 20 10 DHCDHM COc1cccc(Cl)c1CNCc1c([O-])cccc1Cl ZINC000234915634 1032352953 /nfs/dbraw/zinc/35/29/53/1032352953.db2.gz ZEVBBKNEGFFSMN-UHFFFAOYSA-N -1 3 312.196 3.997 20 10 DHCDHM COc1cccc2c(NC(=O)c3cccc(O)c3[O-])cccc12 ZINC001148218866 1032375445 /nfs/dbraw/zinc/37/54/45/1032375445.db2.gz KYKHQBOAYCCMAD-UHFFFAOYSA-N -1 3 309.321 3.512 20 10 DHCDHM O=C(NC1c2ccccc2-c2ccccc21)c1cccc(O)c1[O-] ZINC001148219923 1032375608 /nfs/dbraw/zinc/37/56/08/1032375608.db2.gz GGUZCIPFCAAIPO-UHFFFAOYSA-N -1 3 317.344 3.598 20 10 DHCDHM O=C(Nc1cccc2c(Cl)ccnc12)c1cccc(O)c1[O-] ZINC001148219078 1032375701 /nfs/dbraw/zinc/37/57/01/1032375701.db2.gz RDFIWQSRGBLDIA-UHFFFAOYSA-N -1 3 314.728 3.552 20 10 DHCDHM CC(C)n1cccc(NCc2cc3ccccc3cc2[O-])c1=O ZINC001171406610 1032597742 /nfs/dbraw/zinc/59/77/42/1032597742.db2.gz AWFDBUHGOVINJU-UHFFFAOYSA-N -1 3 308.381 3.900 20 10 DHCDHM C[C@@H]1CCCN(Cc2cc(Br)cc(F)c2[O-])[C@H]1C ZINC000715712544 1018952363 /nfs/dbraw/zinc/95/23/63/1018952363.db2.gz LTBCSRAJMKTZKE-ZJUUUORDSA-N -1 3 316.214 3.914 20 10 DHCDHM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)cc1F ZINC000187060617 1018975549 /nfs/dbraw/zinc/97/55/49/1018975549.db2.gz VHIIGSKTYVEPRB-UHFFFAOYSA-N -1 3 323.389 3.566 20 10 DHCDHM CCn1c2ccccc2nc1CNCc1c([O-])cccc1Cl ZINC000733328121 1020374738 /nfs/dbraw/zinc/37/47/38/1020374738.db2.gz HWHYWVCCFZPIKP-UHFFFAOYSA-N -1 3 315.804 3.705 20 10 DHCDHM O=C1CCc2ccc(NCc3c([O-])cccc3Cl)cc2N1 ZINC000132855431 1020544126 /nfs/dbraw/zinc/54/41/26/1020544126.db2.gz LXVXENKKCIYWKC-UHFFFAOYSA-N -1 3 302.761 3.542 20 10 DHCDHM [O-]c1ccc2oc3c(c2c1CN1CCC(F)(F)C1)CCCC3 ZINC000776291432 1021267281 /nfs/dbraw/zinc/26/72/81/1021267281.db2.gz CJUQADWKZSGMKG-UHFFFAOYSA-N -1 3 307.340 3.858 20 10 DHCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1cccc2ccccc21 ZINC000776314575 1021280878 /nfs/dbraw/zinc/28/08/78/1021280878.db2.gz JSCZHKULVHNEGW-GFCCVEGCSA-N -1 3 307.349 3.742 20 10 DHCDHM C[C@@H](Nc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1[O-] ZINC000170789586 1021554881 /nfs/dbraw/zinc/55/48/81/1021554881.db2.gz IXKRNGLHYXSGJE-CYBMUJFWSA-N -1 3 311.360 3.949 20 10 DHCDHM CCCOC1CCN(Cc2c([O-])ccc(F)c2Cl)CC1 ZINC001237123669 1021703376 /nfs/dbraw/zinc/70/33/76/1021703376.db2.gz FJDCQMZODYQTFS-UHFFFAOYSA-N -1 3 301.789 3.576 20 10 DHCDHM COCCN(CCF)Cc1cc2oc3ccccc3c2cc1[O-] ZINC000853548814 1022292512 /nfs/dbraw/zinc/29/25/12/1022292512.db2.gz QNYFKYXLTGTLEB-UHFFFAOYSA-N -1 3 317.360 3.710 20 10 DHCDHM C[C@H]1c2cccn2CCN1Cc1cc(Br)ccc1[O-] ZINC000179563546 1022473339 /nfs/dbraw/zinc/47/33/39/1022473339.db2.gz URXBIHUDVSXTRQ-NSHDSACASA-N -1 3 321.218 3.533 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)ccc1O ZINC000776748162 1022493096 /nfs/dbraw/zinc/49/30/96/1022493096.db2.gz YIERPDFUJVEQOC-UHFFFAOYSA-N -1 3 319.426 3.799 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc3ccc(O)cc32)c([O-])c1O ZINC000184051634 1022674073 /nfs/dbraw/zinc/67/40/73/1022674073.db2.gz JLVGSBFKZCXKRV-UHFFFAOYSA-N -1 3 309.321 3.517 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](C2CCCCC2)C1 ZINC000856305228 1022792500 /nfs/dbraw/zinc/79/25/00/1022792500.db2.gz MNEIKXNIWQZGLP-AWEZNQCLSA-N -1 3 303.402 3.530 20 10 DHCDHM Cc1nc(C)c([C@@H](C)N(C)Cc2ccc(F)c(F)c2[O-])s1 ZINC000876716378 1033129153 /nfs/dbraw/zinc/12/91/53/1033129153.db2.gz ZEJWJANXOFVPLV-SECBINFHSA-N -1 3 312.385 3.937 20 10 DHCDHM COc1ccc(OC)c([C@@H](C)NCc2cc(F)cc(F)c2[O-])c1 ZINC000882880072 1024157166 /nfs/dbraw/zinc/15/71/66/1024157166.db2.gz AOBOZNTUYVGZID-SNVBAGLBSA-N -1 3 323.339 3.538 20 10 DHCDHM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000790545791 1024328242 /nfs/dbraw/zinc/32/82/42/1024328242.db2.gz FEEVFZXJOBEELR-NSHDSACASA-N -1 3 311.337 3.643 20 10 DHCDHM Cc1csc(C2(NCc3ccc(F)c(F)c3[O-])CCCC2)n1 ZINC000877041834 1033215960 /nfs/dbraw/zinc/21/59/60/1033215960.db2.gz PIGHZAZJMODQSC-UHFFFAOYSA-N -1 3 324.396 3.994 20 10 DHCDHM Cc1n[nH]cc1C1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000793609108 1025124643 /nfs/dbraw/zinc/12/46/43/1025124643.db2.gz OLTGSEWGAQXTQQ-UHFFFAOYSA-N -1 3 323.799 3.596 20 10 DHCDHM C[C@H](NCc1ccccc1OC(F)F)c1c([O-])cccc1F ZINC000886495406 1025652624 /nfs/dbraw/zinc/65/26/24/1025652624.db2.gz XANYMZVIRVWLMZ-JTQLQIEISA-N -1 3 311.303 3.984 20 10 DHCDHM C[C@H](NCc1cccc2c1OCCCO2)c1c([O-])cccc1F ZINC000886553706 1025701478 /nfs/dbraw/zinc/70/14/78/1025701478.db2.gz UAXBJQOFPOGRSX-LBPRGKRZSA-N -1 3 317.360 3.543 20 10 DHCDHM CCCCn1cc(CN[C@@H](C)c2c([O-])cccc2F)c(C)n1 ZINC000886561711 1025707064 /nfs/dbraw/zinc/70/70/64/1025707064.db2.gz HCLKOQPSPRMJHR-ZDUSSCGKSA-N -1 3 305.397 3.687 20 10 DHCDHM COCCOCc1cccc(N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886566473 1025712635 /nfs/dbraw/zinc/71/26/35/1025712635.db2.gz RBNIWTJUPFGGKP-ZDUSSCGKSA-N -1 3 319.376 3.867 20 10 DHCDHM CO[C@H]1Cc2ccc(N[C@@H](C)c3c([O-])cccc3F)cc2C1 ZINC000886589704 1025726033 /nfs/dbraw/zinc/72/60/33/1025726033.db2.gz BXEPLIFEOSICMK-NHYWBVRUSA-N -1 3 301.361 3.818 20 10 DHCDHM CCN(C)C(=O)c1cccc(N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886608889 1025735943 /nfs/dbraw/zinc/73/59/43/1025735943.db2.gz HRXXVQMMDDZQLG-LBPRGKRZSA-N -1 3 316.376 3.796 20 10 DHCDHM COCc1cc(N[C@@H](C)c2c([O-])cccc2F)ccc1OC ZINC000886646724 1025756966 /nfs/dbraw/zinc/75/69/66/1025756966.db2.gz RHQOZKNYZBXBAX-NSHDSACASA-N -1 3 305.349 3.859 20 10 DHCDHM C[C@H](N[C@H]1CCCC1(F)F)c1cc(Br)ccc1[O-] ZINC000806179224 1025836163 /nfs/dbraw/zinc/83/61/63/1025836163.db2.gz BJYVSPBJVKMNEL-UFBFGSQYSA-N -1 3 320.177 3.993 20 10 DHCDHM CCN(C)C(=O)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000808423418 1026272823 /nfs/dbraw/zinc/27/28/23/1026272823.db2.gz BUTHPBFKOBAVPT-UHFFFAOYSA-N -1 3 318.804 3.750 20 10 DHCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)[C@H]1[C@@H]1CCCO1 ZINC000811510320 1027026748 /nfs/dbraw/zinc/02/67/48/1027026748.db2.gz CARXCQXGIJRCOX-ZFWWWQNUSA-N -1 3 313.800 3.574 20 10 DHCDHM COc1cc(Cl)c(NC(=O)c2ccc(C)c(O)c2[O-])cc1C ZINC000813875854 1027743576 /nfs/dbraw/zinc/74/35/76/1027743576.db2.gz SRHIQNAANGYVLH-UHFFFAOYSA-N -1 3 321.760 3.629 20 10 DHCDHM Cc1cc(Br)c([O-])c(CNc2ccc(F)cn2)c1 ZINC000781560284 1028110819 /nfs/dbraw/zinc/11/08/19/1028110819.db2.gz WWEWRXCKSRFLRB-UHFFFAOYSA-N -1 3 311.154 3.609 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@@H](C(C)(C)C)C(F)(F)F)c1[O-] ZINC000779202087 1028698403 /nfs/dbraw/zinc/69/84/03/1028698403.db2.gz HTBWIWMHCSVOHY-ZDUSSCGKSA-N -1 3 321.314 3.801 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC(OCC2CC2)CC1 ZINC000816516226 1028920373 /nfs/dbraw/zinc/92/03/73/1028920373.db2.gz YNLNVXHBAGAZCQ-UHFFFAOYSA-N -1 3 313.800 3.576 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCOCC2(CCCC2)C1 ZINC000816573893 1028951409 /nfs/dbraw/zinc/95/14/09/1028951409.db2.gz PFJPKLLSPRNYKZ-UHFFFAOYSA-N -1 3 313.800 3.577 20 10 DHCDHM C[C@H]1[C@H](C(F)(F)F)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816594755 1028955134 /nfs/dbraw/zinc/95/51/34/1028955134.db2.gz OGSDGCXSWYGKJE-IONNQARKSA-N -1 3 311.706 3.957 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1c(F)cc(F)cc1F ZINC000816651044 1028975354 /nfs/dbraw/zinc/97/53/54/1028975354.db2.gz PVDPNMSMWKORTF-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM CCCCN(C(=O)c1cccc(O)c1[O-])[C@H]1CCC[C@@H](C)C1 ZINC000818802267 1029432123 /nfs/dbraw/zinc/43/21/23/1029432123.db2.gz LKCKWDQXAMDGMG-KGLIPLIRSA-N -1 3 305.418 3.919 20 10 DHCDHM CC[C@H](NCc1cc(C)cc(Br)c1[O-])C(F)F ZINC000824509023 1030579668 /nfs/dbraw/zinc/57/96/68/1030579668.db2.gz JLQZINBWJHOCEV-JTQLQIEISA-N -1 3 308.166 3.596 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1cc(C2CC2)[nH]c1C1CC1 ZINC000928710244 1031364098 /nfs/dbraw/zinc/36/40/98/1031364098.db2.gz RDAGSYSSDXNUCJ-UHFFFAOYSA-N -1 3 314.360 3.544 20 10 DHCDHM C[C@H]1CCCCN1Cc1cc(Br)c(F)cc1[O-] ZINC001144299499 1031439517 /nfs/dbraw/zinc/43/95/17/1031439517.db2.gz YJTUCDMRRIBZJE-VIFPVBQESA-N -1 3 302.187 3.668 20 10 DHCDHM Cc1n[nH]c(C)c1[C@@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000293957524 1031722281 /nfs/dbraw/zinc/72/22/81/1031722281.db2.gz PPRANMTYQSCCQQ-AWEZNQCLSA-N -1 3 323.799 3.862 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@]2(CC2(F)F)C1 ZINC000846105812 1031879086 /nfs/dbraw/zinc/87/90/86/1031879086.db2.gz YPYMCFKEHVCBTA-ZDUSSCGKSA-N -1 3 305.727 3.806 20 10 DHCDHM CCN(Cc1ccccn1)Cc1c([O-])cccc1Br ZINC000862244403 1033794921 /nfs/dbraw/zinc/79/49/21/1033794921.db2.gz NJMZHMZDGCHMRM-UHFFFAOYSA-N -1 3 321.218 3.572 20 10 DHCDHM CC[C@H](C)[C@@H](C(=O)NCc1c([O-])cccc1F)c1ccccc1 ZINC001178412688 1035428961 /nfs/dbraw/zinc/42/89/61/1035428961.db2.gz FCZPKXSBLVWKLI-SCLBCKFNSA-N -1 3 315.388 3.977 20 10 DHCDHM CC(C)N(Cc1ccccn1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775658628 1036269977 /nfs/dbraw/zinc/26/99/77/1036269977.db2.gz QCBUAUVMYLBQSE-UHFFFAOYSA-N -1 3 308.784 3.990 20 10 DHCDHM [O-]c1ccc(F)cc1CN[C@@H](CCc1ccccc1)C(F)F ZINC001182908804 1036484126 /nfs/dbraw/zinc/48/41/26/1036484126.db2.gz AWKFCOQIFLZUIV-HNNXBMFYSA-N -1 3 309.331 3.887 20 10 DHCDHM CC(C)[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CCS1 ZINC000775735748 1036594326 /nfs/dbraw/zinc/59/43/26/1036594326.db2.gz UAPHWWVDKHKOIR-CYBMUJFWSA-N -1 3 303.830 3.758 20 10 DHCDHM CCc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2[O-])cc1C ZINC000775033352 1037443235 /nfs/dbraw/zinc/44/32/35/1037443235.db2.gz MMZLNZNPWCTTBD-UHFFFAOYSA-N -1 3 316.357 3.792 20 10 DHCDHM CC(C)O[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000846016171 1037838159 /nfs/dbraw/zinc/83/81/59/1037838159.db2.gz QHNQRWYBSNNMFY-CYBMUJFWSA-N -1 3 301.789 3.574 20 10 DHCDHM CN(Cc1cc(Cl)c([O-])cc1O)Cc1cccc(F)c1F ZINC001232263568 1039001657 /nfs/dbraw/zinc/00/16/57/1039001657.db2.gz RQNRDDQWJWXTBY-UHFFFAOYSA-N -1 3 313.731 3.661 20 10 DHCDHM CCCOc1ccc(CN2CCCC[C@H]2c2ncc[nH]2)c([O-])c1 ZINC000092729621 185336800 /nfs/dbraw/zinc/33/68/00/185336800.db2.gz CIMGMNBAHWWNSX-INIZCTEOSA-N -1 3 315.417 3.631 20 10 DHCDHM COc1ccccc1[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273372658 130111996 /nfs/dbraw/zinc/11/19/96/130111996.db2.gz GNBVSBBWYNMRCS-NWDGAFQWSA-N -1 3 316.357 3.721 20 10 DHCDHM Cc1cc(Cl)nc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])c1 ZINC000282750266 130938948 /nfs/dbraw/zinc/93/89/48/130938948.db2.gz NSAFBVJFCLCBKY-VIFPVBQESA-N -1 3 312.747 3.878 20 10 DHCDHM C[C@H](N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1[O-] ZINC000286892142 131254558 /nfs/dbraw/zinc/25/45/58/131254558.db2.gz DCSJTRCCGVPGKL-SJCJKPOMSA-N -1 3 320.383 3.624 20 10 DHCDHM CCc1nnc([C@@H](C)N[C@@H](CC)c2cccc(Cl)c2[O-])[nH]1 ZINC000287664681 131293586 /nfs/dbraw/zinc/29/35/86/131293586.db2.gz LWOJAKAAXKNQFR-SKDRFNHKSA-N -1 3 308.813 3.528 20 10 DHCDHM CCc1nnc([C@@H](C)[NH2+][C@@H](CC)c2cccc(Cl)c2[O-])[n-]1 ZINC000287664681 131293587 /nfs/dbraw/zinc/29/35/87/131293587.db2.gz LWOJAKAAXKNQFR-SKDRFNHKSA-N -1 3 308.813 3.528 20 10 DHCDHM CC[C@H](N[C@@H](C)c1nnc2n1CCCCC2)c1ccccc1[O-] ZINC000375875148 332964953 /nfs/dbraw/zinc/96/49/53/332964953.db2.gz NPDHORUTMSUCSE-ZFWWWQNUSA-N -1 3 314.433 3.512 20 10 DHCDHM [O-]c1cccc(Cl)c1CNCc1ccc2c(n1)CCCC2 ZINC000277675103 334090024 /nfs/dbraw/zinc/09/00/24/334090024.db2.gz ISWZHAUJHZROQG-UHFFFAOYSA-N -1 3 302.805 3.609 20 10 DHCDHM C[C@H](N[C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc(F)c(F)c1[O-] ZINC000367578627 336825708 /nfs/dbraw/zinc/82/57/08/336825708.db2.gz WKDJOMKMQVGOHL-AGRCIMAESA-N -1 3 323.314 3.982 20 10 DHCDHM CC[C@H](NCc1nc(C)n2c1CCCC2)c1ccc(F)cc1[O-] ZINC000368616588 336849292 /nfs/dbraw/zinc/84/92/92/336849292.db2.gz DQODLHWYWZPHBN-HNNXBMFYSA-N -1 3 317.408 3.613 20 10 DHCDHM CC[C@@H](N[C@H]1COc2cc(F)cc(F)c21)c1ccccc1[O-] ZINC000372336762 336928564 /nfs/dbraw/zinc/92/85/64/336928564.db2.gz JNXBPSBBSNEQSF-KGLIPLIRSA-N -1 3 305.324 3.845 20 10 DHCDHM [O-]c1ccc(F)cc1CN1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000376164947 337028799 /nfs/dbraw/zinc/02/87/99/337028799.db2.gz HJMCJEWHSFCCKN-AWEZNQCLSA-N -1 3 317.364 3.519 20 10 DHCDHM CC[C@H](c1ccccc1[O-])N1CCn2c(C(C)C)nnc2[C@@H]1C ZINC000377633581 337056992 /nfs/dbraw/zinc/05/69/92/337056992.db2.gz VMNGDBRFWFBBGM-DZGCQCFKSA-N -1 3 314.433 3.635 20 10 DHCDHM CC(C)[C@@]1(CO)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000378129946 337066871 /nfs/dbraw/zinc/06/68/71/337066871.db2.gz MTNONHWAVDTNCB-HNNXBMFYSA-N -1 3 318.244 3.539 20 10 DHCDHM CCCO[C@@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000175659874 337146990 /nfs/dbraw/zinc/14/69/90/337146990.db2.gz HIQAHYBMQYIZRH-MRXNPFEDSA-N -1 3 323.408 3.515 20 10 DHCDHM Cc1cc(Cl)cc(CN2CCCC[C@H]2c2ncc[nH]2)c1[O-] ZINC000179938122 337172675 /nfs/dbraw/zinc/17/26/75/337172675.db2.gz FSQOPVMUSGYYTF-AWEZNQCLSA-N -1 3 305.809 3.804 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)CN(C)C(=O)N2)c1ccc(F)cc1[O-] ZINC000186552758 337257522 /nfs/dbraw/zinc/25/75/22/337257522.db2.gz HGYPCNWWEPDLAT-SNVBAGLBSA-N -1 3 315.348 3.682 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCC(Nc2nccs2)CC1 ZINC000189960074 337284033 /nfs/dbraw/zinc/28/40/33/337284033.db2.gz YMCALRIJLMUHHO-UHFFFAOYSA-N -1 3 323.849 3.579 20 10 DHCDHM COCC1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000156033510 522934559 /nfs/dbraw/zinc/93/45/59/522934559.db2.gz RSHGPCCGYRQNMY-UHFFFAOYSA-N -1 3 304.217 3.557 20 10 DHCDHM COc1ccc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])cc1F ZINC000191192314 524074492 /nfs/dbraw/zinc/07/44/92/524074492.db2.gz MHSZJGATXQMOKM-VIFPVBQESA-N -1 3 311.303 3.669 20 10 DHCDHM C[C@H](N[C@@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)cc1[O-] ZINC000368482634 525593048 /nfs/dbraw/zinc/59/30/48/525593048.db2.gz NVBWUJYGJREPPQ-PUTJDCORSA-N -1 3 305.324 3.843 20 10 DHCDHM C[C@@H](N[C@H]1CN(C)Cc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000364793674 525693076 /nfs/dbraw/zinc/69/30/76/525693076.db2.gz QMKQKUIQGWLGDX-BZNIZROVSA-N -1 3 318.367 3.508 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(OC2CCCC2)CC1 ZINC000179950522 526326371 /nfs/dbraw/zinc/32/63/71/526326371.db2.gz BNIBMKFOOUBUNZ-UHFFFAOYSA-N -1 3 309.837 3.969 20 10 DHCDHM CC[C@@H](NCc1c[nH]nc1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287535711 535805292 /nfs/dbraw/zinc/80/52/92/535805292.db2.gz DUJUSQLMHSBAAT-CYBMUJFWSA-N -1 3 314.216 3.971 20 10 DHCDHM CC[C@@H](N[C@H](C)c1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000272864200 535808598 /nfs/dbraw/zinc/80/85/98/535808598.db2.gz NKPJJLPQIUBTFD-UKRRQHHQSA-N -1 3 314.433 3.512 20 10 DHCDHM CC[C@H](NCc1cccc(N(C)C)n1)c1cccc(Cl)c1[O-] ZINC000287610326 535919595 /nfs/dbraw/zinc/91/95/95/535919595.db2.gz JCGWZDHQBZUOGK-HNNXBMFYSA-N -1 3 319.836 3.748 20 10 DHCDHM COCCc1ccnc(N[C@H](C)c2cc(Cl)ccc2[O-])c1 ZINC000287430599 536831770 /nfs/dbraw/zinc/83/17/70/536831770.db2.gz KMUIOYQKJCZZFL-LLVKDONJSA-N -1 3 306.793 3.803 20 10 DHCDHM O=C([O-])c1coc(C[N@H+](Cc2ccccc2[O-])C2CCCC2)c1 ZINC000740270070 600318177 /nfs/dbraw/zinc/31/81/77/600318177.db2.gz WGTCLQOFJPFUOV-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM O=C([O-])c1coc(C[N@@H+](Cc2ccccc2[O-])C2CCCC2)c1 ZINC000740270070 600318182 /nfs/dbraw/zinc/31/81/82/600318182.db2.gz WGTCLQOFJPFUOV-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM C[C@H]1CCN(Cc2cc(Br)cc(F)c2[O-])[C@@H](C)C1 ZINC000715714123 1018950334 /nfs/dbraw/zinc/95/03/34/1018950334.db2.gz VQUKDHIZYCEVRX-UWVGGRQHSA-N -1 3 316.214 3.914 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@@H](C)CC2)c1[O-] ZINC000192178632 1014710824 /nfs/dbraw/zinc/71/08/24/1014710824.db2.gz QHZXYSHNCYXRAY-JTQLQIEISA-N -1 3 313.850 3.576 20 10 DHCDHM CCCC[N@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccccc1 ZINC001595748136 982417471 /nfs/dbraw/zinc/41/74/71/982417471.db2.gz UIQWWOFVXLQRBV-SFHVURJKSA-N -1 3 313.397 3.820 20 10 DHCDHM CCCC[N@@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccccc1 ZINC001595748136 982417475 /nfs/dbraw/zinc/41/74/75/982417475.db2.gz UIQWWOFVXLQRBV-SFHVURJKSA-N -1 3 313.397 3.820 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc(C(=O)[O-])ccc1O)c1ccc(F)cc1F ZINC001593354316 994989192 /nfs/dbraw/zinc/98/91/92/994989192.db2.gz MISURDIBVIRIOU-ZJUUUORDSA-N -1 3 321.323 3.780 20 10 DHCDHM CC(C)[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CCS1 ZINC000775735749 1036592550 /nfs/dbraw/zinc/59/25/50/1036592550.db2.gz UAPHWWVDKHKOIR-ZDUSSCGKSA-N -1 3 303.830 3.758 20 10 DHCDHM C[C@@H](Nc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1[O-] ZINC000320429446 1016635211 /nfs/dbraw/zinc/63/52/11/1016635211.db2.gz AKBHXIHROOKLGC-CYBMUJFWSA-N -1 3 316.376 3.541 20 10 DHCDHM CC[C@@H]1CO[C@](C)(CCC(C)C)N1C(=O)c1cccc(O)c1[O-] ZINC001148218574 1032375377 /nfs/dbraw/zinc/37/53/77/1032375377.db2.gz GDBBULIZTGKCRO-FZKQIMNGSA-N -1 3 321.417 3.501 20 10 DHCDHM CC[C@@H](C)c1ccc(NC(=O)c2cc(O)c([O-])c(O)c2)cc1 ZINC001148580706 1032421179 /nfs/dbraw/zinc/42/11/79/1032421179.db2.gz KJWPLEBFTUWHIA-SNVBAGLBSA-N -1 3 301.342 3.569 20 10 DHCDHM CC[C@H](NCc1nnc(C2CC2)s1)c1ccc(F)cc1[O-] ZINC000840892404 1017415516 /nfs/dbraw/zinc/41/55/16/1017415516.db2.gz ZPTWUFNMWCJIOG-LBPRGKRZSA-N -1 3 307.394 3.501 20 10 DHCDHM C[C@@H](NCc1ccn(C2CCCC2)n1)c1ccc(F)cc1[O-] ZINC000186138141 1017907508 /nfs/dbraw/zinc/90/75/08/1017907508.db2.gz BYNJFFAKPOEOKP-GFCCVEGCSA-N -1 3 303.381 3.694 20 10 DHCDHM C[C@@H]1C[C@@H](C)CCN1Cc1cc(Br)cc(F)c1[O-] ZINC000715714125 1018951827 /nfs/dbraw/zinc/95/18/27/1018951827.db2.gz VQUKDHIZYCEVRX-VHSXEESVSA-N -1 3 316.214 3.914 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1noc2cc(F)ccc21 ZINC001203458257 1019219538 /nfs/dbraw/zinc/21/95/38/1019219538.db2.gz ZBUSBKFKYPVOLZ-UHFFFAOYSA-N -1 3 324.714 3.755 20 10 DHCDHM COc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1NC(C)=O ZINC000186315718 1020236035 /nfs/dbraw/zinc/23/60/35/1020236035.db2.gz WKHYACFHJUVCJE-JTQLQIEISA-N -1 3 318.348 3.671 20 10 DHCDHM COc1ccc(NCc2cc(Cl)c3cccnc3c2[O-])cn1 ZINC001168523041 1021208559 /nfs/dbraw/zinc/20/85/59/1021208559.db2.gz YRWRKKYAVZKDMV-UHFFFAOYSA-N -1 3 315.760 3.610 20 10 DHCDHM CO[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001237087324 1021671464 /nfs/dbraw/zinc/67/14/64/1021671464.db2.gz VCYDDNRFBHROLJ-VHSXEESVSA-N -1 3 304.217 3.698 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2ccccc2F)C1 ZINC000130742210 1022226347 /nfs/dbraw/zinc/22/63/47/1022226347.db2.gz FNSDBPMSYRUOQI-KRWDZBQOSA-N -1 3 321.779 3.758 20 10 DHCDHM O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1cccc(O)c1[O-] ZINC000776648647 1022245062 /nfs/dbraw/zinc/24/50/62/1022245062.db2.gz UZSHGYZUSHSBID-INIZCTEOSA-N -1 3 315.344 3.508 20 10 DHCDHM O=C(Nc1ccccc1OC1CCCC1)c1cccc(O)c1[O-] ZINC000188217972 1022750280 /nfs/dbraw/zinc/75/02/80/1022750280.db2.gz FBWBIJODCPXVGG-UHFFFAOYSA-N -1 3 313.353 3.672 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000768424101 1022965060 /nfs/dbraw/zinc/96/50/60/1022965060.db2.gz BXAHPEQTZAFCDW-QGZVFWFLSA-N -1 3 321.779 3.758 20 10 DHCDHM Cc1nc2sccn2c1CN(C)Cc1c([O-])cccc1Cl ZINC000769310820 1023117595 /nfs/dbraw/zinc/11/75/95/1023117595.db2.gz ZFPSZIGAUCWLFG-UHFFFAOYSA-N -1 3 321.833 3.695 20 10 DHCDHM C[C@@]1(c2ccccc2)CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000769399879 1023139442 /nfs/dbraw/zinc/13/94/42/1023139442.db2.gz WOHDAOJGPPYFDP-SFHVURJKSA-N -1 3 317.816 3.793 20 10 DHCDHM Cc1ccccc1[C@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000769446717 1023156417 /nfs/dbraw/zinc/15/64/17/1023156417.db2.gz SGLGHFQVKWKELC-GOSISDBHSA-N -1 3 317.816 3.928 20 10 DHCDHM Cc1c([C@@H]2CCCN2Cc2c([O-])ccc(Cl)c2F)cnn1C ZINC000364473699 1023221597 /nfs/dbraw/zinc/22/15/97/1023221597.db2.gz ULOMEHKWZSKEHX-AWEZNQCLSA-N -1 3 323.799 3.564 20 10 DHCDHM Cc1noc([C@H]2CCCCN2Cc2cc(Cl)c(C)cc2[O-])n1 ZINC000825892731 1033122403 /nfs/dbraw/zinc/12/24/03/1033122403.db2.gz IBODFRFFYTZZIN-CQSZACIVSA-N -1 3 321.808 3.773 20 10 DHCDHM COc1ccc(F)cc1[C@@H](C)NCc1ccc(F)c(F)c1[O-] ZINC000876942119 1033190591 /nfs/dbraw/zinc/19/05/91/1033190591.db2.gz UTISUIMPZUDUHY-SECBINFHSA-N -1 3 311.303 3.669 20 10 DHCDHM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000790545790 1024329240 /nfs/dbraw/zinc/32/92/40/1024329240.db2.gz FEEVFZXJOBEELR-LLVKDONJSA-N -1 3 311.337 3.643 20 10 DHCDHM CSc1cc(CNCc2c([O-])ccc(Cl)c2F)ccn1 ZINC000790981315 1024423426 /nfs/dbraw/zinc/42/34/26/1024423426.db2.gz ICSXAGLFUZFGED-UHFFFAOYSA-N -1 3 312.797 3.591 20 10 DHCDHM CCc1cnccc1[C@H](C)NCc1c([O-])ccc(Cl)c1F ZINC000790980662 1024424057 /nfs/dbraw/zinc/42/40/57/1024424057.db2.gz BOZJVLXOCLJIEI-JTQLQIEISA-N -1 3 308.784 3.993 20 10 DHCDHM Cc1ccc(NCc2c([O-])ccc(Cl)c2F)c(N(C)C)n1 ZINC000790982868 1024426016 /nfs/dbraw/zinc/42/60/16/1024426016.db2.gz LENSJSHZHHGXPF-UHFFFAOYSA-N -1 3 309.772 3.566 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(c2ccccn2)CC1 ZINC000792167360 1024641203 /nfs/dbraw/zinc/64/12/03/1024641203.db2.gz PLFVXWPOUIVMLL-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM CN(Cc1ccccc1O)C(=O)c1cc([O-])c2ccccc2c1 ZINC000792226316 1024650524 /nfs/dbraw/zinc/65/05/24/1024650524.db2.gz QTQHBDSQYLFCEY-UHFFFAOYSA-N -1 3 307.349 3.523 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@@H]1[C@@H]1CCCO1 ZINC000793608000 1025127224 /nfs/dbraw/zinc/12/72/24/1025127224.db2.gz HAIWNCPQKFLDEK-KGLIPLIRSA-N -1 3 316.228 3.842 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCCO[C@@H](c2ccccc2)C1 ZINC000893995484 1025639574 /nfs/dbraw/zinc/63/95/74/1025639574.db2.gz LWLBQVFRGHZCBY-QGZVFWFLSA-N -1 3 319.351 3.634 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCC(OC2CCCC2)CC1 ZINC000893986123 1025642301 /nfs/dbraw/zinc/64/23/01/1025642301.db2.gz KDYKUGQAJMCALL-UHFFFAOYSA-N -1 3 311.372 3.594 20 10 DHCDHM C[C@@H](N[C@H]1CCOc2ccc(F)cc21)c1c([O-])cccc1F ZINC000886547312 1025693843 /nfs/dbraw/zinc/69/38/43/1025693843.db2.gz IZXKZPNGMAHXOM-YGRLFVJLSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](N[C@@H]1COc2ccc(Cl)cc21)c1c([O-])cccc1F ZINC000886552117 1025699875 /nfs/dbraw/zinc/69/98/75/1025699875.db2.gz UYKXQCDCOZHNLW-NOZJJQNGSA-N -1 3 307.752 3.969 20 10 DHCDHM CCOc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1CO ZINC000886583931 1025719427 /nfs/dbraw/zinc/71/94/27/1025719427.db2.gz FZDBAYLXSSSYLN-LLVKDONJSA-N -1 3 305.349 3.595 20 10 DHCDHM COCCOc1ccc(F)cc1N[C@H](C)c1c([O-])cccc1F ZINC000886584031 1025719486 /nfs/dbraw/zinc/71/94/86/1025719486.db2.gz HMKJEGMFAPBFKR-LLVKDONJSA-N -1 3 323.339 3.869 20 10 DHCDHM CO[C@@H]1Cc2ccc(N[C@@H](C)c3c([O-])cccc3F)cc2C1 ZINC000886589705 1025727999 /nfs/dbraw/zinc/72/79/99/1025727999.db2.gz BXEPLIFEOSICMK-XHDPSFHLSA-N -1 3 301.361 3.818 20 10 DHCDHM C[C@H](Nc1cccc([C@H]2CCC(=O)N2)c1)c1c([O-])cccc1F ZINC000886626578 1025746397 /nfs/dbraw/zinc/74/63/97/1025746397.db2.gz GHFXAWQQZUHFOG-XHDPSFHLSA-N -1 3 314.360 3.656 20 10 DHCDHM COCc1cc(N[C@H](C)c2c([O-])cccc2F)ccc1OC ZINC000886646723 1025757505 /nfs/dbraw/zinc/75/75/05/1025757505.db2.gz RHQOZKNYZBXBAX-LLVKDONJSA-N -1 3 305.349 3.859 20 10 DHCDHM C[C@@H](Nc1cccc2c1OCCCO2)c1c([O-])cccc1F ZINC000886648331 1025759979 /nfs/dbraw/zinc/75/99/79/1025759979.db2.gz QJAOBIZJCWNRQW-LLVKDONJSA-N -1 3 303.333 3.866 20 10 DHCDHM CCc1cnc(CN(C)Cc2c([O-])ccc3ccncc32)s1 ZINC000747471103 1026240948 /nfs/dbraw/zinc/24/09/48/1026240948.db2.gz DPAZFBXOSYIFKM-UHFFFAOYSA-N -1 3 313.426 3.591 20 10 DHCDHM Cc1nc2sccn2c1CN(C)Cc1cccc(Cl)c1[O-] ZINC000271737541 1027131128 /nfs/dbraw/zinc/13/11/28/1027131128.db2.gz PHAXCDICKDAKKD-UHFFFAOYSA-N -1 3 321.833 3.695 20 10 DHCDHM COc1cc(NCc2c([O-])cccc2Cl)cc(OC)c1C ZINC000814300816 1028002910 /nfs/dbraw/zinc/00/29/10/1028002910.db2.gz QEVFWVCXBNDFQU-UHFFFAOYSA-N -1 3 307.777 3.983 20 10 DHCDHM C[C@@H](NCc1nccs1)c1cccc(C(F)(F)F)c1[O-] ZINC000815563065 1028544955 /nfs/dbraw/zinc/54/49/55/1028544955.db2.gz SRXMPBIRUQKQDB-MRVPVSSYSA-N -1 3 302.321 3.718 20 10 DHCDHM Cc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2[O-])on1 ZINC000815576672 1028550851 /nfs/dbraw/zinc/55/08/51/1028550851.db2.gz WBKPXUKWPKUGRU-SECBINFHSA-N -1 3 300.280 3.558 20 10 DHCDHM COc1ccc(F)cc1CNCc1cc(Cl)cc(F)c1[O-] ZINC000779185316 1028644660 /nfs/dbraw/zinc/64/46/60/1028644660.db2.gz DBTGDRBEUKXXEQ-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM Cc1nc2cc(NCc3cc(Cl)c(F)cc3[O-])ccc2n1C ZINC000816564170 1028945421 /nfs/dbraw/zinc/94/54/21/1028945421.db2.gz WXUQLDSDKFDZIZ-UHFFFAOYSA-N -1 3 319.767 3.992 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H](O)c2ccccc2C1 ZINC000373822015 1029825176 /nfs/dbraw/zinc/82/51/76/1029825176.db2.gz WLXNYRPXQDWFMH-INIZCTEOSA-N -1 3 321.779 3.624 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@H]2c2ncc[nH]2)cc1Cl ZINC000824649907 1030600604 /nfs/dbraw/zinc/60/06/04/1030600604.db2.gz IYOOEYZVRXNYSF-AWEZNQCLSA-N -1 3 305.809 3.804 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000928710925 1031362295 /nfs/dbraw/zinc/36/22/95/1031362295.db2.gz XQODCWHJMUKAIV-KOLCDFICSA-N -1 3 319.298 3.516 20 10 DHCDHM CCC1(C(=O)NCc2c([O-])cccc2F)CCC(F)(F)CC1 ZINC000928710036 1031363087 /nfs/dbraw/zinc/36/30/87/1031363087.db2.gz GJZIJGDLTHRBDT-UHFFFAOYSA-N -1 3 315.335 3.753 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)C1CCC(C(F)(F)F)CC1 ZINC000928708772 1031364172 /nfs/dbraw/zinc/36/41/72/1031364172.db2.gz TXDUSOZVYKPHSZ-UHFFFAOYSA-N -1 3 319.298 3.516 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000928712920 1031366775 /nfs/dbraw/zinc/36/67/75/1031366775.db2.gz XQODCWHJMUKAIV-MWLCHTKSSA-N -1 3 319.298 3.516 20 10 DHCDHM CN(Cc1cc(Br)c(F)cc1[O-])C1CC(F)(F)C1 ZINC001144298940 1031438827 /nfs/dbraw/zinc/43/88/27/1031438827.db2.gz MHWLGJWABJSWMM-UHFFFAOYSA-N -1 3 324.140 3.523 20 10 DHCDHM C[C@@H]1CCCN(Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144299035 1031439972 /nfs/dbraw/zinc/43/99/72/1031439972.db2.gz PKWBEFNLMVUDJD-SECBINFHSA-N -1 3 302.187 3.526 20 10 DHCDHM CCc1nc([C@H]2CCCCN2Cc2cc(Cl)ccc2[O-])no1 ZINC000361157563 1031761594 /nfs/dbraw/zinc/76/15/94/1031761594.db2.gz PHVCUNALISAUOH-CYBMUJFWSA-N -1 3 321.808 3.718 20 10 DHCDHM C[C@H](CO)C1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000846059180 1031817013 /nfs/dbraw/zinc/81/70/13/1031817013.db2.gz ZWXUSMFXRBXHEU-SNVBAGLBSA-N -1 3 318.244 3.539 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CC[C@]2(CC2(F)F)C1 ZINC000846118815 1031865520 /nfs/dbraw/zinc/86/55/20/1031865520.db2.gz ZFTXJXSSAQRPPY-LBPRGKRZSA-N -1 3 308.155 3.930 20 10 DHCDHM CC(C)(O)C1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000877754225 1033431758 /nfs/dbraw/zinc/43/17/58/1033431758.db2.gz XVXCGFAUMFALLP-UHFFFAOYSA-N -1 3 318.244 3.682 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@H](C)c2ccc(F)cc2[O-])o1 ZINC000185548076 1034556675 /nfs/dbraw/zinc/55/66/75/1034556675.db2.gz LUROQLKHYMCTGT-IAQYHMDHSA-N -1 3 307.365 3.725 20 10 DHCDHM C[C@@H](Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(F)cc1[O-] ZINC000186320814 1034619222 /nfs/dbraw/zinc/61/92/22/1034619222.db2.gz VSJBPTJLLSSDQG-MLGOLLRUSA-N -1 3 317.360 3.872 20 10 DHCDHM CC[C@@H](NC(=S)NCc1c([O-])cccc1F)c1cccs1 ZINC000905662097 1035599880 /nfs/dbraw/zinc/59/98/80/1035599880.db2.gz RTYUEUQIYXYFOF-GFCCVEGCSA-N -1 3 324.446 3.708 20 10 DHCDHM CC(C)(C)COC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001194404718 1035922397 /nfs/dbraw/zinc/92/23/97/1035922397.db2.gz UBKWYBPOLZBRRB-UHFFFAOYSA-N -1 3 322.792 3.866 20 10 DHCDHM COCCN(Cc1ccccc1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775642832 1036160631 /nfs/dbraw/zinc/16/06/31/1036160631.db2.gz PBWAGCRLVLNHMH-UHFFFAOYSA-N -1 3 323.795 3.833 20 10 DHCDHM COc1ccccc1CN(C)Cc1cc(Cl)cc(F)c1[O-] ZINC000775641517 1036161851 /nfs/dbraw/zinc/16/18/51/1036161851.db2.gz BVXJBIZJPMYWAR-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM C[C@H](NCc1ccc2c(n1)CCCC2)c1cc(F)cc(F)c1[O-] ZINC000774441505 1036332124 /nfs/dbraw/zinc/33/21/24/1036332124.db2.gz JRDHVWHMMNOAFH-NSHDSACASA-N -1 3 318.367 3.795 20 10 DHCDHM COc1cc(NCc2cccc(F)c2[O-])cc(Cl)c1OC ZINC001182625493 1036404836 /nfs/dbraw/zinc/40/48/36/1036404836.db2.gz QTBSNARZDQBQNP-UHFFFAOYSA-N -1 3 311.740 3.814 20 10 DHCDHM CCCNC(=O)c1ccc(NCc2ccc(Cl)cc2[O-])cc1 ZINC001182645821 1036419002 /nfs/dbraw/zinc/41/90/02/1036419002.db2.gz VDHGPKAVEKZKMO-UHFFFAOYSA-N -1 3 318.804 3.798 20 10 DHCDHM [O-]c1c(Br)cccc1CNCc1ccc(Cl)o1 ZINC000698071501 1036683287 /nfs/dbraw/zinc/68/32/87/1036683287.db2.gz ADZRRBQVVNIBDF-UHFFFAOYSA-N -1 3 316.582 3.691 20 10 DHCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000151872435 1036693479 /nfs/dbraw/zinc/69/34/79/1036693479.db2.gz PAMYWKWGINCULG-UHFFFAOYSA-N -1 3 319.426 3.700 20 10 DHCDHM CCCc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2[O-])cc1 ZINC000774916057 1037217663 /nfs/dbraw/zinc/21/76/63/1037217663.db2.gz PZIKJNOVCIJZDD-UHFFFAOYSA-N -1 3 316.357 3.874 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCCCC(F)(F)C1 ZINC001203636388 1037365665 /nfs/dbraw/zinc/36/56/65/1037365665.db2.gz VYAFEILBPNNUHJ-UHFFFAOYSA-N -1 3 320.177 3.776 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1c(F)c(F)cc(F)c1F ZINC001200932983 1037469027 /nfs/dbraw/zinc/46/90/27/1037469027.db2.gz SKGOLDQVDSFYHM-UHFFFAOYSA-N -1 3 321.220 3.517 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@H](CC(F)(F)F)C1 ZINC000775137805 1037692650 /nfs/dbraw/zinc/69/26/50/1037692650.db2.gz QJKUZVRGZYIFNM-MRVPVSSYSA-N -1 3 311.706 3.959 20 10 DHCDHM [O-]c1c(CNc2cccn3ccnc23)cc(Cl)c2cccnc12 ZINC001168521749 1037979578 /nfs/dbraw/zinc/97/95/78/1037979578.db2.gz IYGWZUJAONXSNF-UHFFFAOYSA-N -1 3 324.771 3.854 20 10 DHCDHM Cc1c(C)c([N-]S(=O)(=O)c2ccc(C3CC3)cc2)ccc1O ZINC001190499765 1038326985 /nfs/dbraw/zinc/32/69/85/1038326985.db2.gz HEQRZFQATZHGDX-UHFFFAOYSA-N -1 3 317.410 3.687 20 10 DHCDHM CC(=O)Nc1cc(N[C@H](C)c2ccc(F)cc2[O-])ccc1C ZINC000170789437 1038965137 /nfs/dbraw/zinc/96/51/37/1038965137.db2.gz BAHPHGOAHYKCSV-LLVKDONJSA-N -1 3 302.349 3.971 20 10 DHCDHM Cc1n[nH]cc1CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000273353127 130108928 /nfs/dbraw/zinc/10/89/28/130108928.db2.gz CFSMZTQTSBDXJJ-MRVPVSSYSA-N -1 3 300.189 3.581 20 10 DHCDHM Cc1n[nH]cc1CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000273353130 130109787 /nfs/dbraw/zinc/10/97/87/130109787.db2.gz CFSMZTQTSBDXJJ-QMMMGPOBSA-N -1 3 300.189 3.581 20 10 DHCDHM COc1ccc(CN[C@H](C)c2cc(Cl)ccc2[O-])c(OC)c1 ZINC000273380869 130114812 /nfs/dbraw/zinc/11/48/12/130114812.db2.gz IFYNOPSSPNUNRC-LLVKDONJSA-N -1 3 321.804 3.914 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cn[nH]c1 ZINC000273484364 130126703 /nfs/dbraw/zinc/12/67/03/130126703.db2.gz MYOHAJDUFMCQNI-HTQZYQBOSA-N -1 3 300.189 3.834 20 10 DHCDHM C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273569539 130138179 /nfs/dbraw/zinc/13/81/79/130138179.db2.gz KISFPESYZRGHTF-QLJPJBMISA-N -1 3 316.332 3.778 20 10 DHCDHM COc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])CCO2 ZINC000274359300 130229161 /nfs/dbraw/zinc/22/91/61/130229161.db2.gz IAGJGQDODYDHAC-ZBEGNZNMSA-N -1 3 317.360 3.714 20 10 DHCDHM CCc1nnc([C@H](C)N[C@H](CC)c2cccc(Cl)c2[O-])[nH]1 ZINC000287664676 131293711 /nfs/dbraw/zinc/29/37/11/131293711.db2.gz LWOJAKAAXKNQFR-JOYOIKCWSA-N -1 3 308.813 3.528 20 10 DHCDHM CCc1nnc([C@H](C)[NH2+][C@H](CC)c2cccc(Cl)c2[O-])[n-]1 ZINC000287664676 131293713 /nfs/dbraw/zinc/29/37/13/131293713.db2.gz LWOJAKAAXKNQFR-JOYOIKCWSA-N -1 3 308.813 3.528 20 10 DHCDHM Cc1c(N[C@H](C)c2ccc(F)cc2[O-])cnn1C1CCOCC1 ZINC000297361584 132012291 /nfs/dbraw/zinc/01/22/91/132012291.db2.gz PUFRWBFFFXDZBT-LLVKDONJSA-N -1 3 319.380 3.561 20 10 DHCDHM Cc1ccc(C(=O)N(C)C)cc1N[C@@H](C)c1ccc(F)cc1[O-] ZINC000170789189 332636375 /nfs/dbraw/zinc/63/63/75/332636375.db2.gz HCRJXIULNVDCLP-LBPRGKRZSA-N -1 3 316.376 3.715 20 10 DHCDHM CC[C@H](N[C@@H]1COc2cccc(F)c21)c1ccc(F)cc1[O-] ZINC000367620534 336826795 /nfs/dbraw/zinc/82/67/95/336826795.db2.gz YFCUKPDANWSEQX-UONOGXRCSA-N -1 3 305.324 3.845 20 10 DHCDHM Cc1cc([C@@H]2CCCN(Cc3c([O-])ccc(Cl)c3F)C2)n[nH]1 ZINC000375985265 337024695 /nfs/dbraw/zinc/02/46/95/337024695.db2.gz MAXYSAOHFAYXCE-LLVKDONJSA-N -1 3 323.799 3.596 20 10 DHCDHM Cc1cc([C@@H]2CCCN(Cc3c([O-])ccc(Cl)c3F)C2)[nH]n1 ZINC000375985265 337024696 /nfs/dbraw/zinc/02/46/96/337024696.db2.gz MAXYSAOHFAYXCE-LLVKDONJSA-N -1 3 323.799 3.596 20 10 DHCDHM Cc1csc(C2CCN(Cc3cccc(F)c3[O-])CC2)n1 ZINC000378488399 337074070 /nfs/dbraw/zinc/07/40/70/337074070.db2.gz AMGQSFXBXKOJNA-UHFFFAOYSA-N -1 3 306.406 3.676 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc(C)c(-c3ncco3)c2)c([O-])c1O ZINC000182823027 337188480 /nfs/dbraw/zinc/18/84/80/337188480.db2.gz KXVXXUOFEPCTLC-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccccc1[O-])c1noc(-c2ccccc2)n1 ZINC000183562745 337192269 /nfs/dbraw/zinc/19/22/69/337192269.db2.gz VMFWGGQNAVLECS-CHWSQXEVSA-N -1 3 309.369 3.854 20 10 DHCDHM CC(C)COC[C@@H](NCc1cc(F)ccc1[O-])c1ccco1 ZINC000180561478 519755193 /nfs/dbraw/zinc/75/51/93/519755193.db2.gz VJURYQPEEGJMAM-OAHLLOKOSA-N -1 3 307.365 3.628 20 10 DHCDHM CCN(Cc1cccc(F)c1[O-])[C@@H]1CCCc2cccnc21 ZINC000365002904 521350198 /nfs/dbraw/zinc/35/01/98/521350198.db2.gz PTHAVALKGGOZSY-MRXNPFEDSA-N -1 3 300.377 3.826 20 10 DHCDHM CCn1ncc2c1CCC[C@H]2N[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000364797308 523696921 /nfs/dbraw/zinc/69/69/21/523696921.db2.gz GUTMWPIDYKCBJU-IINYFYTJSA-N -1 3 321.371 3.615 20 10 DHCDHM CCc1ccc([C@@H](COC)NCc2cccc(Cl)c2[O-])o1 ZINC000182224257 524032462 /nfs/dbraw/zinc/03/24/62/524032462.db2.gz FKJLGAASMYHGIZ-CQSZACIVSA-N -1 3 309.793 3.678 20 10 DHCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](c2ccsc2)O1 ZINC000180223338 524988517 /nfs/dbraw/zinc/98/85/17/524988517.db2.gz KAVPSZNBLCOJHS-BDJLRTHQSA-N -1 3 307.390 3.555 20 10 DHCDHM C[C@@H](NCc1cc(F)ccc1[O-])c1nc(C2CCCCC2)no1 ZINC000191577052 525513571 /nfs/dbraw/zinc/51/35/71/525513571.db2.gz GTLJTPUGDVVMSO-LLVKDONJSA-N -1 3 319.380 3.813 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@H]2COc3cc(F)cc(F)c32)c([O-])c1 ZINC000368212364 525749541 /nfs/dbraw/zinc/74/95/41/525749541.db2.gz NAIQTOMNGVFCIQ-YGRLFVJLSA-N -1 3 305.324 3.763 20 10 DHCDHM CC[C@@H](NCc1cc(F)cnc1Cl)c1ccc(F)cc1[O-] ZINC000297300624 535805580 /nfs/dbraw/zinc/80/55/80/535805580.db2.gz MJERQFZFFTVIHD-CYBMUJFWSA-N -1 3 312.747 3.960 20 10 DHCDHM CC[C@@H](N[C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1[O-] ZINC000285986886 535808190 /nfs/dbraw/zinc/80/81/90/535808190.db2.gz HWWVAPKCJWFLPP-CABCVRRESA-N -1 3 307.365 3.861 20 10 DHCDHM CC[C@@H](N[C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1[O-] ZINC000286127156 535808740 /nfs/dbraw/zinc/80/87/40/535808740.db2.gz NWWJLYPPFKAYFU-ZWNOBZJWSA-N -1 3 306.385 3.575 20 10 DHCDHM CC[C@H](N[C@H](COC)c1ccccc1)c1ccc(F)cc1[O-] ZINC000286000721 535944641 /nfs/dbraw/zinc/94/46/41/535944641.db2.gz HNMDYOZIGJDLDO-DLBZAZTESA-N -1 3 303.377 3.960 20 10 DHCDHM CCC[N@H+](Cc1cc(C(=O)[O-])sc1C)Cc1ccccc1[O-] ZINC000829496695 601626538 /nfs/dbraw/zinc/62/65/38/601626538.db2.gz NPPFZAONHMVWTC-UHFFFAOYSA-N -1 3 319.426 3.873 20 10 DHCDHM CCC[N@@H+](Cc1cc(C(=O)[O-])sc1C)Cc1ccccc1[O-] ZINC000829496695 601626539 /nfs/dbraw/zinc/62/65/39/601626539.db2.gz NPPFZAONHMVWTC-UHFFFAOYSA-N -1 3 319.426 3.873 20 10 DHCDHM CC(C)(C)[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)[O-] ZINC000833426517 605752838 /nfs/dbraw/zinc/75/28/38/605752838.db2.gz NZOBJLQUQHIKHP-QGZVFWFLSA-N -1 3 313.397 3.648 20 10 DHCDHM Cc1c([O-])ccc2c(CSc3nccs3)cc(=O)oc12 ZINC000048874577 1013526773 /nfs/dbraw/zinc/52/67/73/1013526773.db2.gz ZBEXCHZVCUSDRJ-UHFFFAOYSA-N -1 3 305.380 3.556 20 10 DHCDHM CCCCN(Cc1ccccc1O)[C@@H](C(=O)[O-])c1ccsc1 ZINC001595747850 982415855 /nfs/dbraw/zinc/41/58/55/982415855.db2.gz KLPZBMNVMPUZHY-MRXNPFEDSA-N -1 3 319.426 3.882 20 10 DHCDHM CCCC[N@H+](Cc1cccc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC001595749322 982422609 /nfs/dbraw/zinc/42/26/09/982422609.db2.gz XMVHEDSWHBHGOV-UHFFFAOYSA-N -1 3 313.397 3.893 20 10 DHCDHM CCCC[N@@H+](Cc1cccc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC001595749322 982422612 /nfs/dbraw/zinc/42/26/12/982422612.db2.gz XMVHEDSWHBHGOV-UHFFFAOYSA-N -1 3 313.397 3.893 20 10 DHCDHM CCN(Cc1cc(Br)ccc1[O-])CC(F)(F)F ZINC000076118455 1015097440 /nfs/dbraw/zinc/09/74/40/1015097440.db2.gz UGLZAHFLMCEBJL-UHFFFAOYSA-N -1 3 312.129 3.539 20 10 DHCDHM CC[C@@H](C)c1nnc([C@@H](C)NCc2cccc(Cl)c2[O-])[nH]1 ZINC000276833263 1015695296 /nfs/dbraw/zinc/69/52/96/1015695296.db2.gz BOVQARZGLAAJLR-NXEZZACHSA-N -1 3 308.813 3.528 20 10 DHCDHM C[C@H]([NH2+][C@@H](C)C1CCC(F)CC1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593195272 994147052 /nfs/dbraw/zinc/14/70/52/994147052.db2.gz CPCDWHVBPKAMEB-PZFKGIAWSA-N -1 3 309.381 3.658 20 10 DHCDHM C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593299002 994717951 /nfs/dbraw/zinc/71/79/51/994717951.db2.gz PCFWSBNDDMOWQO-SNVBAGLBSA-N -1 3 305.761 3.595 20 10 DHCDHM C[C@H](Nc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1[O-] ZINC000320429449 1016634496 /nfs/dbraw/zinc/63/44/96/1016634496.db2.gz AKBHXIHROOKLGC-ZDUSSCGKSA-N -1 3 316.376 3.541 20 10 DHCDHM C[C@@H](NCc1nc2c(s1)CCCC2)c1c([O-])cccc1F ZINC000926920290 1032774419 /nfs/dbraw/zinc/77/44/19/1032774419.db2.gz UHAVYRRRUJKDFB-SNVBAGLBSA-N -1 3 306.406 3.717 20 10 DHCDHM C[C@@H]1CCCN(Cc2cc(Br)cc(F)c2[O-])[C@@H]1C ZINC000715712538 1018950854 /nfs/dbraw/zinc/95/08/54/1018950854.db2.gz LTBCSRAJMKTZKE-NXEZZACHSA-N -1 3 316.214 3.914 20 10 DHCDHM Cc1cc([O-])c(CNCc2nc3c(s2)CCCC3)c(Cl)c1 ZINC000922697504 1020220174 /nfs/dbraw/zinc/22/01/74/1020220174.db2.gz UPSCPBKZILNUIS-UHFFFAOYSA-N -1 3 322.861 3.979 20 10 DHCDHM C[C@@H](Nc1cncc(Br)c1)c1ccc(F)cc1[O-] ZINC000186360461 1020263140 /nfs/dbraw/zinc/26/31/40/1020263140.db2.gz VNOCHQNOQBCRMK-MRVPVSSYSA-N -1 3 311.154 3.862 20 10 DHCDHM CCCn1ccc2cc(NC(=O)c3cccc(O)c3[O-])ccc21 ZINC000776342732 1021297301 /nfs/dbraw/zinc/29/73/01/1021297301.db2.gz IINXWIFWLKBKLC-UHFFFAOYSA-N -1 3 310.353 3.715 20 10 DHCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@@]2(C1)CCCCO2 ZINC001237078621 1021633687 /nfs/dbraw/zinc/63/36/87/1021633687.db2.gz VLJDETZUCPBRBT-OAHLLOKOSA-N -1 3 316.228 3.844 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC=C(C(C)(C)C)CC2)c1[O-] ZINC001168931983 1022186808 /nfs/dbraw/zinc/18/68/08/1022186808.db2.gz JJDAHQUGWJTKHU-UHFFFAOYSA-N -1 3 305.393 3.912 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)cc(Cl)c2[O-])CCCO1 ZINC000312105431 1022205547 /nfs/dbraw/zinc/20/55/47/1022205547.db2.gz WNIBHDPRCHCGEE-UHFFFAOYSA-N -1 3 304.217 3.700 20 10 DHCDHM [O-]c1c(CNc2cccn3cncc23)cc(Cl)c2cccnc12 ZINC001168525373 1022296707 /nfs/dbraw/zinc/29/67/07/1022296707.db2.gz BSCOOEQCLYQOGE-UHFFFAOYSA-N -1 3 324.771 3.854 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@@H]2c2cc[nH]n2)cc1Cl ZINC000825882258 1033086814 /nfs/dbraw/zinc/08/68/14/1033086814.db2.gz HEVPRFPFVRFULR-OAHLLOKOSA-N -1 3 305.809 3.804 20 10 DHCDHM CCCOC1CCN(Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237935965 1023005350 /nfs/dbraw/zinc/00/53/50/1023005350.db2.gz HNOVJXYFQDHPFK-UHFFFAOYSA-N -1 3 301.789 3.576 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCc2ccsc2C1 ZINC000769427675 1023147036 /nfs/dbraw/zinc/14/70/36/1023147036.db2.gz UEQDDSHLBNUUKE-UHFFFAOYSA-N -1 3 324.243 3.775 20 10 DHCDHM COc1ccc(NCc2c([O-])cccc2Cl)cc1NC(C)=O ZINC000770544591 1023323550 /nfs/dbraw/zinc/32/35/50/1023323550.db2.gz MVSOEJWORZSBFQ-UHFFFAOYSA-N -1 3 320.776 3.625 20 10 DHCDHM CC1(C)CN(Cc2cccc(Cl)c2[O-])CC2(CCCC2)O1 ZINC000785986720 1023648892 /nfs/dbraw/zinc/64/88/92/1023648892.db2.gz CNLAQJVKGOVRBH-UHFFFAOYSA-N -1 3 309.837 3.969 20 10 DHCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)s1 ZINC000790713192 1024361205 /nfs/dbraw/zinc/36/12/05/1024361205.db2.gz PYIBZEJXWGSVBF-VIFPVBQESA-N -1 3 311.790 3.694 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1Cc2ccccc2C1 ZINC000133782510 1024797970 /nfs/dbraw/zinc/79/79/70/1024797970.db2.gz FCZNKTZMTJWCDN-UHFFFAOYSA-N -1 3 304.187 3.671 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccc(OC(F)F)cn1 ZINC000793274709 1024971506 /nfs/dbraw/zinc/97/15/06/1024971506.db2.gz XABRGKMYLFRIAK-UHFFFAOYSA-N -1 3 300.692 3.654 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2cccs2)C1 ZINC000120751333 1025049056 /nfs/dbraw/zinc/04/90/56/1025049056.db2.gz UNNCRRZGWIKMSL-AWEZNQCLSA-N -1 3 309.818 3.681 20 10 DHCDHM CCCn1nccc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000825939678 1033260808 /nfs/dbraw/zinc/26/08/08/1033260808.db2.gz GEMDYDZDCXEAKM-UHFFFAOYSA-N -1 3 314.216 3.595 20 10 DHCDHM CC(C)CCOC1CCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000893965691 1025630683 /nfs/dbraw/zinc/63/06/83/1025630683.db2.gz ACWBNTVHSZHAFE-UHFFFAOYSA-N -1 3 313.388 3.698 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@@H](C)c2c([O-])cccc2F)o1 ZINC000886532074 1025679978 /nfs/dbraw/zinc/67/99/78/1025679978.db2.gz CTSRDBOQYNOFCB-SMDDNHRTSA-N -1 3 307.365 3.725 20 10 DHCDHM C[C@@H](Nc1cccc(C(=O)NC2CC2)c1)c1c([O-])cccc1F ZINC000886582669 1025718794 /nfs/dbraw/zinc/71/87/94/1025718794.db2.gz FXSDGGWPHKQYKI-LLVKDONJSA-N -1 3 314.360 3.597 20 10 DHCDHM Cc1ccc(C(=O)N(C)C)cc1N[C@H](C)c1c([O-])cccc1F ZINC000886584687 1025722052 /nfs/dbraw/zinc/72/20/52/1025722052.db2.gz UCONDOCCCCHEOO-GFCCVEGCSA-N -1 3 316.376 3.715 20 10 DHCDHM COCC[C@@H](N[C@H](C)c1c([O-])cccc1F)c1ccc(C)o1 ZINC000886586071 1025722841 /nfs/dbraw/zinc/72/28/41/1025722841.db2.gz KKAOEMKZIXVPEL-TZMCWYRMSA-N -1 3 307.365 3.861 20 10 DHCDHM COC[C@@H](N[C@H](C)c1c([O-])cccc1F)c1cccc(OC)c1 ZINC000886636777 1025751515 /nfs/dbraw/zinc/75/15/15/1025751515.db2.gz UYPXBYJMKZEFFO-MLGOLLRUSA-N -1 3 319.376 3.578 20 10 DHCDHM CC[C@H](NCc1cc[nH]n1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806138188 1025784512 /nfs/dbraw/zinc/78/45/12/1025784512.db2.gz SFGNYMVJJMLHMA-LBPRGKRZSA-N -1 3 300.189 3.663 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]1c1cccnc1 ZINC000809729668 1026595703 /nfs/dbraw/zinc/59/57/03/1026595703.db2.gz WSSIIHBBFQETKF-CQSZACIVSA-N -1 3 306.768 3.917 20 10 DHCDHM Cc1cc(=O)oc2cc(N(C)Cc3cccc(F)c3[O-])ccc12 ZINC000809724262 1027151919 /nfs/dbraw/zinc/15/19/19/1027151919.db2.gz HQJGQQLFGSHWQC-UHFFFAOYSA-N -1 3 313.328 3.583 20 10 DHCDHM Cc1ccc(C(=O)N2CCC(C)(C)c3ccccc32)c([O-])c1O ZINC000813880359 1027750496 /nfs/dbraw/zinc/75/04/96/1027750496.db2.gz XILDOOIMXLOZFF-UHFFFAOYSA-N -1 3 311.381 3.734 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)ccc2[O-])C[C@@H](C(F)(F)F)O1 ZINC000814177236 1027911317 /nfs/dbraw/zinc/91/13/17/1027911317.db2.gz YRTIZDMLSDEGHP-LBPRGKRZSA-N -1 3 323.742 3.587 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@@H](c2ccccc2)C(F)F)c1[O-] ZINC000814650772 1028138850 /nfs/dbraw/zinc/13/88/50/1028138850.db2.gz YOIULEWTFYRFFO-HNNXBMFYSA-N -1 3 323.314 3.830 20 10 DHCDHM Cc1n[nH]c(C)c1[C@H]1CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000367722615 1028230902 /nfs/dbraw/zinc/23/09/02/1028230902.db2.gz AYGVHSCXKFTGPJ-CYBMUJFWSA-N -1 3 323.799 3.862 20 10 DHCDHM C[C@H](NCc1ncccc1F)c1cccc(C(F)(F)F)c1[O-] ZINC000815598216 1028562358 /nfs/dbraw/zinc/56/23/58/1028562358.db2.gz PEAYEFHXFYLCSU-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM Cc1nc([C@@H]2CCCCN2Cc2ccc3ccccc3c2[O-])no1 ZINC000816494722 1028896077 /nfs/dbraw/zinc/89/60/77/1028896077.db2.gz XOBSBZXHGJAHNY-KRWDZBQOSA-N -1 3 323.396 3.964 20 10 DHCDHM CC(C)N(Cc1ccccn1)Cc1cc(Cl)c(F)cc1[O-] ZINC000816493756 1028896322 /nfs/dbraw/zinc/89/63/22/1028896322.db2.gz MLCDCBRJHMCNIC-UHFFFAOYSA-N -1 3 308.784 3.990 20 10 DHCDHM CC(C)OC1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816495281 1028896899 /nfs/dbraw/zinc/89/68/99/1028896899.db2.gz RDDNSYGYZIWFLO-UHFFFAOYSA-N -1 3 301.789 3.574 20 10 DHCDHM CCCCN(C(=O)c1cccc(O)c1[O-])[C@H]1CCC[C@H](C)C1 ZINC000818802262 1029433478 /nfs/dbraw/zinc/43/34/78/1029433478.db2.gz LKCKWDQXAMDGMG-KBPBESRZSA-N -1 3 305.418 3.919 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000290896176 1030240477 /nfs/dbraw/zinc/24/04/77/1030240477.db2.gz LUJBBMZENHIDOF-ZBFHGGJFSA-N -1 3 307.821 3.579 20 10 DHCDHM COCc1cc(N[C@@H](C)c2ccc(F)cc2[O-])ccc1OC ZINC000866499981 1030328289 /nfs/dbraw/zinc/32/82/89/1030328289.db2.gz RHSZTWRNQCXRKN-NSHDSACASA-N -1 3 305.349 3.859 20 10 DHCDHM CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1C ZINC000824815791 1030648296 /nfs/dbraw/zinc/64/82/96/1030648296.db2.gz ZSIHSKWVLDDYAZ-NOZJJQNGSA-N -1 3 304.217 3.556 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCSC[C@H]1C1CC1 ZINC000824914140 1030664118 /nfs/dbraw/zinc/66/41/18/1030664118.db2.gz MZAZHDJBYROFEC-ZDUSSCGKSA-N -1 3 301.814 3.512 20 10 DHCDHM CC1(C)CCc2onc(CNCc3c([O-])cccc3Cl)c2C1 ZINC000873174157 1031740967 /nfs/dbraw/zinc/74/09/67/1031740967.db2.gz BTYZQVJMFOKSPM-UHFFFAOYSA-N -1 3 320.820 3.838 20 10 DHCDHM CC(C)O[C@H]1CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000846012848 1031804320 /nfs/dbraw/zinc/80/43/20/1031804320.db2.gz BHVJZSJGFXFQLI-LBPRGKRZSA-N -1 3 301.789 3.574 20 10 DHCDHM CC(C)O[C@@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000846013482 1031807971 /nfs/dbraw/zinc/80/79/71/1031807971.db2.gz BTNZAPMHRFJBSU-LLVKDONJSA-N -1 3 301.789 3.574 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@]2(CC2(F)F)C1 ZINC000846103877 1031877185 /nfs/dbraw/zinc/87/71/85/1031877185.db2.gz AXXLRZHTWLXMFY-ZDUSSCGKSA-N -1 3 305.727 3.806 20 10 DHCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@H](C)C1(F)F ZINC000862443428 1033856597 /nfs/dbraw/zinc/85/65/97/1033856597.db2.gz PASRUNLABPXWIK-IUCAKERBSA-N -1 3 307.743 3.908 20 10 DHCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@@H](C)C1(F)F ZINC000862443429 1033855848 /nfs/dbraw/zinc/85/58/48/1033855848.db2.gz PASRUNLABPXWIK-RKDXNWHRSA-N -1 3 307.743 3.908 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@@H](CCO)c1ccco1 ZINC000184507643 1034482556 /nfs/dbraw/zinc/48/25/56/1034482556.db2.gz BCHSIGYUUACSKN-LBPRGKRZSA-N -1 3 316.184 3.505 20 10 DHCDHM COc1ccc(N[C@H](C)c2ccc(F)cc2[O-])c(OC)c1OC ZINC000186345065 1034621280 /nfs/dbraw/zinc/62/12/80/1034621280.db2.gz LYFLMVDJZWUYMW-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM CCCCc1ccc(CC(=O)NCc2c([O-])cccc2F)cc1 ZINC001178409520 1035428278 /nfs/dbraw/zinc/42/82/78/1035428278.db2.gz FLMDVDXKSKWAAY-UHFFFAOYSA-N -1 3 315.388 3.733 20 10 DHCDHM COc1ccc(F)c(CNCc2cc(Cl)c(F)cc2[O-])c1 ZINC001183000945 1036500432 /nfs/dbraw/zinc/50/04/32/1036500432.db2.gz QQYWDMYUSKTVLJ-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@@H](C)c2c(F)cccc2F)c1[O-] ZINC000774864357 1037130768 /nfs/dbraw/zinc/13/07/68/1037130768.db2.gz DNCOOEAQHPZRAK-VIFPVBQESA-N -1 3 323.314 3.863 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@@H](CC(F)(F)F)C1 ZINC000775137810 1037691082 /nfs/dbraw/zinc/69/10/82/1037691082.db2.gz QJKUZVRGZYIFNM-QMMMGPOBSA-N -1 3 311.706 3.959 20 10 DHCDHM CC(C)[C@@H](NCc1cc(Cl)ccc1[O-])C(=O)OC(C)(C)C ZINC000776256597 1038110875 /nfs/dbraw/zinc/11/08/75/1038110875.db2.gz CSWPZXNSRRUJMB-CQSZACIVSA-N -1 3 313.825 3.502 20 10 DHCDHM COc1cccc(C2(N[C@@H](C)c3ccc(F)cc3[O-])CC2)c1 ZINC000273520484 130132378 /nfs/dbraw/zinc/13/23/78/130132378.db2.gz UBWGJZRHYINNJS-LBPRGKRZSA-N -1 3 301.361 3.880 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cnn(C)c1 ZINC000273607927 130143892 /nfs/dbraw/zinc/14/38/92/130143892.db2.gz UVFGLCUYEISKRH-BDAKNGLRSA-N -1 3 314.216 3.844 20 10 DHCDHM CC[C@@H](NCc1cccc(N(C)C)n1)c1cccc(Cl)c1[O-] ZINC000287610328 131290388 /nfs/dbraw/zinc/29/03/88/131290388.db2.gz JCGWZDHQBZUOGK-OAHLLOKOSA-N -1 3 319.836 3.748 20 10 DHCDHM CCc1nnc([C@@H](C)N[C@H](CC)c2cccc(Cl)c2[O-])[nH]1 ZINC000287664670 131293010 /nfs/dbraw/zinc/29/30/10/131293010.db2.gz LWOJAKAAXKNQFR-BXKDBHETSA-N -1 3 308.813 3.528 20 10 DHCDHM CCc1nnc([C@@H](C)[NH2+][C@H](CC)c2cccc(Cl)c2[O-])[n-]1 ZINC000287664670 131293011 /nfs/dbraw/zinc/29/30/11/131293011.db2.gz LWOJAKAAXKNQFR-BXKDBHETSA-N -1 3 308.813 3.528 20 10 DHCDHM CC[C@@H](Nc1cccc(C(=O)N(C)C)c1)c1ccc(F)cc1[O-] ZINC000286177101 334151453 /nfs/dbraw/zinc/15/14/53/334151453.db2.gz QFABJYSWEHUNPP-MRXNPFEDSA-N -1 3 316.376 3.796 20 10 DHCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@H]2c2cccs2)c([O-])c1O ZINC000368042979 336836490 /nfs/dbraw/zinc/83/64/90/336836490.db2.gz MHUHOODPYWFZME-OAHLLOKOSA-N -1 3 317.410 3.691 20 10 DHCDHM Cc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])CO2 ZINC000372621753 336936434 /nfs/dbraw/zinc/93/64/34/336936434.db2.gz SDXLPLCJTHECJD-YGRLFVJLSA-N -1 3 305.324 3.763 20 10 DHCDHM C[C@H](N[C@H]1COc2c1cccc2Cl)c1cc(F)ccc1[O-] ZINC000375242906 337006411 /nfs/dbraw/zinc/00/64/11/337006411.db2.gz ROXBDZNJDNOKJU-XPTSAGLGSA-N -1 3 307.752 3.969 20 10 DHCDHM CCCO[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000175659896 337146961 /nfs/dbraw/zinc/14/69/61/337146961.db2.gz HIQAHYBMQYIZRH-INIZCTEOSA-N -1 3 323.408 3.515 20 10 DHCDHM CN1Cc2cc(NCc3cc(Cl)ccc3[O-])ccc2NC1=O ZINC000187477819 337266142 /nfs/dbraw/zinc/26/61/42/337266142.db2.gz LPTUUCAMSHAUNE-UHFFFAOYSA-N -1 3 317.776 3.635 20 10 DHCDHM Cc1cccc2c1OCC[C@H]2NCc1cccc(Cl)c1[O-] ZINC000188011332 337270070 /nfs/dbraw/zinc/27/00/70/337270070.db2.gz XYVJWBPDHAGILF-OAHLLOKOSA-N -1 3 303.789 3.967 20 10 DHCDHM COCCC1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000529638316 340765850 /nfs/dbraw/zinc/76/58/50/340765850.db2.gz PRCVTEQTKNZWTC-UHFFFAOYSA-N -1 3 318.244 3.948 20 10 DHCDHM CCc1ccc([C@H](COC)NCc2cccc(Cl)c2[O-])o1 ZINC000182224273 524050835 /nfs/dbraw/zinc/05/08/35/524050835.db2.gz FKJLGAASMYHGIZ-AWEZNQCLSA-N -1 3 309.793 3.678 20 10 DHCDHM Cc1cccc(C2=CCN(C(=O)c3ccc(C)c(O)c3[O-])CC2)c1 ZINC000182978479 524333503 /nfs/dbraw/zinc/33/35/03/524333503.db2.gz UYZUPHTWBPIWOU-UHFFFAOYSA-N -1 3 323.392 3.644 20 10 DHCDHM CC[C@H](N[C@@H](CCOC)c1ccco1)c1ccc(F)cc1[O-] ZINC000286302512 535931267 /nfs/dbraw/zinc/93/12/67/535931267.db2.gz XBKJXJPLSDPZFP-GJZGRUSLSA-N -1 3 307.365 3.943 20 10 DHCDHM COCCc1ccnc(N[C@@H](C)c2cc(Cl)ccc2[O-])c1 ZINC000287430608 536832019 /nfs/dbraw/zinc/83/20/19/536832019.db2.gz KMUIOYQKJCZZFL-NSHDSACASA-N -1 3 306.793 3.803 20 10 DHCDHM COCC[C@H](NCc1cc(Cl)c(F)cc1[O-])c1ccco1 ZINC000293753088 1013111168 /nfs/dbraw/zinc/11/11/68/1013111168.db2.gz YGXLDCYMEOORRM-ZDUSSCGKSA-N -1 3 313.756 3.645 20 10 DHCDHM C[C@@H](CC[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])c1ccccc1 ZINC001592519978 978365944 /nfs/dbraw/zinc/36/59/44/978365944.db2.gz LFVFAXAAQDKTJJ-KBPBESRZSA-N -1 3 313.397 3.935 20 10 DHCDHM C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cc(C(=O)[O-])cs1 ZINC001593298075 994709099 /nfs/dbraw/zinc/70/90/99/994709099.db2.gz DHYVMYBHXVLXBV-SNVBAGLBSA-N -1 3 322.405 3.502 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2Cc3cc(F)c(F)cc3C2)c1[O-] ZINC001171568238 1032785670 /nfs/dbraw/zinc/78/56/70/1032785670.db2.gz VXOYTOTUCQPLRX-UHFFFAOYSA-N -1 3 321.298 3.528 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CCCc2cccnc21 ZINC000922877535 1020321074 /nfs/dbraw/zinc/32/10/74/1020321074.db2.gz NSTAYECGJRAQQH-CYBMUJFWSA-N -1 3 306.768 3.747 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc(OC(C)C)cc2F)c([O-])c1O ZINC000182262173 1021567792 /nfs/dbraw/zinc/56/77/92/1021567792.db2.gz RQKQMJLLNYHOOC-UHFFFAOYSA-N -1 3 319.332 3.585 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2C[C@@H](C)S[C@H](C)C2)c1[O-] ZINC000070384286 1021658075 /nfs/dbraw/zinc/65/80/75/1021658075.db2.gz ZXSGLFATMWWIFB-NXEZZACHSA-N -1 3 313.850 3.574 20 10 DHCDHM O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1cccc(O)c1[O-] ZINC000776648648 1022244618 /nfs/dbraw/zinc/24/46/18/1022244618.db2.gz UZSHGYZUSHSBID-MRXNPFEDSA-N -1 3 315.344 3.508 20 10 DHCDHM [O-]c1c(CNc2nccc(Cl)n2)cc(Cl)c2cccnc12 ZINC001168525394 1022328858 /nfs/dbraw/zinc/32/88/58/1022328858.db2.gz CBMYTTJUTMFWDP-UHFFFAOYSA-N -1 3 321.167 3.649 20 10 DHCDHM COc1ccc(F)c(CN[C@H](C)c2cc(F)cc(F)c2[O-])c1 ZINC000857082991 1022946469 /nfs/dbraw/zinc/94/64/69/1022946469.db2.gz ZOWPWGBJQVFIJB-SECBINFHSA-N -1 3 311.303 3.669 20 10 DHCDHM CC(C)CCOC1CCN(Cc2ccc(F)c(F)c2[O-])CC1 ZINC000876620975 1033109959 /nfs/dbraw/zinc/10/99/59/1033109959.db2.gz URIVHXNISXBFNM-UHFFFAOYSA-N -1 3 313.388 3.698 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1cccc(Br)n1 ZINC000769654115 1023193032 /nfs/dbraw/zinc/19/30/32/1023193032.db2.gz QVKVGQJQOJYTRB-UHFFFAOYSA-N -1 3 313.582 3.815 20 10 DHCDHM CC[C@H](NCc1cc(Br)ccc1[O-])C(F)(F)F ZINC000786836337 1023728461 /nfs/dbraw/zinc/72/84/61/1023728461.db2.gz LZLIYZREXQOBOJ-JTQLQIEISA-N -1 3 312.129 3.585 20 10 DHCDHM CCOc1cc(C)ccc1CNCc1cc(F)cc(F)c1[O-] ZINC000883038664 1024219194 /nfs/dbraw/zinc/21/91/94/1024219194.db2.gz OWQKAROFGCKEPB-UHFFFAOYSA-N -1 3 307.340 3.667 20 10 DHCDHM Cc1cc(C=C2SC(=O)[N-]C2=O)c(C)n1-c1ccccc1F ZINC000214289386 1024250574 /nfs/dbraw/zinc/25/05/74/1024250574.db2.gz FGIRLQAOBMGDSH-RIYZIHGNSA-N -1 3 316.357 3.557 20 10 DHCDHM Cc1nc(C(C)(C)NCc2ccc(F)c(F)c2[O-])sc1C ZINC000877043312 1033216530 /nfs/dbraw/zinc/21/65/30/1033216530.db2.gz ITTYBSAGRJJUEK-UHFFFAOYSA-N -1 3 312.385 3.769 20 10 DHCDHM CN(C)c1ccc(CN(C)Cc2c([O-])ccc(Cl)c2F)cc1 ZINC000792160845 1024639033 /nfs/dbraw/zinc/63/90/33/1024639033.db2.gz BXOHFFPMBLWJDH-UHFFFAOYSA-N -1 3 322.811 3.883 20 10 DHCDHM C[C@H]1[C@H](C(F)(F)F)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000793232603 1024948761 /nfs/dbraw/zinc/94/87/61/1024948761.db2.gz ZIPYVUYQYIQKNB-OIBJUYFYSA-N -1 3 311.706 3.957 20 10 DHCDHM C[C@@H](Nc1ccc2ccn(C)c(=O)c2c1)c1ccc(F)cc1[O-] ZINC000793564859 1025103913 /nfs/dbraw/zinc/10/39/13/1025103913.db2.gz OQGUTODVRLSNKM-LLVKDONJSA-N -1 3 312.344 3.556 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@H]1[C@H]1CCCO1 ZINC000793608002 1025125189 /nfs/dbraw/zinc/12/51/89/1025125189.db2.gz HAIWNCPQKFLDEK-UONOGXRCSA-N -1 3 316.228 3.842 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@@H](C)[C@H]2C)c1[O-] ZINC000135821087 1025287360 /nfs/dbraw/zinc/28/73/60/1025287360.db2.gz IXVWDJHMONQPJY-KOLCDFICSA-N -1 3 313.850 3.574 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)ccc1O ZINC000136485026 1025450183 /nfs/dbraw/zinc/45/01/83/1025450183.db2.gz SKUSHCXIFOUDLM-UHFFFAOYSA-N -1 3 305.399 3.625 20 10 DHCDHM CC(C)Oc1ncccc1CN[C@H](C)c1c([O-])cccc1F ZINC000886505031 1025658429 /nfs/dbraw/zinc/65/84/29/1025658429.db2.gz FZCOOSALHHAEBS-GFCCVEGCSA-N -1 3 304.365 3.564 20 10 DHCDHM CCCOc1ncccc1CN[C@H](C)c1c([O-])cccc1F ZINC000886512856 1025666429 /nfs/dbraw/zinc/66/64/29/1025666429.db2.gz OMCBKDBXCDRVCF-GFCCVEGCSA-N -1 3 304.365 3.566 20 10 DHCDHM C[C@H](NCc1cccc(OC(C)(C)C)n1)c1c([O-])cccc1F ZINC000886559674 1025708606 /nfs/dbraw/zinc/70/86/06/1025708606.db2.gz AZDSJBLMRSNKGT-LBPRGKRZSA-N -1 3 318.392 3.954 20 10 DHCDHM C[C@H](Nc1cccc(N2CCOCC2)c1)c1c([O-])cccc1F ZINC000886568521 1025714086 /nfs/dbraw/zinc/71/40/86/1025714086.db2.gz MQSFIWNUJPLTPN-ZDUSSCGKSA-N -1 3 316.376 3.541 20 10 DHCDHM COc1cc(OC)c(OC)cc1N[C@@H](C)c1c([O-])cccc1F ZINC000886586896 1025723309 /nfs/dbraw/zinc/72/33/09/1025723309.db2.gz YTGMJXZTWRWAKC-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM COc1cc(OC)c(OC)cc1N[C@H](C)c1c([O-])cccc1F ZINC000886586897 1025724360 /nfs/dbraw/zinc/72/43/60/1025724360.db2.gz YTGMJXZTWRWAKC-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM Cc1c(N[C@H](C)c2c([O-])cccc2F)cnn1C1CCOCC1 ZINC000886615422 1025741978 /nfs/dbraw/zinc/74/19/78/1025741978.db2.gz GCYSUGDDGRXJEY-LLVKDONJSA-N -1 3 319.380 3.561 20 10 DHCDHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc(N(C)C)cc1 ZINC000811186691 1026951029 /nfs/dbraw/zinc/95/10/29/1026951029.db2.gz USKQBTKINCVWRJ-LLVKDONJSA-N -1 3 318.804 3.603 20 10 DHCDHM C[C@H](c1ccccc1Cl)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126396105 1027549717 /nfs/dbraw/zinc/54/97/17/1027549717.db2.gz MROLBZKZKUORAK-SNVBAGLBSA-N -1 3 305.761 3.584 20 10 DHCDHM CCn1ccnc1CN[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000296464463 1027644794 /nfs/dbraw/zinc/64/47/94/1027644794.db2.gz NLUPZCCNEVJJPC-SECBINFHSA-N -1 3 314.216 3.766 20 10 DHCDHM CCCOc1ncccc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000816542997 1028927480 /nfs/dbraw/zinc/92/74/80/1028927480.db2.gz JZTWMWYIDVXJPG-UHFFFAOYSA-N -1 3 324.783 3.658 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1cc(F)ccc1F ZINC000816548033 1028930696 /nfs/dbraw/zinc/93/06/96/1028930696.db2.gz RMGJBXONBYUUJU-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])[C@H]1[C@H]1CCCO1 ZINC000816613805 1028965345 /nfs/dbraw/zinc/96/53/45/1028965345.db2.gz FVCGCBCXOJHIGO-CABCVRRESA-N -1 3 313.800 3.574 20 10 DHCDHM CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1C ZINC000824815792 1030649086 /nfs/dbraw/zinc/64/90/86/1030649086.db2.gz ZSIHSKWVLDDYAZ-RNCFNFMXSA-N -1 3 304.217 3.556 20 10 DHCDHM C[C@@H]1CCCCN1Cc1cc(Br)c(F)cc1[O-] ZINC001144299498 1031440158 /nfs/dbraw/zinc/44/01/58/1031440158.db2.gz YJTUCDMRRIBZJE-SECBINFHSA-N -1 3 302.187 3.668 20 10 DHCDHM C[C@@H](NCc1ncc(Cl)s1)c1cc(F)cc(F)c1[O-] ZINC000872117032 1031510811 /nfs/dbraw/zinc/51/08/11/1031510811.db2.gz XFCFPVZDJIWVBQ-ZCFIWIBFSA-N -1 3 304.749 3.631 20 10 DHCDHM CCCc1nc(C)c(CN[C@H](C)c2ccc(F)c(F)c2[O-])o1 ZINC000293749712 1031597925 /nfs/dbraw/zinc/59/79/25/1031597925.db2.gz RHQUADNNRSMRGK-SECBINFHSA-N -1 3 310.344 3.770 20 10 DHCDHM CCCc1nc(C)c(CNCc2cc(Cl)c(F)cc2[O-])o1 ZINC000293968340 1031727581 /nfs/dbraw/zinc/72/75/81/1031727581.db2.gz QIKJTCOOUSVERK-UHFFFAOYSA-N -1 3 312.772 3.723 20 10 DHCDHM Cc1ccc([C@H]2CCCN2Cc2cc(F)c(F)cc2[O-])cn1 ZINC001142527418 1031911432 /nfs/dbraw/zinc/91/14/32/1031911432.db2.gz UDLFAGURVUVYOH-MRXNPFEDSA-N -1 3 304.340 3.711 20 10 DHCDHM CC[C@@H](NCc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1[O-] ZINC000927107136 1033776750 /nfs/dbraw/zinc/77/67/50/1033776750.db2.gz GSVXOQFODCYBBZ-OAHLLOKOSA-N -1 3 319.836 3.897 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@@H](c1nccs1)C(F)(F)F ZINC000862431074 1033850673 /nfs/dbraw/zinc/85/06/73/1033850673.db2.gz DGFFQRHVLLFVRX-JTQLQIEISA-N -1 3 322.739 3.895 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN[C@@H](C)c2ncc(C)s2)c1[O-] ZINC000185001471 1034517430 /nfs/dbraw/zinc/51/74/30/1034517430.db2.gz UCVSFRVAVALFPI-VIFPVBQESA-N -1 3 324.833 3.864 20 10 DHCDHM COCCOc1ccc(F)cc1N[C@H](C)c1ccc(F)cc1[O-] ZINC000186429601 1034628878 /nfs/dbraw/zinc/62/88/78/1034628878.db2.gz JNVUKDCAGGMCCX-LLVKDONJSA-N -1 3 323.339 3.869 20 10 DHCDHM COCCOc1ccc(F)cc1N[C@@H](C)c1ccc(F)cc1[O-] ZINC000186429584 1034630162 /nfs/dbraw/zinc/63/01/62/1034630162.db2.gz JNVUKDCAGGMCCX-NSHDSACASA-N -1 3 323.339 3.869 20 10 DHCDHM COc1cc2c(cc1F)CN(Cc1cc(Cl)ccc1[O-])CC2 ZINC000777440053 1034740506 /nfs/dbraw/zinc/74/05/06/1034740506.db2.gz GEBZAGSNPBKGRR-UHFFFAOYSA-N -1 3 321.779 3.752 20 10 DHCDHM CC(C)Sc1ccc(C(=O)NCc2c([O-])cccc2F)cc1 ZINC001178412821 1035428899 /nfs/dbraw/zinc/42/88/99/1035428899.db2.gz GUFNEAHCFKAXOY-UHFFFAOYSA-N -1 3 319.401 3.962 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1ccc(-c2ccco2)s1 ZINC001178413232 1035428927 /nfs/dbraw/zinc/42/89/27/1035428927.db2.gz PEKBEADVUDSTLW-UHFFFAOYSA-N -1 3 317.341 3.783 20 10 DHCDHM CC(C)Oc1ncccc1CNCc1cccc(Cl)c1[O-] ZINC000158063534 1039774166 /nfs/dbraw/zinc/77/41/66/1039774166.db2.gz DGANNAQGOCMMKC-UHFFFAOYSA-N -1 3 306.793 3.518 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])c1cccc(F)c1F ZINC000273484304 130126894 /nfs/dbraw/zinc/12/68/94/130126894.db2.gz MVZNSSZFERVTHP-ZJUUUORDSA-N -1 3 322.311 3.990 20 10 DHCDHM CCn1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2[O-])cn1 ZINC000273538249 130133969 /nfs/dbraw/zinc/13/39/69/130133969.db2.gz XSOJEMMYXZLRDX-SECBINFHSA-N -1 3 314.216 3.766 20 10 DHCDHM CC[C@@H](N[C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1[O-] ZINC000286127149 131220876 /nfs/dbraw/zinc/22/08/76/131220876.db2.gz NWWJLYPPFKAYFU-GXFFZTMASA-N -1 3 306.385 3.575 20 10 DHCDHM CC[C@H](N[C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1[O-] ZINC000286127145 131221001 /nfs/dbraw/zinc/22/10/01/131221001.db2.gz NWWJLYPPFKAYFU-GWCFXTLKSA-N -1 3 306.385 3.575 20 10 DHCDHM C[C@@H](N[C@@H](C)C(F)(F)F)c1cc(Br)ccc1[O-] ZINC000287310433 131274789 /nfs/dbraw/zinc/27/47/89/131274789.db2.gz LEHIEQKYBUWWFZ-RQJHMYQMSA-N -1 3 312.129 3.756 20 10 DHCDHM CCc1nnc([C@H](C)N[C@@H](CC)c2cccc(Cl)c2[O-])[nH]1 ZINC000287664672 131293318 /nfs/dbraw/zinc/29/33/18/131293318.db2.gz LWOJAKAAXKNQFR-CABZTGNLSA-N -1 3 308.813 3.528 20 10 DHCDHM CCc1nnc([C@H](C)[NH2+][C@@H](CC)c2cccc(Cl)c2[O-])[n-]1 ZINC000287664672 131293320 /nfs/dbraw/zinc/29/33/20/131293320.db2.gz LWOJAKAAXKNQFR-CABZTGNLSA-N -1 3 308.813 3.528 20 10 DHCDHM Cc1c(N[C@H](C)c2cc(F)ccc2[O-])cnn1C1CCOCC1 ZINC000297361379 132012319 /nfs/dbraw/zinc/01/23/19/132012319.db2.gz PSZSSJDPJOCIPZ-LLVKDONJSA-N -1 3 319.380 3.561 20 10 DHCDHM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cccc(O)c1[O-] ZINC000292663243 334190345 /nfs/dbraw/zinc/19/03/45/334190345.db2.gz LPGBXFBPPNQCQU-WWGRRREGSA-N -1 3 311.381 3.505 20 10 DHCDHM C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000370708648 336891628 /nfs/dbraw/zinc/89/16/28/336891628.db2.gz QKQCKIMFQRKVLT-DZGCQCFKSA-N -1 3 311.381 3.506 20 10 DHCDHM C[C@@H](N[C@@H]1COc2c1cccc2Cl)c1cc(F)ccc1[O-] ZINC000375242907 337006318 /nfs/dbraw/zinc/00/63/18/337006318.db2.gz ROXBDZNJDNOKJU-YMTOWFKASA-N -1 3 307.752 3.969 20 10 DHCDHM COc1cc(Cl)cc(CN[C@H](C)c2ncc(C)s2)c1[O-] ZINC000228675967 337078171 /nfs/dbraw/zinc/07/81/71/337078171.db2.gz YOFNFCDZCNIJKD-SECBINFHSA-N -1 3 312.822 3.670 20 10 DHCDHM [O-]c1ccc2ccccc2c1CNc1cccc2c1OCC[C@@H]2O ZINC000184093894 337196190 /nfs/dbraw/zinc/19/61/90/337196190.db2.gz DAULRGIPKVTBJU-IBGZPJMESA-N -1 3 321.376 3.973 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(Nc2nccs2)CC1 ZINC000189957233 337284062 /nfs/dbraw/zinc/28/40/62/337284062.db2.gz FVCTXYDNCUJFMY-UHFFFAOYSA-N -1 3 323.849 3.579 20 10 DHCDHM C[C@H](N[C@H]1CCOc2c(F)cccc21)c1ccc(F)cc1[O-] ZINC000188060653 525627361 /nfs/dbraw/zinc/62/73/61/525627361.db2.gz KTJUROZQUQEYSY-BONVTDFDSA-N -1 3 305.324 3.845 20 10 DHCDHM CC(C)(C)OCc1cc(CNCc2c([O-])cccc2Cl)no1 ZINC000275010433 534991416 /nfs/dbraw/zinc/99/14/16/534991416.db2.gz PXESUNRUIYSAMF-UHFFFAOYSA-N -1 3 324.808 3.639 20 10 DHCDHM CC[C@H](NCc1nccn1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287615179 535921814 /nfs/dbraw/zinc/92/18/14/535921814.db2.gz JMHFIKPZSFKDTA-LBPRGKRZSA-N -1 3 314.216 3.673 20 10 DHCDHM CN(Cc1nc2ccccc2o1)Cc1ccc(Cl)cc1[O-] ZINC001140465406 1015528325 /nfs/dbraw/zinc/52/83/25/1015528325.db2.gz MBDMKQSVBSDMRI-UHFFFAOYSA-N -1 3 302.761 3.819 20 10 DHCDHM COCC[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1ccco1 ZINC000276867268 1015718676 /nfs/dbraw/zinc/71/86/76/1015718676.db2.gz DIVTZAIHJXZOET-GXFFZTMASA-N -1 3 311.328 3.692 20 10 DHCDHM C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)c1cc(C(=O)[O-])ccc1[O-] ZINC001593239624 994423855 /nfs/dbraw/zinc/42/38/55/994423855.db2.gz HGDGOGSCEDLSPM-SECBINFHSA-N -1 3 319.323 3.720 20 10 DHCDHM C[C@H](NCc1ccc(Cl)cc1F)c1cc(C(=O)[O-])ccc1O ZINC001593297907 994707909 /nfs/dbraw/zinc/70/79/09/994707909.db2.gz BXQZKMRAKGRZGZ-VIFPVBQESA-N -1 3 323.751 3.734 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN[C@@H]1CCCc2cccnc21 ZINC000897072017 1017032846 /nfs/dbraw/zinc/03/28/46/1017032846.db2.gz SOEOPPFMUXWMAJ-CQSZACIVSA-N -1 3 306.768 3.747 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](c2ccc(F)cc2)C1 ZINC000179427498 1020350590 /nfs/dbraw/zinc/35/05/90/1020350590.db2.gz VDBAZLKFRIRSDX-KRWDZBQOSA-N -1 3 321.779 3.758 20 10 DHCDHM COCCOc1ccccc1N[C@H](C)c1ccc(F)cc1[O-] ZINC000186426659 1020417199 /nfs/dbraw/zinc/41/71/99/1020417199.db2.gz BSGLZQXLRPHGKD-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM Cc1ccc(C(=O)Nc2cc(C(C)C)c(O)cc2C)c([O-])c1O ZINC000182880758 1021837619 /nfs/dbraw/zinc/83/76/19/1021837619.db2.gz CWWTWQGJDVVJBY-UHFFFAOYSA-N -1 3 315.369 3.796 20 10 DHCDHM COc1ccc2cc(NC(=O)c3cccc(O)c3[O-])ccc2c1 ZINC000804308610 1022266291 /nfs/dbraw/zinc/26/62/91/1022266291.db2.gz YHWHLQPDZAYGIN-UHFFFAOYSA-N -1 3 309.321 3.512 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)ccc1O ZINC000776747675 1022492444 /nfs/dbraw/zinc/49/24/44/1022492444.db2.gz JXIGBRFHLDDGLN-UHFFFAOYSA-N -1 3 319.426 3.799 20 10 DHCDHM [O-]c1ccc(F)cc1CN(Cc1ccco1)Cc1ccco1 ZINC000179886719 1022573022 /nfs/dbraw/zinc/57/30/22/1022573022.db2.gz OASNAWUCNUWRDR-UHFFFAOYSA-N -1 3 301.317 3.920 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@H]2c2cc[nH]n2)cc1Cl ZINC000825882257 1033084581 /nfs/dbraw/zinc/08/45/81/1033084581.db2.gz HEVPRFPFVRFULR-HNNXBMFYSA-N -1 3 305.809 3.804 20 10 DHCDHM COc1ccc(F)c(CN[C@@H](C)c2cc(F)cc(F)c2[O-])c1 ZINC000857082992 1022946132 /nfs/dbraw/zinc/94/61/32/1022946132.db2.gz ZOWPWGBJQVFIJB-VIFPVBQESA-N -1 3 311.303 3.669 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)ccc1O ZINC000771219636 1023412582 /nfs/dbraw/zinc/41/25/82/1023412582.db2.gz LJPCFPHNYLYOJO-UHFFFAOYSA-N -1 3 319.426 3.700 20 10 DHCDHM CCc1nn(C)cc1N[C@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788814814 1023939672 /nfs/dbraw/zinc/93/96/72/1023939672.db2.gz NEAVWZFIGGQREP-SECBINFHSA-N -1 3 313.323 3.880 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@H]1CCCc2c[nH]nc21 ZINC000268824306 1024171780 /nfs/dbraw/zinc/17/17/80/1024171780.db2.gz IQIUQQFQJFFWQK-LBPRGKRZSA-N -1 3 312.200 3.589 20 10 DHCDHM COc1ccc([C@H](C)NCc2cc(F)cc(F)c2[O-])c(OC)c1 ZINC000883189129 1024277421 /nfs/dbraw/zinc/27/74/21/1024277421.db2.gz YVJIWGBSSCCVIZ-JTQLQIEISA-N -1 3 323.339 3.538 20 10 DHCDHM CCSc1ccc([C@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790641682 1024350847 /nfs/dbraw/zinc/35/08/47/1024350847.db2.gz HTZSLQAJJCOUGY-NSHDSACASA-N -1 3 317.410 3.701 20 10 DHCDHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc(O)cc2)c(C)c1C ZINC000145117332 1024351694 /nfs/dbraw/zinc/35/16/94/1024351694.db2.gz SHJRMMNXGAGXGC-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM C[C@@H](NC1(c2ncccn2)CCC1)c1ccc(Cl)cc1[O-] ZINC000883311853 1024364664 /nfs/dbraw/zinc/36/46/64/1024364664.db2.gz MODNVIALGCRQDK-LLVKDONJSA-N -1 3 303.793 3.566 20 10 DHCDHM COc1ccc(CNCc2c([O-])ccc(Cl)c2F)c(F)c1 ZINC000790977309 1024422421 /nfs/dbraw/zinc/42/24/21/1024422421.db2.gz WXPZEBZKRNDUCP-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(OCC(C)C)c2)c([O-])c1O ZINC001626139659 1025068566 /nfs/dbraw/zinc/06/85/66/1025068566.db2.gz WPESQQQUUDZCEC-UHFFFAOYSA-N -1 3 315.369 3.693 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCCO[C@H](c2ccccc2)C1 ZINC000893995483 1025638782 /nfs/dbraw/zinc/63/87/82/1025638782.db2.gz LWLBQVFRGHZCBY-KRWDZBQOSA-N -1 3 319.351 3.634 20 10 DHCDHM C[C@H](N[C@H]1COc2c1cccc2Cl)c1c([O-])cccc1F ZINC000886552329 1025699823 /nfs/dbraw/zinc/69/98/23/1025699823.db2.gz ZBJLGYGWXVPUPS-ZANVPECISA-N -1 3 307.752 3.969 20 10 DHCDHM COc1cc(N[C@@H](C)c2c([O-])cccc2F)cc(OC)c1OC ZINC000886563931 1025711518 /nfs/dbraw/zinc/71/15/18/1025711518.db2.gz JKROHWYIUPGIDE-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM C[C@@H](Nc1ccc(N2CCCC2)nc1)c1c([O-])cccc1F ZINC000886577961 1025716920 /nfs/dbraw/zinc/71/69/20/1025716920.db2.gz DHKXNGMSVDGSQH-GFCCVEGCSA-N -1 3 301.365 3.700 20 10 DHCDHM COc1cc(OC)c(N[C@@H](C)c2c([O-])cccc2F)cc1F ZINC000886586428 1025723402 /nfs/dbraw/zinc/72/34/02/1025723402.db2.gz RHKZFBYFUQHNKD-VIFPVBQESA-N -1 3 309.312 3.861 20 10 DHCDHM Cc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1C(=O)N(C)C ZINC000886586167 1025725212 /nfs/dbraw/zinc/72/52/12/1025725212.db2.gz MDJSNWLNDMWTRV-GFCCVEGCSA-N -1 3 316.376 3.715 20 10 DHCDHM CC(=O)N1CCc2c1cccc2N[C@H](C)c1c([O-])cccc1F ZINC000886592585 1025726774 /nfs/dbraw/zinc/72/67/74/1025726774.db2.gz XSDUPHMSEWBKDD-LLVKDONJSA-N -1 3 314.360 3.613 20 10 DHCDHM C[C@@H](N[C@@H]1CCCC1(F)F)c1ccc(Br)cc1[O-] ZINC000806179761 1025834070 /nfs/dbraw/zinc/83/40/70/1025834070.db2.gz GZVAGKISXPYGTR-PRHODGIISA-N -1 3 320.177 3.993 20 10 DHCDHM CCCc1nc(C)c(CNCc2c([O-])ccc(Cl)c2F)o1 ZINC000813791779 1027714621 /nfs/dbraw/zinc/71/46/21/1027714621.db2.gz FKYBMXITUAKMKI-UHFFFAOYSA-N -1 3 312.772 3.723 20 10 DHCDHM C[C@H](NCc1ccc(Cl)cc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779053479 1028072924 /nfs/dbraw/zinc/07/29/24/1028072924.db2.gz CIOMVSVRUWBDIQ-VIFPVBQESA-N -1 3 324.739 3.944 20 10 DHCDHM C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)c1cccc(O)c1[O-] ZINC000188448858 1028511235 /nfs/dbraw/zinc/51/12/35/1028511235.db2.gz HJCZOJWWXVOPER-ZDUSSCGKSA-N -1 3 311.381 3.539 20 10 DHCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000189432506 1028578066 /nfs/dbraw/zinc/57/80/66/1028578066.db2.gz PAPZKJNARQEBOK-UHFFFAOYSA-N -1 3 319.426 3.879 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@H](C(C)(C)C)C(F)(F)F)c1[O-] ZINC000779202086 1028697284 /nfs/dbraw/zinc/69/72/84/1028697284.db2.gz HTBWIWMHCSVOHY-CYBMUJFWSA-N -1 3 321.314 3.801 20 10 DHCDHM Cn1ccnc1[C@@H]1N(Cc2ccc3ccccc3c2[O-])CC1(C)C ZINC000824620482 1030603934 /nfs/dbraw/zinc/60/39/34/1030603934.db2.gz QNPOAXPFFAETRJ-SFHVURJKSA-N -1 3 321.424 3.862 20 10 DHCDHM CCOC[C@@H]1CCCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC001308811840 1031296894 /nfs/dbraw/zinc/29/68/94/1031296894.db2.gz AHOPBRMPHJCDBE-LBPRGKRZSA-N -1 3 301.789 3.576 20 10 DHCDHM CCc1noc(C)c1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000293054490 1031307582 /nfs/dbraw/zinc/30/75/82/1031307582.db2.gz UEMJISMPHOXTEJ-UHFFFAOYSA-N -1 3 315.200 3.848 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1scnc1C1CCCC1 ZINC000928708737 1031364239 /nfs/dbraw/zinc/36/42/39/1031364239.db2.gz RVCCWWRXEVVJNG-UHFFFAOYSA-N -1 3 320.389 3.575 20 10 DHCDHM C[C@H](NCc1ccc(N(C)C)c(F)c1)c1cccc([O-])c1F ZINC000872026982 1031409442 /nfs/dbraw/zinc/40/94/42/1031409442.db2.gz AGHSCEJFCZJHAN-NSHDSACASA-N -1 3 306.356 3.587 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1nc(C2CC2)cs1 ZINC000293542435 1031507827 /nfs/dbraw/zinc/50/78/27/1031507827.db2.gz GCUQTPSGTQXZIE-UHFFFAOYSA-N -1 3 312.797 3.808 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCc2sccc2C1 ZINC000124290073 1031672988 /nfs/dbraw/zinc/67/29/88/1031672988.db2.gz LGIKMZNXCAAYRK-UHFFFAOYSA-N -1 3 324.243 3.775 20 10 DHCDHM C[C@]12CCN(Cc3ccc(F)c(F)c3[O-])C[C@H]1C2(Cl)Cl ZINC000877506727 1033329042 /nfs/dbraw/zinc/32/90/42/1033329042.db2.gz CPIKXRBBLBKJLR-MFKMUULPSA-N -1 3 322.182 3.686 20 10 DHCDHM C[C@H]1C[C@@H](C(F)(F)F)CCN1Cc1ccc(F)c(F)c1[O-] ZINC000877563012 1033358394 /nfs/dbraw/zinc/35/83/94/1033358394.db2.gz FAVAEYYTZAOKPC-WPRPVWTQSA-N -1 3 309.278 3.833 20 10 DHCDHM C[C@@H]1c2cccn2CCN1Cc1c([O-])cccc1Br ZINC000862211783 1033780585 /nfs/dbraw/zinc/78/05/85/1033780585.db2.gz BSTADGYNJKPORK-LLVKDONJSA-N -1 3 321.218 3.533 20 10 DHCDHM C[C@@H](c1ccco1)N(C)Cc1c([O-])cccc1Br ZINC000862219498 1033784682 /nfs/dbraw/zinc/78/46/82/1033784682.db2.gz HMQCHDMDYWHQLT-JTQLQIEISA-N -1 3 310.191 3.941 20 10 DHCDHM CCN(Cc1ccoc1)Cc1c([O-])cccc1Br ZINC000862238172 1033789423 /nfs/dbraw/zinc/78/94/23/1033789423.db2.gz OPXYUQAPVQBCHB-UHFFFAOYSA-N -1 3 310.191 3.770 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@@](C)(C(F)(F)F)C2)c1[O-] ZINC000880000767 1034177487 /nfs/dbraw/zinc/17/74/87/1034177487.db2.gz KJZNCKRLQZOSKL-CQSZACIVSA-N -1 3 319.298 3.508 20 10 DHCDHM CC(=O)c1cc(F)cc(CNC(C)(C)c2ncc(C)s2)c1[O-] ZINC000183957639 1034433207 /nfs/dbraw/zinc/43/32/07/1034433207.db2.gz PPPFMUALMKLFKA-UHFFFAOYSA-N -1 3 322.405 3.524 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@@H](C)c2ccc(F)cc2[O-])o1 ZINC000185548061 1034556374 /nfs/dbraw/zinc/55/63/74/1034556374.db2.gz LUROQLKHYMCTGT-NHYWBVRUSA-N -1 3 307.365 3.725 20 10 DHCDHM CCN(C(=O)c1ccc(C)c(O)c1[O-])c1ccc(F)c(C)c1 ZINC001177198866 1035354419 /nfs/dbraw/zinc/35/44/19/1035354419.db2.gz GNJKDSJSZPLKEQ-UHFFFAOYSA-N -1 3 303.333 3.520 20 10 DHCDHM O=C1Nc2ccc(NCc3c([O-])cccc3Cl)cc2CO1 ZINC001179159550 1035468094 /nfs/dbraw/zinc/46/80/94/1035468094.db2.gz NXRNVTFYFBLFKH-UHFFFAOYSA-N -1 3 304.733 3.720 20 10 DHCDHM Cc1cc([O-])c(CN2Cc3ccc([N+](=O)[O-])cc3C2)cc1Cl ZINC001180071689 1035583586 /nfs/dbraw/zinc/58/35/86/1035583586.db2.gz GKYJLWUKFWNNMU-UHFFFAOYSA-N -1 3 318.760 3.778 20 10 DHCDHM O=C1CCC[C@H]2CN(Cc3cc(Cl)cc(Cl)c3[O-])C[C@H]12 ZINC001203586470 1036827964 /nfs/dbraw/zinc/82/79/64/1036827964.db2.gz OHODLPHRDQWCGA-CABZTGNLSA-N -1 3 314.212 3.500 20 10 DHCDHM CC1(CC(=O)NCc2cc(Cl)c3cccnc3c2[O-])CCC1 ZINC001185109985 1037040073 /nfs/dbraw/zinc/04/00/73/1037040073.db2.gz FCGNYGYDEPDOPI-UHFFFAOYSA-N -1 3 318.804 3.790 20 10 DHCDHM CC[C@@H](NCc1nccn1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775499628 1038582026 /nfs/dbraw/zinc/58/20/26/1038582026.db2.gz SOGNNRWQEXSZSD-LLVKDONJSA-N -1 3 314.216 3.673 20 10 DHCDHM CCOCc1ccccc1CNCc1c([O-])cccc1Cl ZINC000083551676 192372301 /nfs/dbraw/zinc/37/23/01/192372301.db2.gz MYNRNCVHEAEESP-UHFFFAOYSA-N -1 3 305.805 3.872 20 10 DHCDHM CCOc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273437114 130122362 /nfs/dbraw/zinc/12/23/62/130122362.db2.gz XJGAVBRIHXTWMP-GFCCVEGCSA-N -1 3 316.357 3.550 20 10 DHCDHM C[C@H](N[C@@H](C)c1cccc(F)c1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273484300 130126284 /nfs/dbraw/zinc/12/62/84/130126284.db2.gz MVZNSSZFERVTHP-UWVGGRQHSA-N -1 3 322.311 3.990 20 10 DHCDHM CC(C)CNC(=O)c1ccc(NCc2cc(F)ccc2[O-])cc1 ZINC000280819974 130819679 /nfs/dbraw/zinc/81/96/79/130819679.db2.gz VGHACQXZVUPVSH-UHFFFAOYSA-N -1 3 316.376 3.529 20 10 DHCDHM C[C@H](N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1[O-] ZINC000286892151 131254239 /nfs/dbraw/zinc/25/42/39/131254239.db2.gz DCSJTRCCGVPGKL-YVEFUNNKSA-N -1 3 320.383 3.624 20 10 DHCDHM CCCOc1ccc(CN[C@@H](C2CC2)C(F)(F)F)c([O-])c1 ZINC000288519258 131328617 /nfs/dbraw/zinc/32/86/17/131328617.db2.gz UMWNRSZFKHWHHU-AWEZNQCLSA-N -1 3 303.324 3.612 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@H]2CCc3cccc([O-])c32)o1 ZINC000297863975 132037153 /nfs/dbraw/zinc/03/71/53/132037153.db2.gz UEHBYKVZNVMTDU-LSDHHAIUSA-N -1 3 301.386 3.512 20 10 DHCDHM Cc1noc(CN(Cc2ccccc2[O-])[C@H](C)c2ccccc2)n1 ZINC000299691729 132115834 /nfs/dbraw/zinc/11/58/34/132115834.db2.gz URIJRPDDQISAIE-CQSZACIVSA-N -1 3 323.396 3.847 20 10 DHCDHM C[C@H](NCc1ccc(OCC2CC2)nc1)c1ccc(F)cc1[O-] ZINC000185261858 333206503 /nfs/dbraw/zinc/20/65/03/333206503.db2.gz CEFBEKYUXNVNPP-LBPRGKRZSA-N -1 3 316.376 3.566 20 10 DHCDHM Cc1cc(Cl)cc(CN[C@H](C)c2c(F)cncc2F)c1[O-] ZINC000289524035 334165968 /nfs/dbraw/zinc/16/59/68/334165968.db2.gz HFZVMMJSJFYPHT-SECBINFHSA-N -1 3 312.747 3.878 20 10 DHCDHM C[C@@H](N[C@H]1COc2c1cccc2Cl)c1cc(F)ccc1[O-] ZINC000375242905 337006437 /nfs/dbraw/zinc/00/64/37/337006437.db2.gz ROXBDZNJDNOKJU-OTYXRUKQSA-N -1 3 307.752 3.969 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(c2ccccn2)CC1 ZINC000376153095 337028418 /nfs/dbraw/zinc/02/84/18/337028418.db2.gz VELFRNRULWQFHN-UHFFFAOYSA-N -1 3 302.805 3.820 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCC(Nc2cccnc2)CC1 ZINC000377629787 337056802 /nfs/dbraw/zinc/05/68/02/337056802.db2.gz QAIKDMHZHRRLTH-UHFFFAOYSA-N -1 3 317.820 3.517 20 10 DHCDHM C[C@@H](NCc1cc(F)ccc1[O-])c1nccn1-c1ccccc1 ZINC000377869623 337063021 /nfs/dbraw/zinc/06/30/21/337063021.db2.gz PYPQBBGZXFFSEP-CYBMUJFWSA-N -1 3 311.360 3.568 20 10 DHCDHM Cc1cc(Cl)cc(CN2CCCC[C@@H]2c2ncc[nH]2)c1[O-] ZINC000179938102 337172726 /nfs/dbraw/zinc/17/27/26/337172726.db2.gz FSQOPVMUSGYYTF-CQSZACIVSA-N -1 3 305.809 3.804 20 10 DHCDHM C[C@@H](N[C@@H](C)c1noc(-c2ccccc2)n1)c1ccccc1[O-] ZINC000183562710 337192295 /nfs/dbraw/zinc/19/22/95/337192295.db2.gz VMFWGGQNAVLECS-OLZOCXBDSA-N -1 3 309.369 3.854 20 10 DHCDHM [O-]c1ccc2ccccc2c1CNc1cccc2c1OCC[C@H]2O ZINC000184093911 337196158 /nfs/dbraw/zinc/19/61/58/337196158.db2.gz DAULRGIPKVTBJU-LJQANCHMSA-N -1 3 321.376 3.973 20 10 DHCDHM COc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2[O-])c(OC)c1 ZINC000320573580 337598367 /nfs/dbraw/zinc/59/83/67/337598367.db2.gz QWWVTEJUKKQDBS-NEPJUHHUSA-N -1 3 319.376 3.960 20 10 DHCDHM CC(C)(C)Oc1ccc(CNCc2cccc(Cl)c2[O-])cn1 ZINC000181128238 518892336 /nfs/dbraw/zinc/89/23/36/518892336.db2.gz ZEFWSJCXGLIBBE-UHFFFAOYSA-N -1 3 320.820 3.908 20 10 DHCDHM CC[C@@H](N[C@H](c1nc(C)no1)c1ccccc1)c1ccccc1[O-] ZINC000364957098 522945900 /nfs/dbraw/zinc/94/59/00/522945900.db2.gz XRYWSAMBQOBQDH-AEFFLSMTSA-N -1 3 323.396 3.914 20 10 DHCDHM CC[C@@H](NCc1cc(OC)ccc1OC)c1ccc(F)cc1[O-] ZINC000285561230 535805752 /nfs/dbraw/zinc/80/57/52/535805752.db2.gz HGHBQAMPHUVDQJ-MRXNPFEDSA-N -1 3 319.376 3.789 20 10 DHCDHM CC[C@H](N[C@H](COC)c1ccc(C)o1)c1ccc(F)cc1[O-] ZINC000285986894 535944130 /nfs/dbraw/zinc/94/41/30/535944130.db2.gz HWWVAPKCJWFLPP-LSDHHAIUSA-N -1 3 307.365 3.861 20 10 DHCDHM COc1ccc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273576933 536902441 /nfs/dbraw/zinc/90/24/41/536902441.db2.gz MAPJWCDHAFPRLH-RYUDHWBXSA-N -1 3 316.357 3.721 20 10 DHCDHM CCC[N@H+](Cc1ccsc1C(=O)[O-])Cc1ccccc1[O-] ZINC000829496892 601821747 /nfs/dbraw/zinc/82/17/47/601821747.db2.gz UJJFMPOBQTVIEM-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM CCC[N@@H+](Cc1ccsc1C(=O)[O-])Cc1ccccc1[O-] ZINC000829496892 601821749 /nfs/dbraw/zinc/82/17/49/601821749.db2.gz UJJFMPOBQTVIEM-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM Cc1cnc(C(C)(C)NCc2cc(Cl)c(F)cc2[O-])s1 ZINC000293495669 1013100024 /nfs/dbraw/zinc/10/00/24/1013100024.db2.gz BCDYQWQTIDCADP-UHFFFAOYSA-N -1 3 314.813 3.975 20 10 DHCDHM [O-]c1cccc(Br)c1CN1CCCCC(F)(F)C1 ZINC001140099186 1013432244 /nfs/dbraw/zinc/43/22/44/1013432244.db2.gz ZJDWPPUGHHNBHZ-UHFFFAOYSA-N -1 3 320.177 3.776 20 10 DHCDHM C[C@@]12CCN(Cc3cc(F)cc(F)c3[O-])C[C@@H]1C2(Cl)Cl ZINC000894689558 1013456787 /nfs/dbraw/zinc/45/67/87/1013456787.db2.gz DVVVBIUIXOKOFC-WCQYABFASA-N -1 3 322.182 3.686 20 10 DHCDHM C[N@H+](Cc1cc(-c2ccccc2)ccc1[O-])C(C)(C)CC(=O)[O-] ZINC001598504991 992490581 /nfs/dbraw/zinc/49/05/81/992490581.db2.gz UKTYYZBVIODHON-UHFFFAOYSA-N -1 3 313.397 3.744 20 10 DHCDHM C[N@@H+](Cc1cc(-c2ccccc2)ccc1[O-])C(C)(C)CC(=O)[O-] ZINC001598504991 992490585 /nfs/dbraw/zinc/49/05/85/992490585.db2.gz UKTYYZBVIODHON-UHFFFAOYSA-N -1 3 313.397 3.744 20 10 DHCDHM C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593296274 994695756 /nfs/dbraw/zinc/69/57/56/994695756.db2.gz LEMMSKZQJNEHIM-GFCCVEGCSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@@H](NCc1cccc(Cl)c1F)c1cc(C(=O)[O-])ccc1O ZINC001593303761 994737415 /nfs/dbraw/zinc/73/74/15/994737415.db2.gz FOTVWQZTYRNDQQ-SECBINFHSA-N -1 3 323.751 3.734 20 10 DHCDHM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1cccc(O)c1[O-] ZINC001148219854 1032375327 /nfs/dbraw/zinc/37/53/27/1032375327.db2.gz BYDLVINAMYSYLU-UHFFFAOYSA-N -1 3 321.332 3.723 20 10 DHCDHM Cc1ccc2ccccc2c1NC(=O)c1cc(O)c([O-])c(O)c1 ZINC001148581673 1032420373 /nfs/dbraw/zinc/42/03/73/1032420373.db2.gz RHTURAYTZRIDEQ-UHFFFAOYSA-N -1 3 309.321 3.517 20 10 DHCDHM O=C(Nc1cccc(Oc2ccccn2)c1)c1cccc(O)c1[O-] ZINC000185766404 1017159247 /nfs/dbraw/zinc/15/92/47/1017159247.db2.gz STNTXRRQEIUOLK-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM CC[C@@H](NCc1nnc(C2CC2)s1)c1ccc(F)cc1[O-] ZINC000840892403 1017416066 /nfs/dbraw/zinc/41/60/66/1017416066.db2.gz ZPTWUFNMWCJIOG-GFCCVEGCSA-N -1 3 307.394 3.501 20 10 DHCDHM C[C@@H]1CCCN1Cc1cc(Cl)cc(Br)c1[O-] ZINC000708135168 1017667149 /nfs/dbraw/zinc/66/71/49/1017667149.db2.gz WVWALLJLIMMGQQ-MRVPVSSYSA-N -1 3 304.615 3.792 20 10 DHCDHM CCOc1ccccc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000756446466 1018317663 /nfs/dbraw/zinc/31/76/63/1018317663.db2.gz QOVLYEVIMDVBPJ-LLVKDONJSA-N -1 3 307.340 3.920 20 10 DHCDHM CN(Cc1ccc(Br)cc1)Cc1c([O-])cccc1F ZINC001137837676 1018660007 /nfs/dbraw/zinc/66/00/07/1018660007.db2.gz QRCVDYBLZUFPPH-UHFFFAOYSA-N -1 3 324.193 3.926 20 10 DHCDHM O=C(Nc1cccc(NC2CCCC2)c1)c1cccc(O)c1[O-] ZINC000187081472 1019022602 /nfs/dbraw/zinc/02/26/02/1019022602.db2.gz ZYUUGAKKEOMXCI-UHFFFAOYSA-N -1 3 312.369 3.705 20 10 DHCDHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000186877055 1020519760 /nfs/dbraw/zinc/51/97/60/1020519760.db2.gz QRHJQWASDRDIFR-NSHDSACASA-N -1 3 311.337 3.677 20 10 DHCDHM CN(Cc1cccc2ccccc21)C(=O)c1cccc(O)c1[O-] ZINC000186965214 1020629778 /nfs/dbraw/zinc/62/97/78/1020629778.db2.gz MMPMDWOAEKYVKN-UHFFFAOYSA-N -1 3 307.349 3.523 20 10 DHCDHM C[C@H](NCc1c([O-])cccc1Cl)c1nc(C(C)(C)C)no1 ZINC000742390893 1021110859 /nfs/dbraw/zinc/11/08/59/1021110859.db2.gz TWEZJGKFDAXICS-VIFPVBQESA-N -1 3 309.797 3.577 20 10 DHCDHM [O-]c1c(CNc2cccc(O)c2)cc(Cl)c2cccnc12 ZINC001168526018 1021197751 /nfs/dbraw/zinc/19/77/51/1021197751.db2.gz PMJXWWDIRIMWHI-UHFFFAOYSA-N -1 3 300.745 3.912 20 10 DHCDHM O=C(NC1CCC(c2ccccc2)CC1)c1cccc(O)c1[O-] ZINC000776326839 1021286430 /nfs/dbraw/zinc/28/64/30/1021286430.db2.gz DITGSVSVPWDZJG-UHFFFAOYSA-N -1 3 311.381 3.554 20 10 DHCDHM Cc1cccc(C(=O)Nc2cccc(N3CCCCC3)c2)c1[O-] ZINC000919822274 1021922929 /nfs/dbraw/zinc/92/29/29/1021922929.db2.gz IINZPJOELKCOBU-UHFFFAOYSA-N -1 3 310.397 3.943 20 10 DHCDHM COc1ccc2cc(NC(=O)c3ccc(C)c(O)c3[O-])ccc2c1 ZINC000804308767 1022266575 /nfs/dbraw/zinc/26/65/75/1022266575.db2.gz ILZYJEJLUVYNHD-UHFFFAOYSA-N -1 3 323.348 3.820 20 10 DHCDHM CSCCc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000182316871 1022279128 /nfs/dbraw/zinc/27/91/28/1022279128.db2.gz AQOKELJELSIMAK-UHFFFAOYSA-N -1 3 317.410 3.564 20 10 DHCDHM C[C@H](Nc1ccc2oc(N(C)C)nc2c1)c1ccc(F)cc1[O-] ZINC000186475014 1022580113 /nfs/dbraw/zinc/58/01/13/1022580113.db2.gz OJAJWEMJEACGLL-JTQLQIEISA-N -1 3 315.348 3.912 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2ccc(F)cc2)C1 ZINC000768424099 1022966145 /nfs/dbraw/zinc/96/61/45/1022966145.db2.gz BXAHPEQTZAFCDW-KRWDZBQOSA-N -1 3 321.779 3.758 20 10 DHCDHM COc1cc(CN(C)Cc2c([O-])cccc2Cl)cc(OC)c1 ZINC000768538537 1022986373 /nfs/dbraw/zinc/98/63/73/1022986373.db2.gz WIFGBUGEMYGPFA-UHFFFAOYSA-N -1 3 321.804 3.695 20 10 DHCDHM CC(=O)N1CCc2c1cccc2NCc1c([O-])cccc1Cl ZINC000768944340 1023053894 /nfs/dbraw/zinc/05/38/94/1023053894.db2.gz BUMFADRSMNXTAM-UHFFFAOYSA-N -1 3 316.788 3.567 20 10 DHCDHM CCc1nc([C@@H](C)NCc2cc(F)cc(C(C)=O)c2[O-])cs1 ZINC000184718439 1023084618 /nfs/dbraw/zinc/08/46/18/1023084618.db2.gz ZPVMRYITWJGOCJ-SECBINFHSA-N -1 3 322.405 3.604 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCOC[C@H]1c1ccccc1 ZINC000769504329 1023169108 /nfs/dbraw/zinc/16/91/08/1023169108.db2.gz UHUHTUMGZMQBFK-INIZCTEOSA-N -1 3 303.789 3.619 20 10 DHCDHM Cc1ccc2cccc(NC(=O)c3ccc(C)c(O)c3[O-])c2n1 ZINC000770484394 1023319472 /nfs/dbraw/zinc/31/94/72/1023319472.db2.gz FEBMEWCZOXCUFH-UHFFFAOYSA-N -1 3 308.337 3.515 20 10 DHCDHM CCc1nn(C)cc1N[C@@H](C)c1cccc(C(F)(F)F)c1[O-] ZINC000788814816 1023939905 /nfs/dbraw/zinc/93/99/05/1023939905.db2.gz NEAVWZFIGGQREP-VIFPVBQESA-N -1 3 313.323 3.880 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@H]1CCCOc2ccc(F)cc21 ZINC000882915615 1024172041 /nfs/dbraw/zinc/17/20/41/1024172041.db2.gz VLRWDLCGHMBTFA-HNNXBMFYSA-N -1 3 323.314 3.813 20 10 DHCDHM CC(C)n1cc2c(n1)[C@H](NCc1cc(F)cc(F)c1[O-])CCC2 ZINC000883085478 1024235994 /nfs/dbraw/zinc/23/59/94/1024235994.db2.gz SCFRLFSPVCQLCD-OAHLLOKOSA-N -1 3 321.371 3.615 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)Nc2cc(F)ccc2C)c1 ZINC000756869864 1024239548 /nfs/dbraw/zinc/23/95/48/1024239548.db2.gz DRQWKSCUBQKCJX-LLVKDONJSA-N -1 3 303.333 3.799 20 10 DHCDHM CC(C)(NCc1cc(F)cc(F)c1[O-])c1ccccc1[N+](=O)[O-] ZINC000883126884 1024249974 /nfs/dbraw/zinc/24/99/74/1024249974.db2.gz DBECDGMKJWODDP-UHFFFAOYSA-N -1 3 322.311 3.604 20 10 DHCDHM CN(C(=O)c1cccc(O)c1[O-])C1CCC(C(C)(C)C)CC1 ZINC000790524922 1024318909 /nfs/dbraw/zinc/31/89/09/1024318909.db2.gz DWEOPMFRXQWNHB-UHFFFAOYSA-N -1 3 305.418 3.775 20 10 DHCDHM CC[C@@H](C)Oc1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790573200 1024329619 /nfs/dbraw/zinc/32/96/19/1024329619.db2.gz MTJBFGDAPBFOMY-LLVKDONJSA-N -1 3 301.342 3.527 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC(C2CCCCC2)CC1 ZINC000790544861 1024329692 /nfs/dbraw/zinc/32/96/92/1024329692.db2.gz WSNJGIOWDABMMT-UHFFFAOYSA-N -1 3 303.402 3.530 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000790863002 1024395980 /nfs/dbraw/zinc/39/59/80/1024395980.db2.gz RVZVENXEEGYNTO-OAHLLOKOSA-N -1 3 315.344 3.604 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@@H]1c2ccccc2CC[C@@H]1F ZINC000883381968 1024413467 /nfs/dbraw/zinc/41/34/67/1024413467.db2.gz XFTPOXBXBKMRIZ-GOEBONIOSA-N -1 3 307.315 3.786 20 10 DHCDHM Cc1csc([C@@H](NCc2ccc(F)c(F)c2[O-])C2CC2)n1 ZINC000877066672 1033224645 /nfs/dbraw/zinc/22/46/45/1033224645.db2.gz QMNHRNRTUJNEFI-ZDUSSCGKSA-N -1 3 310.369 3.676 20 10 DHCDHM C[C@@H](O)CN(Cc1ccccc1)Cc1c([O-])ccc(Cl)c1F ZINC000792166633 1024641180 /nfs/dbraw/zinc/64/11/80/1024641180.db2.gz FDFPGOPBFZBDDL-GFCCVEGCSA-N -1 3 323.795 3.568 20 10 DHCDHM Cc1nc2c(s1)[C@H](N(C)Cc1cc(F)cc(F)c1[O-])CCC2 ZINC000894021274 1025654563 /nfs/dbraw/zinc/65/45/63/1025654563.db2.gz QUPRQCNMZMOARX-CQSZACIVSA-N -1 3 324.396 3.945 20 10 DHCDHM C[C@H](Nc1ccc(O[C@@H]2CCOC2)cc1)c1c([O-])cccc1F ZINC000886575135 1025715766 /nfs/dbraw/zinc/71/57/66/1025715766.db2.gz HAEMUEQEMAOMKP-SWLSCSKDSA-N -1 3 317.360 3.872 20 10 DHCDHM C[C@@H](Nc1ccc(O[C@H]2CCOC2)cc1)c1c([O-])cccc1F ZINC000886575133 1025717073 /nfs/dbraw/zinc/71/70/73/1025717073.db2.gz HAEMUEQEMAOMKP-DOMZBBRYSA-N -1 3 317.360 3.872 20 10 DHCDHM COCC[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1ccc(C)o1 ZINC000886586068 1025723099 /nfs/dbraw/zinc/72/30/99/1025723099.db2.gz KKAOEMKZIXVPEL-GXTWGEPZSA-N -1 3 307.365 3.861 20 10 DHCDHM C[C@@H](NCc1ccc2c(n1)CCCC2)c1c([O-])cccc1F ZINC000886601271 1025730986 /nfs/dbraw/zinc/73/09/86/1025730986.db2.gz NYEIITZEZNCWDL-GFCCVEGCSA-N -1 3 300.377 3.656 20 10 DHCDHM COc1ccc([C@H](C)N[C@@H](C)c2c([O-])cccc2F)c(OC)c1 ZINC000886641481 1025753222 /nfs/dbraw/zinc/75/32/22/1025753222.db2.gz KSHNSDRKXRADNU-RYUDHWBXSA-N -1 3 319.376 3.960 20 10 DHCDHM CC[C@@H](NCc1ccn(C)n1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806150759 1025809962 /nfs/dbraw/zinc/80/99/62/1025809962.db2.gz ZMPPLUBUPYLZQI-CYBMUJFWSA-N -1 3 314.216 3.673 20 10 DHCDHM CC[C@H](NCc1ccn(C)n1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806150760 1025811634 /nfs/dbraw/zinc/81/16/34/1025811634.db2.gz ZMPPLUBUPYLZQI-ZDUSSCGKSA-N -1 3 314.216 3.673 20 10 DHCDHM [O-]c1ccc(Br)cc1CNC1(C(F)F)CCCC1 ZINC000808451115 1026292335 /nfs/dbraw/zinc/29/23/35/1026292335.db2.gz FGTLGLWYIQMJKN-UHFFFAOYSA-N -1 3 320.177 3.822 20 10 DHCDHM CN(C)c1ccccc1CN(C)Cc1c([O-])ccc(Cl)c1F ZINC000809787501 1026625749 /nfs/dbraw/zinc/62/57/49/1026625749.db2.gz GBKXDMYRBFFYDR-UHFFFAOYSA-N -1 3 322.811 3.883 20 10 DHCDHM O=C(Nc1cccc(N2CCCC2)c1)c1cc([O-])ccc1Cl ZINC000810166873 1026692007 /nfs/dbraw/zinc/69/20/07/1026692007.db2.gz QSTYIUJEGDWVIA-UHFFFAOYSA-N -1 3 316.788 3.898 20 10 DHCDHM CCc1nnc(CN[C@H](CC)c2cc(Cl)ccc2[O-])s1 ZINC000810260190 1026721102 /nfs/dbraw/zinc/72/11/02/1026721102.db2.gz GVHKUTUYPOGOSE-LLVKDONJSA-N -1 3 311.838 3.700 20 10 DHCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)[C@H]1[C@H]1CCCO1 ZINC000811510318 1027026789 /nfs/dbraw/zinc/02/67/89/1027026789.db2.gz CARXCQXGIJRCOX-HIFRSBDPSA-N -1 3 313.800 3.574 20 10 DHCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC3(CCC3)[C@@H]2C2CC2)c1[O-] ZINC000811513695 1027029743 /nfs/dbraw/zinc/02/97/43/1027029743.db2.gz MKTCJFHZNUJYSJ-HNNXBMFYSA-N -1 3 322.792 3.718 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)ccc2[O-])C[C@H](C(F)(F)F)O1 ZINC000814177235 1027911938 /nfs/dbraw/zinc/91/19/38/1027911938.db2.gz YRTIZDMLSDEGHP-GFCCVEGCSA-N -1 3 323.742 3.587 20 10 DHCDHM CCCc1nc(C)c(CNCc2cc(Cl)cc(F)c2[O-])o1 ZINC000814178013 1027913216 /nfs/dbraw/zinc/91/32/16/1027913216.db2.gz YRBCNTCHERPHLQ-UHFFFAOYSA-N -1 3 312.772 3.723 20 10 DHCDHM C[C@H]1CN(Cc2cccc(Cl)c2[O-])Cc2ccccc2O1 ZINC000814177948 1027916409 /nfs/dbraw/zinc/91/64/09/1027916409.db2.gz WGBKHMKOUXLVSF-LBPRGKRZSA-N -1 3 303.789 3.829 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CNCc1cccc(F)n1 ZINC000747926348 1027964758 /nfs/dbraw/zinc/96/47/58/1027964758.db2.gz QJDXRHRNBDDJLC-UHFFFAOYSA-N -1 3 301.148 3.523 20 10 DHCDHM C[C@@H](NCc1ccc(Cl)cc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779053478 1028074933 /nfs/dbraw/zinc/07/49/33/1028074933.db2.gz CIOMVSVRUWBDIQ-SECBINFHSA-N -1 3 324.739 3.944 20 10 DHCDHM [O-]c1cccc(Cl)c1CNCc1c(F)cc(F)cc1F ZINC000815152041 1028382966 /nfs/dbraw/zinc/38/29/66/1028382966.db2.gz GIAGRKSZAHESRR-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H](OCC2CC2)C1 ZINC000779188423 1028666462 /nfs/dbraw/zinc/66/64/62/1028666462.db2.gz NPROUTCYHBSWHY-CQSZACIVSA-N -1 3 313.800 3.576 20 10 DHCDHM CN(Cc1cc(Cl)c(F)cc1[O-])Cc1ccccc1[N+](=O)[O-] ZINC000816487766 1028892491 /nfs/dbraw/zinc/89/24/91/1028892491.db2.gz XJFSTUDAKUITME-UHFFFAOYSA-N -1 3 324.739 3.725 20 10 DHCDHM Cc1nc([C@H]2CCCCN2Cc2ccc3ccccc3c2[O-])no1 ZINC000816494723 1028899308 /nfs/dbraw/zinc/89/93/08/1028899308.db2.gz XOBSBZXHGJAHNY-QGZVFWFLSA-N -1 3 323.396 3.964 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@H](CC(F)(F)F)C1 ZINC000816592282 1028938400 /nfs/dbraw/zinc/93/84/00/1028938400.db2.gz FSEPNJLCLDLTJS-MRVPVSSYSA-N -1 3 311.706 3.959 20 10 DHCDHM Cc1nc(CNCc2cc(Cl)c(F)cc2[O-])sc1C ZINC000816554305 1028941211 /nfs/dbraw/zinc/94/12/11/1028941211.db2.gz UPLJZQDGTBRVQZ-UHFFFAOYSA-N -1 3 300.786 3.548 20 10 DHCDHM CC1(C)C[C@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000819749371 1029609736 /nfs/dbraw/zinc/60/97/36/1029609736.db2.gz NTKKWZZXDXNJEF-OAHLLOKOSA-N -1 3 311.381 3.711 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2Cc3cccc(Cl)c3C2)c1[O-] ZINC000805806885 1030176663 /nfs/dbraw/zinc/17/66/63/1030176663.db2.gz WPBSPNCCIGKFIX-UHFFFAOYSA-N -1 3 319.763 3.903 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1cncc(Br)c1 ZINC000120990339 1030188284 /nfs/dbraw/zinc/18/82/84/1030188284.db2.gz ZDTKPCIZCQBFCD-UHFFFAOYSA-N -1 3 313.582 3.815 20 10 DHCDHM COCc1cc(N[C@H](C)c2ccc(F)cc2[O-])ccc1OC ZINC000866499980 1030326839 /nfs/dbraw/zinc/32/68/39/1030326839.db2.gz RHSZTWRNQCXRKN-LLVKDONJSA-N -1 3 305.349 3.859 20 10 DHCDHM C[C@@H](Nc1cccc2c1OCCCO2)c1ccc(F)cc1[O-] ZINC000866619859 1030409948 /nfs/dbraw/zinc/40/99/48/1030409948.db2.gz VWHLWEUQORSLMI-LLVKDONJSA-N -1 3 303.333 3.866 20 10 DHCDHM C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928383633 1031293224 /nfs/dbraw/zinc/29/32/24/1031293224.db2.gz IWCLTIBXNQWNIA-CJNGLKHVSA-N -1 3 311.381 3.506 20 10 DHCDHM CCC1CCN(Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144299204 1031439873 /nfs/dbraw/zinc/43/98/73/1031439873.db2.gz RJXCIKZTZSAUGN-UHFFFAOYSA-N -1 3 316.214 3.916 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCCCC12CC2 ZINC001144306677 1031455640 /nfs/dbraw/zinc/45/56/40/1031455640.db2.gz LVPNKLOAMLSTRA-UHFFFAOYSA-N -1 3 314.198 3.812 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@H]1c1ccncc1 ZINC000293912891 1031693909 /nfs/dbraw/zinc/69/39/09/1031693909.db2.gz LWPGCYLVHZNYOV-HNNXBMFYSA-N -1 3 306.768 3.917 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CC[C@@]2(CC2(F)F)C1 ZINC000846118814 1031866919 /nfs/dbraw/zinc/86/69/19/1031866919.db2.gz ZFTXJXSSAQRPPY-GFCCVEGCSA-N -1 3 308.155 3.930 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1c(Cl)n[nH]c1C1CC1 ZINC000898214418 1031976381 /nfs/dbraw/zinc/97/63/81/1031976381.db2.gz CCDAVXJRLFBTBU-UHFFFAOYSA-N -1 3 312.200 3.589 20 10 DHCDHM CC[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CCCO1 ZINC000387523422 1033593921 /nfs/dbraw/zinc/59/39/21/1033593921.db2.gz BHOPSYDATPZONJ-LBPRGKRZSA-N -1 3 304.217 3.700 20 10 DHCDHM COc1cc2c(cc1F)CN(Cc1c([O-])cccc1Cl)CC2 ZINC000777440006 1034739732 /nfs/dbraw/zinc/73/97/32/1034739732.db2.gz CETKNYQGIBWUAK-UHFFFAOYSA-N -1 3 321.779 3.752 20 10 DHCDHM CCCN(Cc1cc(F)cc(C(C)=O)c1[O-])CC(F)(F)F ZINC000042776571 1035327384 /nfs/dbraw/zinc/32/73/84/1035327384.db2.gz ZNUIEXAIQWPUGE-UHFFFAOYSA-N -1 3 307.287 3.508 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1occc1-c1ccccc1 ZINC001178410515 1035428084 /nfs/dbraw/zinc/42/80/84/1035428084.db2.gz QZDXWJANTHXIMD-UHFFFAOYSA-N -1 3 311.312 3.721 20 10 DHCDHM CCCCOC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001193720575 1035718618 /nfs/dbraw/zinc/71/86/18/1035718618.db2.gz MZCUUTHETNLLBA-UHFFFAOYSA-N -1 3 308.765 3.620 20 10 DHCDHM CCn1c2ccccc2nc1CNCc1cccc(Cl)c1[O-] ZINC001180708502 1035749204 /nfs/dbraw/zinc/74/92/04/1035749204.db2.gz VXAQBSMLGULPIG-UHFFFAOYSA-N -1 3 315.804 3.705 20 10 DHCDHM C[C@@H]1[C@@H](C(F)(F)F)CCCN1Cc1cc(F)cc(F)c1[O-] ZINC001180970702 1035799687 /nfs/dbraw/zinc/79/96/87/1035799687.db2.gz WBKRXVGVKNVVRO-KCJUWKMLSA-N -1 3 309.278 3.833 20 10 DHCDHM COc1c([O-])c(CNc2ccc(Cl)c(C)c2)ccc1[N+](=O)[O-] ZINC001182616278 1036413282 /nfs/dbraw/zinc/41/32/82/1036413282.db2.gz MZTHOYTXFTWTDY-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1csc(-c2ccco2)n1 ZINC001201017508 1037495963 /nfs/dbraw/zinc/49/59/63/1037495963.db2.gz IASDHFJWNAUEAA-UHFFFAOYSA-N -1 3 322.336 3.677 20 10 DHCDHM CC(C)n1cc(NCc2cc(Cl)c3cccnc3c2[O-])cn1 ZINC001168522718 1038187879 /nfs/dbraw/zinc/18/78/79/1038187879.db2.gz UUAGQCOPGFXPFM-UHFFFAOYSA-N -1 3 316.792 3.983 20 10 DHCDHM COCCN(Cc1c([O-])ccc2ccccc21)CC(F)(F)F ZINC000063281742 1040185471 /nfs/dbraw/zinc/18/54/71/1040185471.db2.gz GMGTVZGHOMHMHL-UHFFFAOYSA-N -1 3 313.319 3.556 20 10 DHCDHM CCCOc1ccc(CN2CCCC[C@@H]2c2ncc[nH]2)c([O-])c1 ZINC000092729618 185336547 /nfs/dbraw/zinc/33/65/47/185336547.db2.gz CIMGMNBAHWWNSX-MRXNPFEDSA-N -1 3 315.417 3.631 20 10 DHCDHM COc1ccc(OC)c(CN[C@@H](C)c2cc(Cl)ccc2[O-])c1 ZINC000273399569 130117225 /nfs/dbraw/zinc/11/72/25/130117225.db2.gz MUECHDKBYMRWRJ-NSHDSACASA-N -1 3 321.804 3.914 20 10 DHCDHM C[C@H](N[C@@H](CO)c1ccc(F)cc1)c1cc(Cl)ccc1[O-] ZINC000273491767 130128140 /nfs/dbraw/zinc/12/81/40/130128140.db2.gz OJGUBLZLUGGBBD-BONVTDFDSA-N -1 3 309.768 3.569 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1[O-] ZINC000273533379 130133336 /nfs/dbraw/zinc/13/33/36/130133336.db2.gz WVRSSGFZYVQJJB-GHMZBOCLSA-N -1 3 304.321 3.851 20 10 DHCDHM C[C@H](N[C@H]1CCc2c1cccc2F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273606028 130143248 /nfs/dbraw/zinc/14/32/48/130143248.db2.gz UDLUZADYJJUQDN-QFYYESIMSA-N -1 3 316.332 3.778 20 10 DHCDHM CC(C)COC[C@H](N[C@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000297831613 132035916 /nfs/dbraw/zinc/03/59/16/132035916.db2.gz RXZDQMDTRKJKPR-HOTGVXAUSA-N -1 3 315.413 3.976 20 10 DHCDHM Cc1ccc(C(=O)N(C)C)cc1N[C@H](C)c1ccc(F)cc1[O-] ZINC000170789192 332636433 /nfs/dbraw/zinc/63/64/33/332636433.db2.gz HCRJXIULNVDCLP-GFCCVEGCSA-N -1 3 316.376 3.715 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC2(CCOCC2)CC1 ZINC000375315974 337007847 /nfs/dbraw/zinc/00/78/47/337007847.db2.gz CMZFOONLKLBZBB-UHFFFAOYSA-N -1 3 313.800 3.577 20 10 DHCDHM Cc1cc(Cl)cc(CN2CCO[C@@H](c3ccco3)C2)c1[O-] ZINC000180629065 337176777 /nfs/dbraw/zinc/17/67/77/337176777.db2.gz ZJPREEKHMBVWND-OAHLLOKOSA-N -1 3 307.777 3.521 20 10 DHCDHM Cc1cccc2c1OCC[C@@H]2NCc1cccc(Cl)c1[O-] ZINC000188128308 337270995 /nfs/dbraw/zinc/27/09/95/337270995.db2.gz XYVJWBPDHAGILF-HNNXBMFYSA-N -1 3 303.789 3.967 20 10 DHCDHM C[C@@H](NCC1(C)OCCCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000190667376 525419675 /nfs/dbraw/zinc/41/96/75/525419675.db2.gz FPRAXFHADGQYAP-SECBINFHSA-N -1 3 320.216 3.503 20 10 DHCDHM C[C@H](N[C@@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)c(F)c1[O-] ZINC000364809008 525590576 /nfs/dbraw/zinc/59/05/76/525590576.db2.gz MQBUGTSENQIMEW-QQXLSSBLSA-N -1 3 323.314 3.982 20 10 DHCDHM C[C@H](N[C@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)cc1[O-] ZINC000368482636 525639188 /nfs/dbraw/zinc/63/91/88/525639188.db2.gz NVBWUJYGJREPPQ-YNHOBRIKSA-N -1 3 305.324 3.843 20 10 DHCDHM COc1cccc(CN[C@H](C)c2ccc(F)c(F)c2[O-])c1OC ZINC000191210638 526036554 /nfs/dbraw/zinc/03/65/54/526036554.db2.gz IFTUEVAGCDMJBH-SNVBAGLBSA-N -1 3 323.339 3.538 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000829496443 604770333 /nfs/dbraw/zinc/77/03/33/604770333.db2.gz AMSPGFDJFCFAFA-QGZVFWFLSA-N -1 3 317.360 3.569 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000829496443 604770337 /nfs/dbraw/zinc/77/03/37/604770337.db2.gz AMSPGFDJFCFAFA-QGZVFWFLSA-N -1 3 317.360 3.569 20 10 DHCDHM Cc1cnc(C2CCN(Cc3cc(F)cc(F)c3[O-])CC2)s1 ZINC000894564692 1013421070 /nfs/dbraw/zinc/42/10/70/1013421070.db2.gz CZOJGUBVSALOPU-UHFFFAOYSA-N -1 3 324.396 3.815 20 10 DHCDHM C[C@H]1CCCN(Cc2cc(Br)cc(F)c2[O-])[C@H]1C ZINC000715712540 1018951570 /nfs/dbraw/zinc/95/15/70/1018951570.db2.gz LTBCSRAJMKTZKE-UWVGGRQHSA-N -1 3 316.214 3.914 20 10 DHCDHM C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592478093 978248987 /nfs/dbraw/zinc/24/89/87/978248987.db2.gz QPVWKHMWCFYUJY-NXEZZACHSA-N -1 3 319.323 3.862 20 10 DHCDHM C[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592541262 978428347 /nfs/dbraw/zinc/42/83/47/978428347.db2.gz WJBFEDXQMHITQP-KGLIPLIRSA-N -1 3 313.397 3.762 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCC[C@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599902230 984858324 /nfs/dbraw/zinc/85/83/24/984858324.db2.gz RRYTWRDWOOXZGC-ZNMIVQPWSA-N -1 3 305.418 3.857 20 10 DHCDHM CCN(Cc1ccccn1)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000126641631 1015489552 /nfs/dbraw/zinc/48/95/52/1015489552.db2.gz DIJGWGJLXYECBV-UHFFFAOYSA-N -1 3 318.804 3.665 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593233894 994394960 /nfs/dbraw/zinc/39/49/60/994394960.db2.gz UGBFQSLSPYIGEP-QFYYESIMSA-N -1 3 315.344 3.568 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593233895 994395107 /nfs/dbraw/zinc/39/51/07/994395107.db2.gz UGBFQSLSPYIGEP-QLJPJBMISA-N -1 3 315.344 3.568 20 10 DHCDHM C[C@@H](NCc1ccccc1Cl)c1cc(C(=O)[O-])ccc1O ZINC001593304580 994749721 /nfs/dbraw/zinc/74/97/21/994749721.db2.gz OIZHLGONSOJNDJ-SNVBAGLBSA-N -1 3 305.761 3.595 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccn(C)n1)c1cc(Cl)c(Cl)cc1[O-] ZINC000840815271 1017076638 /nfs/dbraw/zinc/07/66/38/1017076638.db2.gz DHUMPUXLMKEEQY-BDAKNGLRSA-N -1 3 314.216 3.844 20 10 DHCDHM CC[C@@H]1CO[C@@](C)(CCC(C)C)N1C(=O)c1cccc(O)c1[O-] ZINC001148218573 1032375559 /nfs/dbraw/zinc/37/55/59/1032375559.db2.gz GDBBULIZTGKCRO-ACJLOTCBSA-N -1 3 321.417 3.501 20 10 DHCDHM Cc1cc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)ccc1F ZINC000187058253 1018976099 /nfs/dbraw/zinc/97/60/99/1018976099.db2.gz HTUKWYJQFCMNDI-UHFFFAOYSA-N -1 3 323.389 3.566 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@H]1c2ccccc2OC[C@H]1F ZINC000922519525 1020110416 /nfs/dbraw/zinc/11/04/16/1020110416.db2.gz CMQZUNVXAJLQOQ-CJNGLKHVSA-N -1 3 307.752 3.607 20 10 DHCDHM Cc1nc(CNCc2c([O-])cccc2Cl)nc2ccccc12 ZINC000733327879 1020373686 /nfs/dbraw/zinc/37/36/86/1020373686.db2.gz YXWILXSODGIAFM-UHFFFAOYSA-N -1 3 313.788 3.587 20 10 DHCDHM C[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1nccn1C ZINC000850573034 1021616524 /nfs/dbraw/zinc/61/65/24/1021616524.db2.gz SODZCZXZYXLTJW-UWVGGRQHSA-N -1 3 313.323 3.556 20 10 DHCDHM CC(=O)N1CCc2c1cccc2N[C@H](C)c1ccc(F)cc1[O-] ZINC000769417065 1023145405 /nfs/dbraw/zinc/14/54/05/1023145405.db2.gz PIFMFNSFGKGUHT-LLVKDONJSA-N -1 3 314.360 3.613 20 10 DHCDHM CC(C)CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000770330300 1023299028 /nfs/dbraw/zinc/29/90/28/1023299028.db2.gz XDTSPCISYZSAPS-CYBMUJFWSA-N -1 3 318.244 3.946 20 10 DHCDHM COc1ccc(F)cc1[C@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000882899477 1024165074 /nfs/dbraw/zinc/16/50/74/1024165074.db2.gz NYLFWBGALWHGNX-VIFPVBQESA-N -1 3 311.303 3.669 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCc3sccc3[C@H]2C)c1[O-] ZINC000314965562 1024418626 /nfs/dbraw/zinc/41/86/26/1024418626.db2.gz AIFOYVLLEHNDHH-SNVBAGLBSA-N -1 3 319.401 3.915 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@H]2C)c1[O-] ZINC000791577747 1024519434 /nfs/dbraw/zinc/51/94/34/1024519434.db2.gz DKBKYDIQWQBPSD-OQPBUACISA-N -1 3 319.298 3.507 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@@H]2C)c1[O-] ZINC000791577750 1024519576 /nfs/dbraw/zinc/51/95/76/1024519576.db2.gz DKBKYDIQWQBPSD-SDBXPKJASA-N -1 3 319.298 3.507 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCN(c2ccc(F)cc2)CC1 ZINC000317355309 1024530188 /nfs/dbraw/zinc/53/01/88/1024530188.db2.gz RYHNOGKFXZJVMT-UHFFFAOYSA-N -1 3 320.795 3.507 20 10 DHCDHM C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000793232247 1024949321 /nfs/dbraw/zinc/94/93/21/1024949321.db2.gz VCQLPZHHYAVSQO-CBAPKCEASA-N -1 3 311.706 3.957 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2cccs2)C1 ZINC000120751487 1025049707 /nfs/dbraw/zinc/04/97/07/1025049707.db2.gz UNNCRRZGWIKMSL-CQSZACIVSA-N -1 3 309.818 3.681 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@@H]1[C@H]1CCCO1 ZINC000793608004 1025126468 /nfs/dbraw/zinc/12/64/68/1025126468.db2.gz HAIWNCPQKFLDEK-ZIAGYGMSSA-N -1 3 316.228 3.842 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@@H](C)[C@@H]2C)c1[O-] ZINC000135821126 1025287623 /nfs/dbraw/zinc/28/76/23/1025287623.db2.gz IXVWDJHMONQPJY-ONGXEEELSA-N -1 3 313.850 3.574 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@@H](C)c2c([O-])cccc2F)o1 ZINC000886532072 1025681239 /nfs/dbraw/zinc/68/12/39/1025681239.db2.gz CTSRDBOQYNOFCB-FZMZJTMJSA-N -1 3 307.365 3.725 20 10 DHCDHM COc1cccc2c1OCC[C@H]2N[C@@H](C)c1c([O-])cccc1F ZINC000886547973 1025697140 /nfs/dbraw/zinc/69/71/40/1025697140.db2.gz VLIZJOFZUKLGRF-SMDDNHRTSA-N -1 3 317.360 3.714 20 10 DHCDHM C[C@H](N[C@@H]1COc2ccc(Cl)cc21)c1c([O-])cccc1F ZINC000886552119 1025701561 /nfs/dbraw/zinc/70/15/61/1025701561.db2.gz UYKXQCDCOZHNLW-TVQRCGJNSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@@H](Nc1ccc(N2CCOCC2)cc1)c1c([O-])cccc1F ZINC000886564266 1025709607 /nfs/dbraw/zinc/70/96/07/1025709607.db2.gz RFRYJXOCISFRKC-CYBMUJFWSA-N -1 3 316.376 3.541 20 10 DHCDHM CCN(C)C(=O)c1cccc(N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886608888 1025736956 /nfs/dbraw/zinc/73/69/56/1025736956.db2.gz HRXXVQMMDDZQLG-GFCCVEGCSA-N -1 3 316.376 3.796 20 10 DHCDHM COC[C@H](N[C@@H](C)c1c([O-])cccc1F)c1cccc(OC)c1 ZINC000886636776 1025750660 /nfs/dbraw/zinc/75/06/60/1025750660.db2.gz UYPXBYJMKZEFFO-LRDDRELGSA-N -1 3 319.376 3.578 20 10 DHCDHM CCN(C)C(=O)c1cccc(N[C@H](C)c2ccc(F)cc2[O-])c1 ZINC000806170389 1025798837 /nfs/dbraw/zinc/79/88/37/1025798837.db2.gz RRKOFRIVKMXISA-GFCCVEGCSA-N -1 3 316.376 3.796 20 10 DHCDHM C[C@H](N[C@H]1CCCC1(F)F)c1ccc(Br)cc1[O-] ZINC000806179763 1025836673 /nfs/dbraw/zinc/83/66/73/1025836673.db2.gz GZVAGKISXPYGTR-UFBFGSQYSA-N -1 3 320.177 3.993 20 10 DHCDHM Cc1c2ccccc2n(C)c1CNCc1c(F)ccc([O-])c1F ZINC000513337216 1026480316 /nfs/dbraw/zinc/48/03/16/1026480316.db2.gz FAGTZUXBXMSDIP-UHFFFAOYSA-N -1 3 316.351 3.760 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)Nc2cc(C3CC3)ccn2)c1 ZINC000810258343 1026720649 /nfs/dbraw/zinc/72/06/49/1026720649.db2.gz MNSYCZIKOGMTBC-NSHDSACASA-N -1 3 312.369 3.624 20 10 DHCDHM CCCc1nc(C)c(CN[C@@H](C)c2cc(F)cc(F)c2[O-])o1 ZINC000813883582 1027749201 /nfs/dbraw/zinc/74/92/01/1027749201.db2.gz ALISMVIPYJHWBN-VIFPVBQESA-N -1 3 310.344 3.770 20 10 DHCDHM CCCc1nc(C)c(CN[C@H](C)c2cc(F)cc(F)c2[O-])o1 ZINC000813883574 1027750956 /nfs/dbraw/zinc/75/09/56/1027750956.db2.gz ALISMVIPYJHWBN-SECBINFHSA-N -1 3 310.344 3.770 20 10 DHCDHM CCc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2[O-])on1 ZINC000815582596 1028554613 /nfs/dbraw/zinc/55/46/13/1028554613.db2.gz KRHJFUJOWZDSHA-SECBINFHSA-N -1 3 314.307 3.812 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H](OCC2CC2)C1 ZINC000779188420 1028665985 /nfs/dbraw/zinc/66/59/85/1028665985.db2.gz NPROUTCYHBSWHY-AWEZNQCLSA-N -1 3 313.800 3.576 20 10 DHCDHM CCO[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000155455960 1029235459 /nfs/dbraw/zinc/23/54/59/1029235459.db2.gz CWCJRMFEWZMNOI-LBPRGKRZSA-N -1 3 304.217 3.700 20 10 DHCDHM Cc1cc(Br)c([O-])c(CN(C)Cc2ccoc2)c1 ZINC000781897059 1029436219 /nfs/dbraw/zinc/43/62/19/1029436219.db2.gz CDMKBKYRSICYTM-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000290896157 1030240606 /nfs/dbraw/zinc/24/06/06/1030240606.db2.gz LUJBBMZENHIDOF-GOEBONIOSA-N -1 3 307.821 3.579 20 10 DHCDHM Cc1cc([O-])c(CN(C)Cc2nccn2C(F)F)cc1Cl ZINC000824567454 1030582979 /nfs/dbraw/zinc/58/29/79/1030582979.db2.gz TXXZSTFXSYNDBH-UHFFFAOYSA-N -1 3 315.751 3.578 20 10 DHCDHM C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cccc([O-])c1F ZINC000872026962 1031410077 /nfs/dbraw/zinc/41/00/77/1031410077.db2.gz AGHSCEJFCZJHAN-LLVKDONJSA-N -1 3 306.356 3.587 20 10 DHCDHM CC(C)O[C@@H]1CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000846012846 1031804147 /nfs/dbraw/zinc/80/41/47/1031804147.db2.gz BHVJZSJGFXFQLI-GFCCVEGCSA-N -1 3 301.789 3.574 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC2(CC2(F)F)CC1 ZINC000846055212 1031847309 /nfs/dbraw/zinc/84/73/09/1031847309.db2.gz UKACSOFVLWXFSO-UHFFFAOYSA-N -1 3 305.727 3.806 20 10 DHCDHM Cc1cc([O-])c(CNCc2nc(C(C)(C)C)co2)cc1Cl ZINC000897941564 1031891683 /nfs/dbraw/zinc/89/16/83/1031891683.db2.gz BUHMQZNLLWVEDY-UHFFFAOYSA-N -1 3 308.809 3.929 20 10 DHCDHM CCN(Cc1cc(F)c(F)cc1[O-])Cc1cccc(F)c1F ZINC001142530315 1031946535 /nfs/dbraw/zinc/94/65/35/1031946535.db2.gz CRNMRKZNSNRAKK-UHFFFAOYSA-N -1 3 313.294 3.971 20 10 DHCDHM Cc1cnc(C2CCN(Cc3ccc(F)c(F)c3[O-])CC2)s1 ZINC000877479654 1033315561 /nfs/dbraw/zinc/31/55/61/1033315561.db2.gz VOUKWJSFLKIKNX-UHFFFAOYSA-N -1 3 324.396 3.815 20 10 DHCDHM Cc1ccoc1CN(C)Cc1c([O-])cccc1Br ZINC000862374352 1033833437 /nfs/dbraw/zinc/83/34/37/1033833437.db2.gz LVYZUAHYXBSDJK-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM CCC1(c2ccccc2)CN(Cc2ccc(F)c(F)c2[O-])C1 ZINC001206224087 1034401286 /nfs/dbraw/zinc/40/12/86/1034401286.db2.gz LMZQBFFXTNDFCM-UHFFFAOYSA-N -1 3 303.352 3.834 20 10 DHCDHM C[C@@H](c1cccnc1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000183727052 1034414207 /nfs/dbraw/zinc/41/42/07/1034414207.db2.gz KBZUQMHNPYXRQP-JTQLQIEISA-N -1 3 321.764 3.542 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1c(Cl)nc2ccccn21 ZINC001179771900 1035496853 /nfs/dbraw/zinc/49/68/53/1035496853.db2.gz QMISNFGKICVAKJ-UHFFFAOYSA-N -1 3 322.195 3.637 20 10 DHCDHM COc1cccc(CN(C)Cc2cc(Cl)cc(F)c2[O-])c1 ZINC000775643478 1036164961 /nfs/dbraw/zinc/16/49/61/1036164961.db2.gz YTKNEJZYFWGTFC-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCOC2(C1)CCCCCC2 ZINC000775725127 1036566051 /nfs/dbraw/zinc/56/60/51/1036566051.db2.gz IWDIFQJGYQEOQL-UHFFFAOYSA-N -1 3 309.837 3.971 20 10 DHCDHM COc1c([O-])c(CNc2ccc(SC)cc2)ccc1[N+](=O)[O-] ZINC000774915340 1037214602 /nfs/dbraw/zinc/21/46/02/1037214602.db2.gz NMRDXSPLGSZDKN-UHFFFAOYSA-N -1 3 320.370 3.643 20 10 DHCDHM Cc1cc(Br)c([O-])c(CNc2cnccc2C)c1 ZINC001201573032 1037785871 /nfs/dbraw/zinc/78/58/71/1037785871.db2.gz KZHPWLCERYIPKT-UHFFFAOYSA-N -1 3 307.191 3.779 20 10 DHCDHM Cc1ncc(NCc2cc(Cl)c3cccnc3c2[O-])nc1C ZINC001168522192 1038026133 /nfs/dbraw/zinc/02/61/33/1038026133.db2.gz AXXDEXMSLIKLAI-UHFFFAOYSA-N -1 3 314.776 3.613 20 10 DHCDHM CC[C@H](NCc1ccn(C)n1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775527014 1038644449 /nfs/dbraw/zinc/64/44/49/1038644449.db2.gz VKWJAAXDYBLETJ-LBPRGKRZSA-N -1 3 314.216 3.673 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@H](C)c2ccccn2)c1[O-] ZINC000091703527 193094476 /nfs/dbraw/zinc/09/44/76/193094476.db2.gz RESCICKBBYFGNQ-LLVKDONJSA-N -1 3 318.804 3.836 20 10 DHCDHM CC[C@H](N[C@@H](C)c1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000272864203 130070084 /nfs/dbraw/zinc/07/00/84/130070084.db2.gz NKPJJLPQIUBTFD-ZFWWWQNUSA-N -1 3 314.433 3.512 20 10 DHCDHM C[C@@H](NCc1c(F)cccc1OC(F)F)c1ccccc1[O-] ZINC000272914186 130073340 /nfs/dbraw/zinc/07/33/40/130073340.db2.gz WZUKCHDOGWYWTC-SNVBAGLBSA-N -1 3 311.303 3.984 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)NC2(c3ccccc3)CC2)c1 ZINC000273345714 130109350 /nfs/dbraw/zinc/10/93/50/130109350.db2.gz ANXXGCFMUXVWRB-ZDUSSCGKSA-N -1 3 311.381 3.519 20 10 DHCDHM COc1cccc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273390277 130115988 /nfs/dbraw/zinc/11/59/88/130115988.db2.gz KKZFVNGIPNHEOH-NEPJUHHUSA-N -1 3 316.357 3.721 20 10 DHCDHM C[C@@H](N[C@@H](CO)c1ccc(F)cc1)c1cc(Cl)ccc1[O-] ZINC000273491765 130128221 /nfs/dbraw/zinc/12/82/21/130128221.db2.gz OJGUBLZLUGGBBD-BMIGLBTASA-N -1 3 309.768 3.569 20 10 DHCDHM CC[C@@H](NCc1ccn(Cc2ccccc2)n1)c1ccccc1[O-] ZINC000284363276 131074128 /nfs/dbraw/zinc/07/41/28/131074128.db2.gz NEJLIVLZVFKHHO-LJQANCHMSA-N -1 3 321.424 3.878 20 10 DHCDHM Cc1cc(CN[C@H](C)c2cc(Cl)c(Cl)cc2[O-])n(C)n1 ZINC000284385487 131076134 /nfs/dbraw/zinc/07/61/34/131076134.db2.gz OYISLDYCXUQTOX-SECBINFHSA-N -1 3 314.216 3.592 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000286148490 131222127 /nfs/dbraw/zinc/22/21/27/131222127.db2.gz NYVYVGCHOXPPAW-DJIMGWMZSA-N -1 3 323.392 3.506 20 10 DHCDHM CC[C@@H](N[C@@H](CCOC)c1ccco1)c1ccc(F)cc1[O-] ZINC000286302506 131229257 /nfs/dbraw/zinc/22/92/57/131229257.db2.gz XBKJXJPLSDPZFP-CABCVRRESA-N -1 3 307.365 3.943 20 10 DHCDHM C[C@H](N[C@@H](C)C(F)(F)F)c1cc(Br)ccc1[O-] ZINC000287310426 131274410 /nfs/dbraw/zinc/27/44/10/131274410.db2.gz LEHIEQKYBUWWFZ-BQBZGAKWSA-N -1 3 312.129 3.756 20 10 DHCDHM CC[C@H](NCc1cc(F)cnc1Cl)c1ccc(F)cc1[O-] ZINC000297300628 132008668 /nfs/dbraw/zinc/00/86/68/132008668.db2.gz MJERQFZFFTVIHD-ZDUSSCGKSA-N -1 3 312.747 3.960 20 10 DHCDHM COc1ccc([C@H](C)NCc2cc(F)cc(C(C)=O)c2[O-])cc1 ZINC000271651998 334025031 /nfs/dbraw/zinc/02/50/31/334025031.db2.gz JDHBYXMRXMLZJV-NSHDSACASA-N -1 3 317.360 3.593 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@H](C)c2cc(F)ccc2[O-])cs1 ZINC000273460898 334047330 /nfs/dbraw/zinc/04/73/30/334047330.db2.gz CQDIWLMCQHGBMN-ZJUUUORDSA-N -1 3 310.394 3.546 20 10 DHCDHM C[C@H](N[C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc(F)c(F)c1[O-] ZINC000367578628 336825713 /nfs/dbraw/zinc/82/57/13/336825713.db2.gz WKDJOMKMQVGOHL-BEPCFFQHSA-N -1 3 323.314 3.982 20 10 DHCDHM C[C@H](N[C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc(F)cc1[O-] ZINC000368586511 336848686 /nfs/dbraw/zinc/84/86/86/336848686.db2.gz YUKTZULHPCMAJE-YMNVWFMLSA-N -1 3 305.324 3.843 20 10 DHCDHM CC[C@H](c1ccccc1[O-])N1CCCC[C@H]1c1noc(C)n1 ZINC000377615649 337056324 /nfs/dbraw/zinc/05/63/24/337056324.db2.gz MZDWLXVAXLBXMD-CABCVRRESA-N -1 3 301.390 3.762 20 10 DHCDHM CC[C@H](N[C@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1[O-] ZINC000183339164 337191470 /nfs/dbraw/zinc/19/14/70/337191470.db2.gz DLODATFYCJUOHX-PBHICJAKSA-N -1 3 322.412 3.775 20 10 DHCDHM C[C@H](NCc1ncc(-c2ccccc2)cn1)c1cc(F)ccc1[O-] ZINC000186052880 337253253 /nfs/dbraw/zinc/25/32/53/337253253.db2.gz SJQAMOIUCAUPTP-ZDUSSCGKSA-N -1 3 323.371 3.839 20 10 DHCDHM Cc1ccc([C@H](C)N[C@@H](C)c2cn(-c3ccccc3)nn2)c([O-])c1 ZINC000186113198 337253856 /nfs/dbraw/zinc/25/38/56/337253856.db2.gz RLKSYVCSXOULTB-GJZGRUSLSA-N -1 3 322.412 3.693 20 10 DHCDHM CN1Cc2ccc(NCc3c([O-])ccc(Cl)c3F)cc2C1 ZINC000191407967 337296793 /nfs/dbraw/zinc/29/67/93/337296793.db2.gz CHEZRHFTVXITTK-UHFFFAOYSA-N -1 3 306.768 3.742 20 10 DHCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](c2ccsc2)O1 ZINC000180223353 524611039 /nfs/dbraw/zinc/61/10/39/524611039.db2.gz KAVPSZNBLCOJHS-MEDUHNTESA-N -1 3 307.390 3.555 20 10 DHCDHM C[C@@H](N[C@@H]1CCOc2c(F)cccc21)c1ccc(F)c(F)c1[O-] ZINC000364798585 525648102 /nfs/dbraw/zinc/64/81/02/525648102.db2.gz LQYSGJUWRPUGAW-YMTOWFKASA-N -1 3 323.314 3.984 20 10 DHCDHM O=[N+]([O-])c1cc(Cl)cc(CN[C@@H]2CCCc3occc32)c1[O-] ZINC000237959623 527332001 /nfs/dbraw/zinc/33/20/01/527332001.db2.gz MVLRSPWSAMEDKR-GFCCVEGCSA-N -1 3 322.748 3.714 20 10 DHCDHM CC(C)(O)c1ccc(CNCc2c([O-])cccc2Cl)cc1 ZINC000274857782 535326171 /nfs/dbraw/zinc/32/61/71/535326171.db2.gz YYUXJXKXNYVUGU-UHFFFAOYSA-N -1 3 305.805 3.563 20 10 DHCDHM C[C@@H]1C[C@@H](c2cccnc2)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461199 1013378123 /nfs/dbraw/zinc/37/81/23/1013378123.db2.gz CYURPFHMYNVYSC-BZNIZROVSA-N -1 3 304.340 3.649 20 10 DHCDHM C[C@H]1C[C@@H](c2cccnc2)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461201 1013378815 /nfs/dbraw/zinc/37/88/15/1013378815.db2.gz CYURPFHMYNVYSC-ZBEGNZNMSA-N -1 3 304.340 3.649 20 10 DHCDHM COCCOc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000083607967 1013987327 /nfs/dbraw/zinc/98/73/27/1013987327.db2.gz YRHIBJZFKUTXNG-UHFFFAOYSA-N -1 3 307.777 3.683 20 10 DHCDHM C[C@@H](C[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-])c1cccc(F)c1 ZINC001592704918 979165374 /nfs/dbraw/zinc/16/53/74/979165374.db2.gz AEMJBXQQZUENJD-NWDGAFQWSA-N -1 3 317.360 3.684 20 10 DHCDHM C[C@@H](Cc1ccccc1F)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592896670 979798111 /nfs/dbraw/zinc/79/81/11/979798111.db2.gz RFDKXYYXGGAOMD-RYUDHWBXSA-N -1 3 317.360 3.511 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1cnc(C2CCCC2)s1 ZINC000896642015 1015694889 /nfs/dbraw/zinc/69/48/89/1015694889.db2.gz VZKBXCCQIGQRQA-UHFFFAOYSA-N -1 3 306.406 3.935 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593219447 994299336 /nfs/dbraw/zinc/29/93/36/994299336.db2.gz OEYVWSNVJKZYFX-SJKOYZFVSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCSC2(CCC2)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593232601 994385741 /nfs/dbraw/zinc/38/57/41/994385741.db2.gz OAFWPXFTFVZRIQ-DGCLKSJQSA-N -1 3 321.442 3.559 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593233762 994394663 /nfs/dbraw/zinc/39/46/63/994394663.db2.gz UGBFQSLSPYIGEP-HWPZZCPQSA-N -1 3 315.344 3.568 20 10 DHCDHM C[C@@H]([NH2+]CCCc1ccccc1F)c1cc(C(=O)[O-])ccc1[O-] ZINC001593266357 994580197 /nfs/dbraw/zinc/58/01/97/994580197.db2.gz CVCXYWYVJVOCTJ-GFCCVEGCSA-N -1 3 317.360 3.513 20 10 DHCDHM O=C1CSc2ccc(NCc3c([O-])cccc3Cl)cc2N1 ZINC000148124373 1016986727 /nfs/dbraw/zinc/98/67/27/1016986727.db2.gz PJWLYZCLJPCTRV-UHFFFAOYSA-N -1 3 320.801 3.702 20 10 DHCDHM O=C(Nc1cc(-c2cccc(F)c2)ccn1)c1cccc(O)c1[O-] ZINC001148212777 1032372355 /nfs/dbraw/zinc/37/23/55/1032372355.db2.gz LYEFHXQOWVOWEC-UHFFFAOYSA-N -1 3 324.311 3.551 20 10 DHCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC000035685953 1012184184 /nfs/dbraw/zinc/18/41/84/1012184184.db2.gz XXEASRIZSCBEHP-UHFFFAOYSA-N -1 3 313.378 3.655 20 10 DHCDHM O=C([N-]c1c2nonc2ccc1Cl)c1ccsc1Cl ZINC001128704335 1017970604 /nfs/dbraw/zinc/97/06/04/1017970604.db2.gz GXUASNVNVWRHTA-UHFFFAOYSA-N -1 3 314.153 3.843 20 10 DHCDHM COCCOc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1 ZINC000170789421 1019434335 /nfs/dbraw/zinc/43/43/35/1019434335.db2.gz MQWNHEHRSFVMOF-LBPRGKRZSA-N -1 3 305.349 3.730 20 10 DHCDHM CCCc1cc(=O)[n-]c(C(=Cc2ccc3c(c2)CCN3C)CC)n1 ZINC000588611140 1019620704 /nfs/dbraw/zinc/62/07/04/1019620704.db2.gz SZAJPLFWLVDDMB-RVDMUPIBSA-N -1 3 323.440 3.665 20 10 DHCDHM COCCN(Cc1ccc(C)o1)Cc1c([O-])cccc1Cl ZINC000131664682 1020453979 /nfs/dbraw/zinc/45/39/79/1020453979.db2.gz VTNHUXWEQPEIHL-UHFFFAOYSA-N -1 3 309.793 3.596 20 10 DHCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)cc1 ZINC000776328186 1021287433 /nfs/dbraw/zinc/28/74/33/1021287433.db2.gz ZPXUWWJDLATJIY-ZDUSSCGKSA-N -1 3 305.761 3.632 20 10 DHCDHM C[C@H](Nc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1[O-] ZINC000170789583 1021554042 /nfs/dbraw/zinc/55/40/42/1021554042.db2.gz IXKRNGLHYXSGJE-ZDUSSCGKSA-N -1 3 311.360 3.949 20 10 DHCDHM COc1cccc(OC)c1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000850504862 1021566876 /nfs/dbraw/zinc/56/68/76/1021566876.db2.gz GXTDFBYAGDMTME-JTQLQIEISA-N -1 3 323.339 3.538 20 10 DHCDHM Cc1ccc(C(=O)Nc2cc(F)ccc2OC(C)C)c([O-])c1O ZINC000179475133 1022448315 /nfs/dbraw/zinc/44/83/15/1022448315.db2.gz DUNOCLTULMDKKM-UHFFFAOYSA-N -1 3 319.332 3.585 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CC(Cc2ccsc2)C1 ZINC000857067853 1022940603 /nfs/dbraw/zinc/94/06/03/1022940603.db2.gz HDGJGBJTXLCBHS-UHFFFAOYSA-N -1 3 311.809 3.921 20 10 DHCDHM Cc1c(NC(=O)c2cccc(O)c2[O-])cccc1C(F)(F)F ZINC000193133892 1023080961 /nfs/dbraw/zinc/08/09/61/1023080961.db2.gz PLMBZJRBESLZHJ-UHFFFAOYSA-N -1 3 311.259 3.677 20 10 DHCDHM CCCn1ccc2ccc(NC(=O)c3cccc(O)c3[O-])cc21 ZINC000790773035 1024373553 /nfs/dbraw/zinc/37/35/53/1024373553.db2.gz OYFUNCBGLIQPHP-UHFFFAOYSA-N -1 3 310.353 3.715 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000188352921 1024500604 /nfs/dbraw/zinc/50/06/04/1024500604.db2.gz AHUVCDSRUPGDFJ-QGZVFWFLSA-N -1 3 323.392 3.780 20 10 DHCDHM Cc1csc([C@H](NCc2ccc(F)c(F)c2[O-])C2CC2)n1 ZINC000877066671 1033224271 /nfs/dbraw/zinc/22/42/71/1033224271.db2.gz QMNHRNRTUJNEFI-CYBMUJFWSA-N -1 3 310.369 3.676 20 10 DHCDHM CC(C)OC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792166656 1024640448 /nfs/dbraw/zinc/64/04/48/1024640448.db2.gz FFNLMIGIEONOOD-UHFFFAOYSA-N -1 3 301.789 3.574 20 10 DHCDHM COCCOc1cccc(N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886565859 1025709536 /nfs/dbraw/zinc/70/95/36/1025709536.db2.gz BHJDAJYEKURZQB-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(c2ccncc2)CC1 ZINC000809730687 1026597433 /nfs/dbraw/zinc/59/74/33/1026597433.db2.gz ZJBKCCIVFFJXPB-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM [O-]c1ccc(F)cc1CN1CCCn2c(cc3ccccc32)C1 ZINC000809782636 1026624404 /nfs/dbraw/zinc/62/44/04/1026624404.db2.gz BJFXEYYUWINRNC-UHFFFAOYSA-N -1 3 310.372 3.892 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)Nc2cc(C3CC3)ccn2)c1 ZINC000810258342 1026721168 /nfs/dbraw/zinc/72/11/68/1026721168.db2.gz MNSYCZIKOGMTBC-LLVKDONJSA-N -1 3 312.369 3.624 20 10 DHCDHM Cc1nn(C)c2cc(NCc3c([O-])cccc3Cl)ccc12 ZINC000812773624 1027399173 /nfs/dbraw/zinc/39/91/73/1027399173.db2.gz JFQYZZSOLOKXDE-UHFFFAOYSA-N -1 3 301.777 3.853 20 10 DHCDHM C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126395940 1027550389 /nfs/dbraw/zinc/55/03/89/1027550389.db2.gz MROLBZKZKUORAK-JTQLQIEISA-N -1 3 305.761 3.584 20 10 DHCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])Cc2ccccc2O1 ZINC000814177947 1027913366 /nfs/dbraw/zinc/91/33/66/1027913366.db2.gz WGBKHMKOUXLVSF-GFCCVEGCSA-N -1 3 303.789 3.829 20 10 DHCDHM C[C@H](NCc1c(F)cc(F)cc1F)c1cc(F)cc(F)c1[O-] ZINC000815649550 1028591926 /nfs/dbraw/zinc/59/19/26/1028591926.db2.gz SRNPUPPWHYQTSJ-ZETCQYMHSA-N -1 3 317.257 3.939 20 10 DHCDHM CCCCN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCC[C@H](C)C1 ZINC000818802269 1029433132 /nfs/dbraw/zinc/43/31/32/1029433132.db2.gz LKCKWDQXAMDGMG-UONOGXRCSA-N -1 3 305.418 3.919 20 10 DHCDHM Cc1cc([O-])c(CN2CCOC[C@H]2c2ccco2)cc1Cl ZINC000824802191 1030645328 /nfs/dbraw/zinc/64/53/28/1030645328.db2.gz IHCKJYAWBYFDEA-AWEZNQCLSA-N -1 3 307.777 3.521 20 10 DHCDHM Cc1ccc(C(=O)N(CC2CC2)c2cccc(F)c2)c([O-])c1O ZINC000869718048 1030842262 /nfs/dbraw/zinc/84/22/62/1030842262.db2.gz NGHPWNPSMANRIL-UHFFFAOYSA-N -1 3 315.344 3.602 20 10 DHCDHM Cc1n[nH]c(C)c1[C@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000293957528 1031720743 /nfs/dbraw/zinc/72/07/43/1031720743.db2.gz PPRANMTYQSCCQQ-CQSZACIVSA-N -1 3 323.799 3.862 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(C)[C@@H](C)c2cccc(O)c2)c1[O-] ZINC000177280772 1034148936 /nfs/dbraw/zinc/14/89/36/1034148936.db2.gz NAEDIYGXLWOECV-NSHDSACASA-N -1 3 317.360 3.633 20 10 DHCDHM N=c1ccc(/N=N/c2ccccc2)c(N)n1-c1ccc([O-])c(F)c1 ZINC001174734185 1034587766 /nfs/dbraw/zinc/58/77/66/1034587766.db2.gz QSBYWRJSLLDVKY-YWTBVUPUSA-N -1 3 323.331 3.799 20 10 DHCDHM CCCCCNC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001193346480 1035611547 /nfs/dbraw/zinc/61/15/47/1035611547.db2.gz LJEORZGKDMYUGN-UHFFFAOYSA-N -1 3 321.808 3.583 20 10 DHCDHM [O-]c1cc(F)c(F)cc1CN1CC(c2ccc(Cl)cc2)C1 ZINC001181826935 1036006988 /nfs/dbraw/zinc/00/69/88/1036006988.db2.gz IFWJAVVQNYZQJK-UHFFFAOYSA-N -1 3 309.743 3.923 20 10 DHCDHM O=C1CCC[C@@H]2CN(Cc3cc(Cl)cc(Cl)c3[O-])C[C@@H]12 ZINC001203586468 1036825392 /nfs/dbraw/zinc/82/53/92/1036825392.db2.gz OHODLPHRDQWCGA-BXKDBHETSA-N -1 3 314.212 3.500 20 10 DHCDHM C[C@@H](NCc1nnc(C2CC2)s1)c1ccc(Cl)cc1[O-] ZINC000841755326 1037033366 /nfs/dbraw/zinc/03/33/66/1037033366.db2.gz JGKXJGIQBJQHJJ-MRVPVSSYSA-N -1 3 309.822 3.625 20 10 DHCDHM CCc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2[O-])cc1F ZINC000774927447 1037239047 /nfs/dbraw/zinc/23/90/47/1037239047.db2.gz GWYLEQLCTUIPHZ-UHFFFAOYSA-N -1 3 320.320 3.623 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCc2ccc(Br)cc21 ZINC001205347381 1037359777 /nfs/dbraw/zinc/35/97/77/1037359777.db2.gz NCPBGGBBBOILTA-UHFFFAOYSA-N -1 3 322.177 3.857 20 10 DHCDHM CCc1cc(NCc2ccc([N+](=O)[O-])c(OC)c2[O-])ccc1C ZINC000775057872 1037520665 /nfs/dbraw/zinc/52/06/65/1037520665.db2.gz OPDFIXQGAQAOCD-UHFFFAOYSA-N -1 3 316.357 3.792 20 10 DHCDHM C[C@@H](Nc1ccc(N2CCCC2)nc1)c1ccc(F)cc1[O-] ZINC000170789167 1038964707 /nfs/dbraw/zinc/96/47/07/1038964707.db2.gz RCYUAGFYKOWFST-GFCCVEGCSA-N -1 3 301.365 3.700 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCCC[C@H]1C(F)F ZINC000800533194 1040965053 /nfs/dbraw/zinc/96/50/53/1040965053.db2.gz JWSJSQRCCZWXBT-NSHDSACASA-N -1 3 320.177 3.774 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])c1ccc(F)cc1F ZINC000273414969 130118865 /nfs/dbraw/zinc/11/88/65/130118865.db2.gz QRWJQMLABQTOSK-ZJUUUORDSA-N -1 3 322.311 3.990 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273414967 130118910 /nfs/dbraw/zinc/11/89/10/130118910.db2.gz QRWJQMLABQTOSK-VHSXEESVSA-N -1 3 322.311 3.990 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@H](C)c2ccc(F)cc2[O-])cs1 ZINC000273551096 130134991 /nfs/dbraw/zinc/13/49/91/130134991.db2.gz FWIBANWYPFIFEA-ZJUUUORDSA-N -1 3 310.394 3.546 20 10 DHCDHM COc1cc(Cl)cc(CN2CCC[C@@H]2c2ccc[nH]2)c1[O-] ZINC000273723060 130159376 /nfs/dbraw/zinc/15/93/76/130159376.db2.gz ITCNHYNUPADBFP-CQSZACIVSA-N -1 3 306.793 3.719 20 10 DHCDHM COc1cc(Cl)cc(CN2CC=C(C(F)(F)F)CC2)c1[O-] ZINC000273789799 130167414 /nfs/dbraw/zinc/16/74/14/130167414.db2.gz UYZFDNJEQADSMB-UHFFFAOYSA-N -1 3 321.726 3.749 20 10 DHCDHM C[C@@H](N[C@H]1CCc2c1cccc2O)c1ccc(F)c(F)c1[O-] ZINC000276885465 130555908 /nfs/dbraw/zinc/55/59/08/130555908.db2.gz GQIJKMLCLYWSAU-OTYXRUKQSA-N -1 3 305.324 3.714 20 10 DHCDHM CC[C@H](N[C@@H](COC)c1ccccc1)c1ccc(F)cc1[O-] ZINC000286000727 131214360 /nfs/dbraw/zinc/21/43/60/131214360.db2.gz HNMDYOZIGJDLDO-IRXDYDNUSA-N -1 3 303.377 3.960 20 10 DHCDHM CC[C@@H](NCc1cn2c(cccc2C)n1)c1ccc(F)cc1[O-] ZINC000286273088 131227289 /nfs/dbraw/zinc/22/72/89/131227289.db2.gz VLUZVNAGRDUBEE-MRXNPFEDSA-N -1 3 313.376 3.728 20 10 DHCDHM Cc1c(N[C@@H](C)c2cc(F)ccc2[O-])cnn1C1CCOCC1 ZINC000297361385 132011888 /nfs/dbraw/zinc/01/18/88/132011888.db2.gz PSZSSJDPJOCIPZ-NSHDSACASA-N -1 3 319.380 3.561 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1ccc([N+](=O)[O-])cc1 ZINC000296250872 335142889 /nfs/dbraw/zinc/14/28/89/335142889.db2.gz BHHJEHPNXOKPED-UWVGGRQHSA-N -1 3 322.311 3.990 20 10 DHCDHM COc1ccc([C@@H](C)NCc2cc(F)cc(C(C)=O)c2[O-])cc1 ZINC000271651996 334024996 /nfs/dbraw/zinc/02/49/96/334024996.db2.gz JDHBYXMRXMLZJV-LLVKDONJSA-N -1 3 317.360 3.593 20 10 DHCDHM CC(C)[C@H](NCc1ccccc1[O-])c1nc(-c2ccccc2)no1 ZINC000368851108 336854032 /nfs/dbraw/zinc/85/40/32/336854032.db2.gz OLXAOLWNIDWSIE-KRWDZBQOSA-N -1 3 323.396 3.929 20 10 DHCDHM COc1ccc2c(c1)OCC[C@H]2N[C@@H](C)c1ccc(F)cc1[O-] ZINC000371871235 336915367 /nfs/dbraw/zinc/91/53/67/336915367.db2.gz YLNVKQBFUFOLRA-MEDUHNTESA-N -1 3 317.360 3.714 20 10 DHCDHM COc1cccc([C@H](NCc2ccccc2[O-])c2ccccn2)c1 ZINC000375073277 337002541 /nfs/dbraw/zinc/00/25/41/337002541.db2.gz DUSLQVJDLXEFBM-FQEVSTJZSA-N -1 3 320.392 3.675 20 10 DHCDHM C[C@@H](N[C@@H]1CCOc2c(F)cccc21)c1ccc(F)cc1[O-] ZINC000375345061 337008482 /nfs/dbraw/zinc/00/84/82/337008482.db2.gz KTJUROZQUQEYSY-MEBBXXQBSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccccc1[O-])c1nccn1-c1ccccc1 ZINC000376563429 337036874 /nfs/dbraw/zinc/03/68/74/337036874.db2.gz TXIHYYSBJCCKDL-LSDHHAIUSA-N -1 3 307.397 3.990 20 10 DHCDHM COc1cc(Cl)cc(CN[C@@H](C)c2ncc(C)s2)c1[O-] ZINC000228675955 337078118 /nfs/dbraw/zinc/07/81/18/337078118.db2.gz YOFNFCDZCNIJKD-VIFPVBQESA-N -1 3 312.822 3.670 20 10 DHCDHM C[C@H](NCc1nnc(-c2ccccc2)s1)c1ccccc1[O-] ZINC000183617591 337193804 /nfs/dbraw/zinc/19/38/04/337193804.db2.gz PWDXTNDOSJMQQF-LBPRGKRZSA-N -1 3 311.410 3.762 20 10 DHCDHM C[C@H](NCc1ncc(-c2ccccc2)cn1)c1ccccc1[O-] ZINC000186061725 337253250 /nfs/dbraw/zinc/25/32/50/337253250.db2.gz MIIUNIFUBPZXSW-AWEZNQCLSA-N -1 3 305.381 3.700 20 10 DHCDHM Cc1cccc2c1OCC[C@@H]2NCc1cc(Cl)ccc1[O-] ZINC000188950587 337276928 /nfs/dbraw/zinc/27/69/28/337276928.db2.gz QLYJMFXCVLFUQM-HNNXBMFYSA-N -1 3 303.789 3.967 20 10 DHCDHM CCSc1cc(CNCc2cccc(Cl)c2[O-])ccn1 ZINC000190198194 521734198 /nfs/dbraw/zinc/73/41/98/521734198.db2.gz FABTXLAOUXGNRH-UHFFFAOYSA-N -1 3 308.834 3.842 20 10 DHCDHM Cc1nnc(-c2cc(F)ccc2NCc2cc(F)ccc2[O-])o1 ZINC000366290012 526315892 /nfs/dbraw/zinc/31/58/92/526315892.db2.gz YLDZJCYHFXEXNP-UHFFFAOYSA-N -1 3 317.295 3.641 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC[C@@H](O)c2cc(F)ccc21 ZINC000365144604 526328809 /nfs/dbraw/zinc/32/88/09/526328809.db2.gz ZWNRFOOVIWTHAS-MRXNPFEDSA-N -1 3 305.324 3.504 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@H](C)c2ccc(C)cc2[O-])cs1 ZINC000273367557 536514031 /nfs/dbraw/zinc/51/40/31/536514031.db2.gz BSSXCFKFAYEWMY-VXGBXAGGSA-N -1 3 306.431 3.715 20 10 DHCDHM CC[C@@H](N[C@H](CCO)c1ccco1)c1cccc(Cl)c1[O-] ZINC000287842980 535808849 /nfs/dbraw/zinc/80/88/49/535808849.db2.gz WJFHMCXXERXMPR-ZIAGYGMSSA-N -1 3 309.793 3.803 20 10 DHCDHM O=C([O-])c1occc1C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000740282077 600318499 /nfs/dbraw/zinc/31/84/99/600318499.db2.gz RIKUAQLHOHMFFX-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM O=C([O-])c1occc1C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000740282077 600318502 /nfs/dbraw/zinc/31/85/02/600318502.db2.gz RIKUAQLHOHMFFX-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM C[C@H]1CCCN(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715702575 1024038213 /nfs/dbraw/zinc/03/82/13/1024038213.db2.gz LXEUWVSKSPYVEI-VIFPVBQESA-N -1 3 302.187 3.526 20 10 DHCDHM CC(C)(CC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)[O-] ZINC000818628903 978921766 /nfs/dbraw/zinc/92/17/66/978921766.db2.gz GPOPJMAYEBZMSD-UHFFFAOYSA-N -1 3 313.397 3.650 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CNCc1nccc2c1CCCC2 ZINC000896283017 1015535726 /nfs/dbraw/zinc/53/57/26/1015535726.db2.gz YROMIDODAGQNFK-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM CC1(C)Cc2cccc(CNCc3c([O-])cccc3F)c2O1 ZINC000896642488 1015689651 /nfs/dbraw/zinc/68/96/51/1015689651.db2.gz YADDUFDTYVLRCL-UHFFFAOYSA-N -1 3 301.361 3.535 20 10 DHCDHM CC[C@H](C)c1nnc([C@H](C)NCc2cccc(Cl)c2[O-])[nH]1 ZINC000276833265 1015694929 /nfs/dbraw/zinc/69/49/29/1015694929.db2.gz BOVQARZGLAAJLR-UWVGGRQHSA-N -1 3 308.813 3.528 20 10 DHCDHM C[C@H]([NH2+][C@@H](CCC(=O)[O-])c1ccccc1)c1cc(F)ccc1[O-] ZINC001593202983 994183033 /nfs/dbraw/zinc/18/30/33/994183033.db2.gz BKOWVHBLTQBGGG-LRDDRELGSA-N -1 3 317.360 3.788 20 10 DHCDHM C[C@H]([NH2+][C@H](CCC(=O)[O-])c1ccccc1)c1cc(F)ccc1[O-] ZINC001593202982 994183621 /nfs/dbraw/zinc/18/36/21/994183621.db2.gz BKOWVHBLTQBGGG-BLLLJJGKSA-N -1 3 317.360 3.788 20 10 DHCDHM C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)c1cc(C(=O)[O-])ccc1[O-] ZINC001593239625 994423587 /nfs/dbraw/zinc/42/35/87/994423587.db2.gz HGDGOGSCEDLSPM-VIFPVBQESA-N -1 3 319.323 3.720 20 10 DHCDHM Cc1cc(NCc2cc(Cl)c3cccnc3c2[O-])nnc1C ZINC001168527397 1016732927 /nfs/dbraw/zinc/73/29/27/1016732927.db2.gz GFLAJUPDZMOQJW-UHFFFAOYSA-N -1 3 314.776 3.613 20 10 DHCDHM CC[C@H]1CO[C@](C)(CCC(C)C)N1C(=O)c1cccc(O)c1[O-] ZINC001148218575 1032374568 /nfs/dbraw/zinc/37/45/68/1032374568.db2.gz GDBBULIZTGKCRO-SCLBCKFNSA-N -1 3 321.417 3.501 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](c2ccsc2)C1 ZINC000093768350 1032553691 /nfs/dbraw/zinc/55/36/91/1032553691.db2.gz ZXORPTUHSUYZHR-OAHLLOKOSA-N -1 3 309.818 3.681 20 10 DHCDHM [O-]c1c(Br)cc(Cl)cc1CNCc1ccco1 ZINC000708193920 1018014650 /nfs/dbraw/zinc/01/46/50/1018014650.db2.gz ZDTYMWJTXMJPNQ-UHFFFAOYSA-N -1 3 316.582 3.691 20 10 DHCDHM C[C@@H]1CC[C@H](C)N(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715718471 1018949654 /nfs/dbraw/zinc/94/96/54/1018949654.db2.gz NSUQYEANYDVUJZ-ZJUUUORDSA-N -1 3 316.214 3.914 20 10 DHCDHM [O-]c1ccc(F)cc1CN1Cc2ccc(Br)cc2C1 ZINC000765670818 1019035475 /nfs/dbraw/zinc/03/54/75/1019035475.db2.gz BDFFOSWCLGRYMG-UHFFFAOYSA-N -1 3 322.177 3.810 20 10 DHCDHM C[C@H](Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)cc1[O-] ZINC000170788929 1019434974 /nfs/dbraw/zinc/43/49/74/1019434974.db2.gz FOHFKRUYOQCEAD-NSHDSACASA-N -1 3 314.360 3.597 20 10 DHCDHM CCNC(=O)c1ccc(C)c(N[C@H](C)c2ccc(F)cc2[O-])c1 ZINC000170789430 1019435708 /nfs/dbraw/zinc/43/57/08/1019435708.db2.gz KFQMQRAQGPDAPC-GFCCVEGCSA-N -1 3 316.376 3.763 20 10 DHCDHM CCC(F)(F)CN[C@H](C)c1cc(Br)ccc1[O-] ZINC000858508190 1032926296 /nfs/dbraw/zinc/92/62/96/1032926296.db2.gz UDGWLEYCSQDBTH-MRVPVSSYSA-N -1 3 308.166 3.851 20 10 DHCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000743259655 1021250826 /nfs/dbraw/zinc/25/08/26/1021250826.db2.gz IRHYLUTZUMFZSM-UHFFFAOYSA-N -1 3 319.426 3.799 20 10 DHCDHM COCC1CCN(Cc2cc(Cl)c(Cl)cc2[O-])CC1 ZINC001236793103 1021271171 /nfs/dbraw/zinc/27/11/71/1021271171.db2.gz HMUREEYUIPWMAF-UHFFFAOYSA-N -1 3 304.217 3.557 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-])c1nccn1C ZINC000850573180 1021617177 /nfs/dbraw/zinc/61/71/77/1021617177.db2.gz VUOCUMPIGZBKTC-DTWKUNHWSA-N -1 3 314.216 3.844 20 10 DHCDHM C=Cc1ncc(NCc2cc(Cl)c3cccnc3c2[O-])cn1 ZINC001168526571 1022341830 /nfs/dbraw/zinc/34/18/30/1022341830.db2.gz YUSKUYBFTPDPNU-UHFFFAOYSA-N -1 3 312.760 3.639 20 10 DHCDHM Cc1ccccc1[C@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000769444636 1023154354 /nfs/dbraw/zinc/15/43/54/1023154354.db2.gz AJTWUTKEBLYUJN-GOSISDBHSA-N -1 3 317.816 3.928 20 10 DHCDHM Cc1c(NC(=O)c2ccc(C)c(O)c2[O-])sc2c1CCCC2 ZINC000770502161 1023316453 /nfs/dbraw/zinc/31/64/53/1023316453.db2.gz JOLBXHUEDJKMTL-UHFFFAOYSA-N -1 3 317.410 3.907 20 10 DHCDHM [O-]c1c(CN2CCCO[C@H](c3ccccc3)C2)ccc(F)c1F ZINC000876684981 1033122330 /nfs/dbraw/zinc/12/23/30/1033122330.db2.gz VTIAKJABRARWKT-INIZCTEOSA-N -1 3 319.351 3.634 20 10 DHCDHM CC1(C)CCCN(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715719069 1024040232 /nfs/dbraw/zinc/04/02/32/1024040232.db2.gz POIFMXYQOPHXPQ-UHFFFAOYSA-N -1 3 316.214 3.916 20 10 DHCDHM CC[C@H](Nc1ccc2c(c1)N(C)CCO2)c1ccc(F)cc1[O-] ZINC000796925638 1024103833 /nfs/dbraw/zinc/10/38/33/1024103833.db2.gz KVSNGRJOTYSFEX-HNNXBMFYSA-N -1 3 316.376 3.923 20 10 DHCDHM CC(C)(C)c1csc(CNCc2cc(F)cc(F)c2[O-])n1 ZINC000882986802 1024195042 /nfs/dbraw/zinc/19/50/42/1024195042.db2.gz JXDNEKXIICPWIL-UHFFFAOYSA-N -1 3 312.385 3.714 20 10 DHCDHM Cc1csc(C2(NCc3cc(F)cc(F)c3[O-])CCCC2)n1 ZINC000882994520 1024200914 /nfs/dbraw/zinc/20/09/14/1024200914.db2.gz JDQWXNWFXOBQKN-UHFFFAOYSA-N -1 3 324.396 3.994 20 10 DHCDHM Cn1c2cc(F)ccc2nc1NCc1c([O-])ccc(Cl)c1F ZINC000790246662 1024252292 /nfs/dbraw/zinc/25/22/92/1024252292.db2.gz WPYMHTOPEGEEQP-UHFFFAOYSA-N -1 3 323.730 3.823 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1CCC1CCCC1 ZINC000790893576 1024395700 /nfs/dbraw/zinc/39/57/00/1024395700.db2.gz IULQTNVTUSBXRL-AWEZNQCLSA-N -1 3 303.402 3.673 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1ccc(F)c(F)c1 ZINC000790956572 1024403939 /nfs/dbraw/zinc/40/39/39/1024403939.db2.gz VCZHKLVCHQXGKC-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM CC[C@@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2[O-])CCS1 ZINC000135822406 1025287237 /nfs/dbraw/zinc/28/72/37/1025287237.db2.gz UPSXZORAVQBXMZ-CYBMUJFWSA-N -1 3 313.850 3.576 20 10 DHCDHM CC[C@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2[O-])CCS1 ZINC000135822440 1025287696 /nfs/dbraw/zinc/28/76/96/1025287696.db2.gz UPSXZORAVQBXMZ-ZDUSSCGKSA-N -1 3 313.850 3.576 20 10 DHCDHM COc1ccc(OC)c([C@H](C)N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886491364 1025649940 /nfs/dbraw/zinc/64/99/40/1025649940.db2.gz ASLQXJUNNAGDOS-NWDGAFQWSA-N -1 3 319.376 3.960 20 10 DHCDHM COc1ccc(OC)c([C@@H](C)N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886491366 1025650088 /nfs/dbraw/zinc/65/00/88/1025650088.db2.gz ASLQXJUNNAGDOS-VXGBXAGGSA-N -1 3 319.376 3.960 20 10 DHCDHM Cc1nc(C)c([C@H](C)N(C)Cc2cc(F)cc(F)c2[O-])s1 ZINC000894014611 1025656273 /nfs/dbraw/zinc/65/62/73/1025656273.db2.gz NLNUMVQDWMPWNH-VIFPVBQESA-N -1 3 312.385 3.937 20 10 DHCDHM Cc1cccc([C@@H]2CCCN2Cc2cc(F)cc(F)c2[O-])n1 ZINC000894031129 1025657930 /nfs/dbraw/zinc/65/79/30/1025657930.db2.gz PHMMIVIOPZVCQA-INIZCTEOSA-N -1 3 304.340 3.711 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@H](C)c2c([O-])cccc2F)o1 ZINC000886532071 1025681853 /nfs/dbraw/zinc/68/18/53/1025681853.db2.gz CTSRDBOQYNOFCB-BXUZGUMPSA-N -1 3 307.365 3.725 20 10 DHCDHM COc1cccc2c1OCC[C@H]2N[C@H](C)c1c([O-])cccc1F ZINC000886547970 1025696342 /nfs/dbraw/zinc/69/63/42/1025696342.db2.gz VLIZJOFZUKLGRF-BXUZGUMPSA-N -1 3 317.360 3.714 20 10 DHCDHM C[C@@H](NCc1ccn(C2CCCC2)n1)c1c([O-])cccc1F ZINC000886553388 1025699545 /nfs/dbraw/zinc/69/95/45/1025699545.db2.gz MALFQSNMVUPCSP-GFCCVEGCSA-N -1 3 303.381 3.694 20 10 DHCDHM COc1ccc2c(c1)[C@@H](N[C@H](C)c1c([O-])cccc1F)CCO2 ZINC000886592200 1025726391 /nfs/dbraw/zinc/72/63/91/1025726391.db2.gz NFNBZTQKRBZASB-ABAIWWIYSA-N -1 3 317.360 3.714 20 10 DHCDHM CCN(C)C(=O)c1cccc(N[C@@H](C)c2ccc(F)cc2[O-])c1 ZINC000806170390 1025798668 /nfs/dbraw/zinc/79/86/68/1025798668.db2.gz RRKOFRIVKMXISA-LBPRGKRZSA-N -1 3 316.376 3.796 20 10 DHCDHM C[C@H](N[C@@H]1CCCC1(F)F)c1cc(Br)ccc1[O-] ZINC000806179223 1025836618 /nfs/dbraw/zinc/83/66/18/1025836618.db2.gz BJYVSPBJVKMNEL-QPUJVOFHSA-N -1 3 320.177 3.993 20 10 DHCDHM Cc1noc(C)c1C(C)(C)NCc1cc(Cl)cc(F)c1[O-] ZINC000809718475 1026603833 /nfs/dbraw/zinc/60/38/33/1026603833.db2.gz KFLRKJVQQNHMIB-UHFFFAOYSA-N -1 3 312.772 3.814 20 10 DHCDHM CC[C@H](NCc1ncccc1N(C)C)c1cccc(Cl)c1[O-] ZINC000810249244 1026728871 /nfs/dbraw/zinc/72/88/71/1026728871.db2.gz RGUHYHNRSYOLBU-AWEZNQCLSA-N -1 3 319.836 3.748 20 10 DHCDHM Cc1ncsc1CN(C)Cc1cc(Cl)c(F)cc1[O-] ZINC000295388726 1027248160 /nfs/dbraw/zinc/24/81/60/1027248160.db2.gz PRGNSGZTQQOHQX-UHFFFAOYSA-N -1 3 300.786 3.582 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(OCC2CC2)CC1 ZINC000365268580 1027916840 /nfs/dbraw/zinc/91/68/40/1027916840.db2.gz ZDJGGDAHNHVZJB-UHFFFAOYSA-N -1 3 313.800 3.576 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@H](c2ccccc2)C(F)F)c1[O-] ZINC000814650777 1028139322 /nfs/dbraw/zinc/13/93/22/1028139322.db2.gz YOIULEWTFYRFFO-OAHLLOKOSA-N -1 3 323.314 3.830 20 10 DHCDHM CO[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CC[C@H]1C ZINC000188294680 1028505957 /nfs/dbraw/zinc/50/59/57/1028505957.db2.gz WYMJDNAIUNXDDY-RNCFNFMXSA-N -1 3 304.217 3.556 20 10 DHCDHM C[C@H](NCc1cccc(F)n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815598621 1028564156 /nfs/dbraw/zinc/56/41/56/1028564156.db2.gz YVSPGHXMJDJWBQ-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC[C@@H]2c2nccs2)c1[O-] ZINC000370168979 1028571133 /nfs/dbraw/zinc/57/11/33/1028571133.db2.gz KJEVMUOSKBJFAY-CQSZACIVSA-N -1 3 320.389 3.528 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCC(F)(F)C[C@@H]2C)c1[O-] ZINC000528763732 1028762531 /nfs/dbraw/zinc/76/25/31/1028762531.db2.gz BLJHJDBXOUPAGS-VIFPVBQESA-N -1 3 317.763 3.868 20 10 DHCDHM COc1ccc2c(c1)CN(Cc1cc(Cl)c(F)cc1[O-])CC2 ZINC000816497098 1028898200 /nfs/dbraw/zinc/89/82/00/1028898200.db2.gz MVBWKHYOUZIATH-UHFFFAOYSA-N -1 3 321.779 3.752 20 10 DHCDHM C[C@H](Nc1ccc(COCCO)cc1)c1ccc(Cl)cc1[O-] ZINC000818361296 1029386384 /nfs/dbraw/zinc/38/63/84/1029386384.db2.gz IITQIVLGHZFBJC-LBPRGKRZSA-N -1 3 321.804 3.728 20 10 DHCDHM Cc1ncc([C@H](C)NCc2c([O-])ccc(Cl)c2F)s1 ZINC000865701391 1029981044 /nfs/dbraw/zinc/98/10/44/1029981044.db2.gz FCXMQLCYZHQSBD-ZETCQYMHSA-N -1 3 300.786 3.800 20 10 DHCDHM CC(C)n1cc2c(n1)[C@H](NCc1c([O-])cccc1Cl)CCC2 ZINC000824176351 1030493059 /nfs/dbraw/zinc/49/30/59/1030493059.db2.gz MVQHPIAVFNDDPQ-OAHLLOKOSA-N -1 3 319.836 3.990 20 10 DHCDHM Cn1ccnc1[C@H]1N(Cc2ccc3ccccc3c2[O-])CC1(C)C ZINC000824620481 1030603446 /nfs/dbraw/zinc/60/34/46/1030603446.db2.gz QNPOAXPFFAETRJ-GOSISDBHSA-N -1 3 321.424 3.862 20 10 DHCDHM C[C@H]1CN(Cc2cc(Br)c(F)cc2[O-])C2(CC2)C1 ZINC001144308128 1031458785 /nfs/dbraw/zinc/45/87/85/1031458785.db2.gz QOZNOZJSTNWCON-SECBINFHSA-N -1 3 314.198 3.668 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2[O-])on1 ZINC000192830698 1034820060 /nfs/dbraw/zinc/82/00/60/1034820060.db2.gz MRESCJYAOBVXQB-QMMMGPOBSA-N -1 3 301.173 3.846 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1cscc1C(F)(F)F ZINC001178413766 1035429003 /nfs/dbraw/zinc/42/90/03/1035429003.db2.gz YPFZPWHWKXQTHI-UHFFFAOYSA-N -1 3 319.279 3.542 20 10 DHCDHM O=C(NCc1cc(Cl)c2cccnc2c1[O-])OC1CCCC1 ZINC001193576442 1035669330 /nfs/dbraw/zinc/66/93/30/1035669330.db2.gz NISZIMAXJSABHY-UHFFFAOYSA-N -1 3 320.776 3.763 20 10 DHCDHM CC(C)(C)[C@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])CCO1 ZINC001184373581 1036839286 /nfs/dbraw/zinc/83/92/86/1036839286.db2.gz AIFHYFIUCQQHBG-CQSZACIVSA-N -1 3 315.816 3.822 20 10 DHCDHM CC(C)(C)c1ccc(NC(=S)NCc2ncccc2[O-])cc1 ZINC001198504328 1037042884 /nfs/dbraw/zinc/04/28/84/1037042884.db2.gz PTAHWEDNCKIRDL-UHFFFAOYSA-N -1 3 315.442 3.571 20 10 DHCDHM CN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000054682661 1037589017 /nfs/dbraw/zinc/58/90/17/1037589017.db2.gz FHNQNANYDNTFBW-AWEZNQCLSA-N -1 3 323.179 3.895 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(C(C)(C)C)c2O)c([O-])c1O ZINC000775450655 1038485598 /nfs/dbraw/zinc/48/55/98/1038485598.db2.gz QQEXCPPCVYLUCD-UHFFFAOYSA-N -1 3 315.369 3.662 20 10 DHCDHM Cc1ccc(C(=O)N(Cc2cccs2)C(C)C)c([O-])c1O ZINC000272760426 130061837 /nfs/dbraw/zinc/06/18/37/130061837.db2.gz LHKSTNDMJALKCF-UHFFFAOYSA-N -1 3 305.399 3.519 20 10 DHCDHM COc1ccccc1[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273372660 130112408 /nfs/dbraw/zinc/11/24/08/130112408.db2.gz GNBVSBBWYNMRCS-VXGBXAGGSA-N -1 3 316.357 3.721 20 10 DHCDHM CCOc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273391991 130116282 /nfs/dbraw/zinc/11/62/82/130116282.db2.gz LAUQJPTYRFZEPU-GFCCVEGCSA-N -1 3 316.357 3.550 20 10 DHCDHM C[C@@H](N[C@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273444779 130122412 /nfs/dbraw/zinc/12/24/12/130122412.db2.gz ZRSAEGBVNPWBHC-YGRLFVJLSA-N -1 3 302.330 3.622 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)N[C@H]2CCCc3occc32)c1 ZINC000273437053 130122654 /nfs/dbraw/zinc/12/26/54/130122654.db2.gz XDTOITOLTNSCCF-ABAIWWIYSA-N -1 3 315.369 3.500 20 10 DHCDHM C[C@@H](N[C@H](C)C(F)(F)F)c1ccc(Br)cc1[O-] ZINC000287262327 131272016 /nfs/dbraw/zinc/27/20/16/131272016.db2.gz ILZHQWYHTNDZEJ-RNFRBKRXSA-N -1 3 312.129 3.756 20 10 DHCDHM CC[C@@H](NCc1cnn(C)c1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287601455 131289442 /nfs/dbraw/zinc/28/94/42/131289442.db2.gz IQMPDBZXSPKLIG-CYBMUJFWSA-N -1 3 314.216 3.673 20 10 DHCDHM Cc1ccc(C(=O)N2CC[C@H]2c2ccc(Cl)cc2)c([O-])c1O ZINC000371568060 336908096 /nfs/dbraw/zinc/90/80/96/336908096.db2.gz GEZKBICLFRIXSV-AWEZNQCLSA-N -1 3 317.772 3.647 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccccc1[O-])c1nccn1-c1ccccc1 ZINC000376563428 337036933 /nfs/dbraw/zinc/03/69/33/337036933.db2.gz TXIHYYSBJCCKDL-HUUCEWRRSA-N -1 3 307.397 3.990 20 10 DHCDHM Cc1cccc(-c2nnc([C@H](C)N(C)Cc3ccccc3[O-])o2)c1 ZINC000377600654 337055889 /nfs/dbraw/zinc/05/58/89/337055889.db2.gz KEVQJPFSKIBUTG-AWEZNQCLSA-N -1 3 323.396 3.944 20 10 DHCDHM COc1cc(Cl)cc(CN2CCCC[C@@H]2c2ncc[nH]2)c1[O-] ZINC000184685558 337199858 /nfs/dbraw/zinc/19/98/58/337199858.db2.gz AJGVPADTXXYBRB-CYBMUJFWSA-N -1 3 321.808 3.505 20 10 DHCDHM Cc1ccc([C@H](C)N[C@@H]2CCCn3nc(C(C)C)nc32)c([O-])c1 ZINC000185684532 337250143 /nfs/dbraw/zinc/25/01/43/337250143.db2.gz JMLZGGXNUALAHV-DZGCQCFKSA-N -1 3 314.433 3.601 20 10 DHCDHM C[C@H](c1nnc(-c2ccccc2)o1)N(C)Cc1ccccc1[O-] ZINC000109773457 337388482 /nfs/dbraw/zinc/38/84/82/337388482.db2.gz FBXVZQQVHBWLFD-CYBMUJFWSA-N -1 3 309.369 3.635 20 10 DHCDHM CCCOc1ncccc1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000191222093 520504226 /nfs/dbraw/zinc/50/42/26/520504226.db2.gz FUSAVLSISVMHSB-LLVKDONJSA-N -1 3 322.355 3.705 20 10 DHCDHM CC[C@H](N[C@H](c1nc(C)no1)c1ccccc1)c1ccccc1[O-] ZINC000364957101 522750517 /nfs/dbraw/zinc/75/05/17/522750517.db2.gz XRYWSAMBQOBQDH-WMZOPIPTSA-N -1 3 323.396 3.914 20 10 DHCDHM C[C@@H]1N(Cc2c([O-])ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780833 525547116 /nfs/dbraw/zinc/54/71/16/525547116.db2.gz XFXBLFRYSAXMMC-NSHDSACASA-N -1 3 313.800 3.576 20 10 DHCDHM C[C@H](N[C@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)c(F)c1[O-] ZINC000364809007 525639378 /nfs/dbraw/zinc/63/93/78/525639378.db2.gz MQBUGTSENQIMEW-KOSWAMCASA-N -1 3 323.314 3.982 20 10 DHCDHM C[C@H](Nc1ccc(OC2COC2)cc1)c1cc(Cl)ccc1[O-] ZINC000188644013 525657135 /nfs/dbraw/zinc/65/71/35/525657135.db2.gz DRQLEDDKBRWQKE-NSHDSACASA-N -1 3 319.788 3.996 20 10 DHCDHM C[C@@H](N[C@H]1COc2cc(F)cc(F)c21)c1ccc(F)cc1[O-] ZINC000368211158 525692614 /nfs/dbraw/zinc/69/26/14/525692614.db2.gz BYJDMBDNQFSELL-OQPBUACISA-N -1 3 309.287 3.594 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000365664661 526346175 /nfs/dbraw/zinc/34/61/75/526346175.db2.gz WJJFBCCQXBZUJX-HOTGVXAUSA-N -1 3 307.821 3.579 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@H]1CCOc2ccc(F)cc21 ZINC000264987433 526365474 /nfs/dbraw/zinc/36/54/74/526365474.db2.gz WGDDETWOYRQMRJ-AWEZNQCLSA-N -1 3 307.752 3.798 20 10 DHCDHM CCCCc1noc(CN(CCC)Cc2ccccc2[O-])n1 ZINC000299628858 535119919 /nfs/dbraw/zinc/11/99/19/535119919.db2.gz KTKXGABDTOIANZ-UHFFFAOYSA-N -1 3 303.406 3.530 20 10 DHCDHM C[C@H]1C[C@H](c2cccnc2)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461200 1013377676 /nfs/dbraw/zinc/37/76/76/1013377676.db2.gz CYURPFHMYNVYSC-MEDUHNTESA-N -1 3 304.340 3.649 20 10 DHCDHM COCCOCc1cccc(N[C@@H](C)c2ccc(F)cc2[O-])c1 ZINC000320584937 1014433922 /nfs/dbraw/zinc/43/39/22/1014433922.db2.gz UEJZNUXZEXTNJE-ZDUSSCGKSA-N -1 3 319.376 3.867 20 10 DHCDHM CC[C@H](N[C@H](C)c1ncc(C(=O)[O-])s1)c1ccc(C)cc1O ZINC001595281291 980332426 /nfs/dbraw/zinc/33/24/26/980332426.db2.gz LMZDCLMEAPQEKK-PWSUYJOCSA-N -1 3 320.414 3.657 20 10 DHCDHM [O-]c1cc(Cl)ccc1CN1CCO[C@@H](c2ccccc2)C1 ZINC001140464445 1015507209 /nfs/dbraw/zinc/50/72/09/1015507209.db2.gz QCZRSTWPEPUJMX-QGZVFWFLSA-N -1 3 303.789 3.619 20 10 DHCDHM Cn1cc(CNCc2c([O-])cccc2F)c(C2CCCCC2)n1 ZINC000896636230 1015693551 /nfs/dbraw/zinc/69/35/51/1015693551.db2.gz AYLDGKLOYDUSFQ-UHFFFAOYSA-N -1 3 317.408 3.602 20 10 DHCDHM C[C@@H]([NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])C1CCC(F)CC1 ZINC001593195274 994147019 /nfs/dbraw/zinc/14/70/19/994147019.db2.gz CPCDWHVBPKAMEB-QZPOHEPASA-N -1 3 309.381 3.658 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593231803 994379231 /nfs/dbraw/zinc/37/92/31/994379231.db2.gz LIENKBHWRMOMDJ-HWPZZCPQSA-N -1 3 315.344 3.568 20 10 DHCDHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185765572 1017157790 /nfs/dbraw/zinc/15/77/90/1017157790.db2.gz PAACDRZEZPTIIL-SMDDNHRTSA-N -1 3 315.369 3.613 20 10 DHCDHM CCCN(Cc1ccccc1O)C(=O)c1cc([O-])ccc1Cl ZINC000764608731 1018331198 /nfs/dbraw/zinc/33/11/98/1018331198.db2.gz IEXKUSUPCAXLBE-UHFFFAOYSA-N -1 3 319.788 3.804 20 10 DHCDHM COc1c([O-])c(CNc2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000278609209 1018923153 /nfs/dbraw/zinc/92/31/53/1018923153.db2.gz DQPXCHFHVASPCW-UHFFFAOYSA-N -1 3 302.330 3.538 20 10 DHCDHM COc1cc(N[C@@H](C)c2ccc(F)cc2[O-])cc(OC)c1OC ZINC000170788752 1019433936 /nfs/dbraw/zinc/43/39/36/1019433936.db2.gz KCUDKBDJCCVEKW-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM Cc1cc([O-])c(CNCc2ncc(Cl)s2)cc1Cl ZINC000877806422 1033457204 /nfs/dbraw/zinc/45/72/04/1033457204.db2.gz GUUYVAJSAZZZAH-UHFFFAOYSA-N -1 3 303.214 3.754 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCSC(C)(C)C2)c1[O-] ZINC000122134296 1021157418 /nfs/dbraw/zinc/15/74/18/1021157418.db2.gz XWNLGYSIBBJPLK-UHFFFAOYSA-N -1 3 313.850 3.576 20 10 DHCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1cccc2ccccc21 ZINC000776314576 1021280583 /nfs/dbraw/zinc/28/05/83/1021280583.db2.gz JSCZHKULVHNEGW-LBPRGKRZSA-N -1 3 307.349 3.742 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1nccn1C ZINC000850573036 1021616885 /nfs/dbraw/zinc/61/68/85/1021616885.db2.gz SODZCZXZYXLTJW-VHSXEESVSA-N -1 3 313.323 3.556 20 10 DHCDHM C[C@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877824985 1033476391 /nfs/dbraw/zinc/47/63/91/1033476391.db2.gz WAMJWXRBTODBDI-JOYOIKCWSA-N -1 3 323.742 3.587 20 10 DHCDHM CCc1ccc(S(=O)(=O)[N-]c2ccc(O)c(C)c2)cc1CC ZINC000776748156 1022492186 /nfs/dbraw/zinc/49/21/86/1022492186.db2.gz XZPWJKUSLLWFDF-UHFFFAOYSA-N -1 3 319.426 3.626 20 10 DHCDHM Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000855213266 1022598206 /nfs/dbraw/zinc/59/82/06/1022598206.db2.gz AYIMNBUHOAATIN-OAHLLOKOSA-N -1 3 311.381 3.692 20 10 DHCDHM COc1ccc(CN(C)Cc2c([O-])cccc2Cl)cc1F ZINC000768200339 1022913241 /nfs/dbraw/zinc/91/32/41/1022913241.db2.gz MUMAFLLVSBPICH-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM COc1c([O-])c(CNc2ccc(C)c(C)c2)ccc1[N+](=O)[O-] ZINC000278833462 1023060506 /nfs/dbraw/zinc/06/05/06/1023060506.db2.gz IWKPNDHXOGHNMB-UHFFFAOYSA-N -1 3 302.330 3.538 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2cccc(F)c2)C1 ZINC000769307976 1023117461 /nfs/dbraw/zinc/11/74/61/1023117461.db2.gz MNMAHBPEWHVCIY-QGZVFWFLSA-N -1 3 321.779 3.758 20 10 DHCDHM C[C@]1(c2ccccc2)CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000769397286 1023149944 /nfs/dbraw/zinc/14/99/44/1023149944.db2.gz CLHDDATXROBDGD-GOSISDBHSA-N -1 3 317.816 3.793 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CC[C@H](C(F)(F)F)C2)c1[O-] ZINC000313725751 1023637390 /nfs/dbraw/zinc/63/73/90/1023637390.db2.gz ABDALZOCYLGXIX-JTQLQIEISA-N -1 3 321.726 3.632 20 10 DHCDHM Cc1ccc2c(c1C)OC[C@@H]2NCc1cc(F)cc(F)c1[O-] ZINC000882986598 1024192962 /nfs/dbraw/zinc/19/29/62/1024192962.db2.gz DHOWPAARXACBKA-HNNXBMFYSA-N -1 3 305.324 3.511 20 10 DHCDHM CCC(CC)c1cc(CNCc2cc(F)cc(F)c2[O-])on1 ZINC000883018417 1024212942 /nfs/dbraw/zinc/21/29/42/1024212942.db2.gz BYGLPCVWICCNFW-UHFFFAOYSA-N -1 3 310.344 3.852 20 10 DHCDHM Cn1c2ccc(F)cc2nc1NCc1c([O-])ccc(Cl)c1F ZINC000790246705 1024253050 /nfs/dbraw/zinc/25/30/50/1024253050.db2.gz YOQYACFJYGKAKE-UHFFFAOYSA-N -1 3 323.730 3.823 20 10 DHCDHM CCCCN(C)c1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790665507 1024346969 /nfs/dbraw/zinc/34/69/69/1024346969.db2.gz DVTIARAJRPMFMF-UHFFFAOYSA-N -1 3 314.385 3.586 20 10 DHCDHM CC(C)(C)OCc1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790875681 1024390881 /nfs/dbraw/zinc/39/08/81/1024390881.db2.gz HHABYPZYDUUYCG-UHFFFAOYSA-N -1 3 315.369 3.665 20 10 DHCDHM CC(C)Oc1ncccc1CNCc1c([O-])ccc(Cl)c1F ZINC000790947874 1024402641 /nfs/dbraw/zinc/40/26/41/1024402641.db2.gz BQHOSKCEHHQIEQ-UHFFFAOYSA-N -1 3 324.783 3.657 20 10 DHCDHM CC(C)n1cc([C@H](C)NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790958722 1024404603 /nfs/dbraw/zinc/40/46/03/1024404603.db2.gz MCWUOEFUGGYYDK-JTQLQIEISA-N -1 3 311.788 3.813 20 10 DHCDHM Cn1cnc2cc(NCc3c([O-])ccc(Cl)c3F)ccc21 ZINC000790981480 1024423345 /nfs/dbraw/zinc/42/33/45/1024423345.db2.gz PJQHWWLOVGGGCB-UHFFFAOYSA-N -1 3 305.740 3.684 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@@H]2C)c1[O-] ZINC000791577746 1024518908 /nfs/dbraw/zinc/51/89/08/1024518908.db2.gz DKBKYDIQWQBPSD-ISVAXAHUSA-N -1 3 319.298 3.507 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCOCC2(CCCC2)C1 ZINC000792174901 1024640595 /nfs/dbraw/zinc/64/05/95/1024640595.db2.gz MNWVGLZXYVAWPC-UHFFFAOYSA-N -1 3 313.800 3.577 20 10 DHCDHM CC1(C)C[C@H](c2ccccc2)CN1C(=O)c1cccc(O)c1[O-] ZINC000885234029 1025291444 /nfs/dbraw/zinc/29/14/44/1025291444.db2.gz ISNPDKHFDPEBTI-AWEZNQCLSA-N -1 3 311.381 3.506 20 10 DHCDHM Cc1nc2c(s1)[C@@H](N(C)Cc1cc(F)cc(F)c1[O-])CCC2 ZINC000894021273 1025654313 /nfs/dbraw/zinc/65/43/13/1025654313.db2.gz QUPRQCNMZMOARX-AWEZNQCLSA-N -1 3 324.396 3.945 20 10 DHCDHM COCCOCc1cccc(N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886566472 1025713380 /nfs/dbraw/zinc/71/33/80/1025713380.db2.gz RBNIWTJUPFGGKP-CYBMUJFWSA-N -1 3 319.376 3.867 20 10 DHCDHM COCCOc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1F ZINC000886568886 1025714261 /nfs/dbraw/zinc/71/42/61/1025714261.db2.gz ZBFHLGCCKXAZNG-LLVKDONJSA-N -1 3 323.339 3.869 20 10 DHCDHM CCc1nnc(CN[C@@H](CC)c2cc(Cl)ccc2[O-])s1 ZINC000810260191 1026720581 /nfs/dbraw/zinc/72/05/81/1026720581.db2.gz GVHKUTUYPOGOSE-NSHDSACASA-N -1 3 311.838 3.700 20 10 DHCDHM CC[C@@H](NCc1ncccc1N(C)C)c1cccc(Cl)c1[O-] ZINC000810249245 1026729663 /nfs/dbraw/zinc/72/96/63/1026729663.db2.gz RGUHYHNRSYOLBU-CQSZACIVSA-N -1 3 319.836 3.748 20 10 DHCDHM C[C@@]12CCN(Cc3cc(Cl)cc(F)c3[O-])C[C@@H]1C2(F)F ZINC000814170297 1027926280 /nfs/dbraw/zinc/92/62/80/1027926280.db2.gz UTZVINIUPMIAML-WCQYABFASA-N -1 3 305.727 3.662 20 10 DHCDHM COc1cccc(Cl)c1CNCc1cccc(Cl)c1[O-] ZINC000188279840 1028502247 /nfs/dbraw/zinc/50/22/47/1028502247.db2.gz ILUQOXDYAAMNEI-UHFFFAOYSA-N -1 3 312.196 3.997 20 10 DHCDHM Cn1nccc1[C@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000370201386 1028578065 /nfs/dbraw/zinc/57/80/65/1028578065.db2.gz KASANPPMLMCUSM-OAHLLOKOSA-N -1 3 305.809 3.506 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@H]1c1ccccn1 ZINC000816487377 1028892290 /nfs/dbraw/zinc/89/22/90/1028892290.db2.gz LCFASNCEMOCGHN-HNNXBMFYSA-N -1 3 306.768 3.917 20 10 DHCDHM Cc1nn(C)cc1[C@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816520546 1028933940 /nfs/dbraw/zinc/93/39/40/1028933940.db2.gz RRIGULSSEFEWLS-OAHLLOKOSA-N -1 3 323.799 3.564 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@H](OCC2CC2)C1 ZINC000816574909 1028951745 /nfs/dbraw/zinc/95/17/45/1028951745.db2.gz WJMNMDUQIZLULA-ZDUSSCGKSA-N -1 3 313.800 3.576 20 10 DHCDHM C[C@H](NCc1cc(Cl)c(F)cc1[O-])c1c(F)cncc1F ZINC000816609650 1028961195 /nfs/dbraw/zinc/96/11/95/1028961195.db2.gz IIEFSXKATATKRW-ZETCQYMHSA-N -1 3 316.710 3.709 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(-c3ncco3)c2C)c([O-])c1O ZINC000816798847 1029011240 /nfs/dbraw/zinc/01/12/40/1029011240.db2.gz XOPNITMASORHEH-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM CC1(C)[C@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000817704212 1029230709 /nfs/dbraw/zinc/23/07/09/1029230709.db2.gz WEOXWWXYHYINLP-HNNXBMFYSA-N -1 3 311.381 3.506 20 10 DHCDHM CC[C@@H](NCc1cc(C)cc(Br)c1[O-])C(F)F ZINC000824509224 1030579093 /nfs/dbraw/zinc/57/90/93/1030579093.db2.gz JLQZINBWJHOCEV-SNVBAGLBSA-N -1 3 308.166 3.596 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCSC[C@@H]1C1CC1 ZINC000824914139 1030663361 /nfs/dbraw/zinc/66/33/61/1030663361.db2.gz MZAZHDJBYROFEC-CYBMUJFWSA-N -1 3 301.814 3.512 20 10 DHCDHM Cc1nc(C2(NCc3cc(Cl)c(C)cc3[O-])CCCC2)no1 ZINC000825196928 1030754112 /nfs/dbraw/zinc/75/41/12/1030754112.db2.gz CUCKWFBFORLPCK-UHFFFAOYSA-N -1 3 321.808 3.605 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000844105278 1030964086 /nfs/dbraw/zinc/96/40/86/1030964086.db2.gz GVSLEFHTGMFHHG-GOSISDBHSA-N -1 3 321.376 3.631 20 10 DHCDHM C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928383635 1031292245 /nfs/dbraw/zinc/29/22/45/1031292245.db2.gz IWCLTIBXNQWNIA-CZUORRHYSA-N -1 3 311.381 3.506 20 10 DHCDHM C[C@]12CCN(Cc3cc(Cl)c(F)cc3[O-])C[C@H]1C2(F)F ZINC000294085471 1031791137 /nfs/dbraw/zinc/79/11/37/1031791137.db2.gz ZDYDFRMQIDTAQY-OLZOCXBDSA-N -1 3 305.727 3.662 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC2(CC2(F)F)CC1 ZINC000846054952 1031846145 /nfs/dbraw/zinc/84/61/45/1031846145.db2.gz RBDGXMAXRKPSCH-UHFFFAOYSA-N -1 3 305.727 3.806 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1ccc2c(n1)CCCC2 ZINC000294492812 1032027462 /nfs/dbraw/zinc/02/74/62/1032027462.db2.gz BELHYVUTMRQPSN-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM CC[C@H](NCc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1[O-] ZINC000927107135 1033777185 /nfs/dbraw/zinc/77/71/85/1033777185.db2.gz GSVXOQFODCYBBZ-HNNXBMFYSA-N -1 3 319.836 3.897 20 10 DHCDHM C[C@H]1c2cccn2CCN1Cc1c([O-])cccc1Br ZINC000862211785 1033779124 /nfs/dbraw/zinc/77/91/24/1033779124.db2.gz BSTADGYNJKPORK-NSHDSACASA-N -1 3 321.218 3.533 20 10 DHCDHM CN=[S@@](C)(=O)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000864014002 1034254024 /nfs/dbraw/zinc/25/40/24/1034254024.db2.gz IMARJEAERZDNDF-NRFANRHFSA-N -1 3 324.833 3.744 20 10 DHCDHM CN(Cc1cc2ccccc2[nH]1)Cc1cc(F)c(F)cc1[O-] ZINC001180092218 1035577386 /nfs/dbraw/zinc/57/73/86/1035577386.db2.gz KPJMKSMVNLJZKO-UHFFFAOYSA-N -1 3 302.324 3.784 20 10 DHCDHM CC(=O)c1cccc(NC(=O)c2cc([O-])c(O)c(Cl)c2)c1C ZINC001193625521 1035681073 /nfs/dbraw/zinc/68/10/73/1035681073.db2.gz PCFZZQQVOLVDJG-UHFFFAOYSA-N -1 3 319.744 3.515 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)OCc1ccc(Cl)cc1 ZINC001195137259 1036148206 /nfs/dbraw/zinc/14/82/06/1036148206.db2.gz OLQDHQLXUOWFOM-UHFFFAOYSA-N -1 3 309.724 3.611 20 10 DHCDHM Cc1ccccc1N1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000775646904 1036193284 /nfs/dbraw/zinc/19/32/84/1036193284.db2.gz QBJXDUQIORQEQN-UHFFFAOYSA-N -1 3 316.832 3.676 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@H](Oc2ccccc2)C1 ZINC001182574068 1036391206 /nfs/dbraw/zinc/39/12/06/1036391206.db2.gz JVAXQWLOUHRAGD-AWEZNQCLSA-N -1 3 321.779 3.838 20 10 DHCDHM C[C@H]1CCCCN1Cc1cc(F)cc(Br)c1[O-] ZINC001235300393 1036976551 /nfs/dbraw/zinc/97/65/51/1036976551.db2.gz YHZCSRLYBXSQGX-VIFPVBQESA-N -1 3 302.187 3.668 20 10 DHCDHM CC(=O)c1cc(F)cc(CN[C@H](C)c2c(F)cccc2F)c1[O-] ZINC000774864355 1037130261 /nfs/dbraw/zinc/13/02/61/1037130261.db2.gz DNCOOEAQHPZRAK-SECBINFHSA-N -1 3 323.314 3.863 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc3occc3c2)c(C)cc1O ZINC001198854479 1037144773 /nfs/dbraw/zinc/14/47/73/1037144773.db2.gz CSKSFLJWLSKDAY-UHFFFAOYSA-N -1 3 317.366 3.556 20 10 DHCDHM Cc1cc(O)cc(C)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198859691 1037148631 /nfs/dbraw/zinc/14/86/31/1037148631.db2.gz ZDAOVKVSSVLOPG-UHFFFAOYSA-N -1 3 317.366 3.556 20 10 DHCDHM COc1cc(F)c(NCc2c([O-])cccc2Cl)cc1OC ZINC000129359862 1037157590 /nfs/dbraw/zinc/15/75/90/1037157590.db2.gz FZAYWXDUTHZKSI-UHFFFAOYSA-N -1 3 311.740 3.814 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c(C)cc1O ZINC001190500512 1038329929 /nfs/dbraw/zinc/32/99/29/1038329929.db2.gz QDAGDRZMHNNEDM-UHFFFAOYSA-N -1 3 317.410 3.687 20 10 DHCDHM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2C)cc1 ZINC001191249140 1038476654 /nfs/dbraw/zinc/47/66/54/1038476654.db2.gz OUYGCNQYWFWSHS-UHFFFAOYSA-N -1 3 319.426 3.844 20 10 DHCDHM CC[C@](C)(NCc1cc(F)cc(C(C)=O)c1[O-])c1nccs1 ZINC000079443617 185171928 /nfs/dbraw/zinc/17/19/28/185171928.db2.gz CGLHBFNWILFCFP-INIZCTEOSA-N -1 3 322.405 3.605 20 10 DHCDHM O=C(c1ccccc1)C1CCN(Cc2cccc(F)c2[O-])CC1 ZINC000272316414 130019850 /nfs/dbraw/zinc/01/98/50/130019850.db2.gz SRIPEJVVPNOTOG-UHFFFAOYSA-N -1 3 313.372 3.626 20 10 DHCDHM C[C@H](NCc1cccc2c1OCCCO2)c1ccc(F)cc1[O-] ZINC000273347961 130109291 /nfs/dbraw/zinc/10/92/91/130109291.db2.gz BCRLCEOJUVJQRR-LBPRGKRZSA-N -1 3 317.360 3.543 20 10 DHCDHM COc1ccc(OC)c(CN[C@H](C)c2cc(Cl)ccc2[O-])c1 ZINC000273399562 130117376 /nfs/dbraw/zinc/11/73/76/130117376.db2.gz MUECHDKBYMRWRJ-LLVKDONJSA-N -1 3 321.804 3.914 20 10 DHCDHM COc1cccc(C2(N[C@H](C)c3ccc(F)cc3[O-])CC2)c1 ZINC000273520482 130132321 /nfs/dbraw/zinc/13/23/21/130132321.db2.gz UBWGJZRHYINNJS-GFCCVEGCSA-N -1 3 301.361 3.880 20 10 DHCDHM CCn1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2[O-])cn1 ZINC000273538251 130133394 /nfs/dbraw/zinc/13/33/94/130133394.db2.gz XSOJEMMYXZLRDX-VIFPVBQESA-N -1 3 314.216 3.766 20 10 DHCDHM CC[C@@H](N[C@H](COC)c1ccccc1)c1ccc(F)cc1[O-] ZINC000286000724 131214697 /nfs/dbraw/zinc/21/46/97/131214697.db2.gz HNMDYOZIGJDLDO-IAGOWNOFSA-N -1 3 303.377 3.960 20 10 DHCDHM C[C@H](N[C@@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1[O-] ZINC000287035349 131260598 /nfs/dbraw/zinc/26/05/98/131260598.db2.gz MBIHSRRBJXKUTF-ZBEGNZNMSA-N -1 3 323.795 3.959 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(Br)cc1[O-])C(F)(F)F ZINC000287262325 131272108 /nfs/dbraw/zinc/27/21/08/131272108.db2.gz ILZHQWYHTNDZEJ-NKWVEPMBSA-N -1 3 312.129 3.756 20 10 DHCDHM CC[C@@H](NCc1cccnc1OC)c1cccc(Cl)c1[O-] ZINC000287633669 131291640 /nfs/dbraw/zinc/29/16/40/131291640.db2.gz KNRUHTDIJGHOKF-CQSZACIVSA-N -1 3 306.793 3.690 20 10 DHCDHM CCOc1ccc(N[C@@H](C)c2cc(F)ccc2[O-])cc1CO ZINC000176986047 332967201 /nfs/dbraw/zinc/96/72/01/332967201.db2.gz GMTPGICMCPSVCB-NSHDSACASA-N -1 3 305.349 3.595 20 10 DHCDHM Cc1nn(C)c(C)c1N[C@@H](C)c1ccc(Br)cc1[O-] ZINC000273410781 334046381 /nfs/dbraw/zinc/04/63/81/334046381.db2.gz HTMWDIIXKCKTHQ-QMMMGPOBSA-N -1 3 324.222 3.678 20 10 DHCDHM CC(C)(NCc1cc(Cl)c(F)cc1[O-])c1nccs1 ZINC000293598937 334199512 /nfs/dbraw/zinc/19/95/12/334199512.db2.gz KZMBBMZOYYABJG-UHFFFAOYSA-N -1 3 300.786 3.666 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC([C@H]2CCCO2)CC1 ZINC000373821099 336973843 /nfs/dbraw/zinc/97/38/43/336973843.db2.gz FHZCEQAHLXUAHF-OAHLLOKOSA-N -1 3 313.800 3.576 20 10 DHCDHM O=C(c1cccs1)C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000374877162 336998634 /nfs/dbraw/zinc/99/86/34/336998634.db2.gz DPNAUGSICVEJAX-UHFFFAOYSA-N -1 3 319.401 3.688 20 10 DHCDHM C[C@H]1Oc2cc(F)ccc2[C@H]1NCc1cccc(Cl)c1[O-] ZINC000377835607 337062096 /nfs/dbraw/zinc/06/20/96/337062096.db2.gz VIRKNJQBPGWCDC-PSLIRLAXSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@H](N[C@@H]1CCOc2c(F)cccc21)c1ccc(F)c(F)c1[O-] ZINC000364798584 525577567 /nfs/dbraw/zinc/57/75/67/525577567.db2.gz LQYSGJUWRPUGAW-LKFCYVNXSA-N -1 3 323.314 3.984 20 10 DHCDHM C[C@@H](N[C@@H]1CN(C)Cc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000364793664 525652130 /nfs/dbraw/zinc/65/21/30/525652130.db2.gz QMKQKUIQGWLGDX-BDJLRTHQSA-N -1 3 318.367 3.508 20 10 DHCDHM CC[C@H](N[C@@H](CCO)c1ccco1)c1cccc(Cl)c1[O-] ZINC000287842975 535931129 /nfs/dbraw/zinc/93/11/29/535931129.db2.gz WJFHMCXXERXMPR-KBPBESRZSA-N -1 3 309.793 3.803 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1ccc(CSC(F)F)o1 ZINC000896639181 1015694079 /nfs/dbraw/zinc/69/40/79/1015694079.db2.gz AYIZMMYLYHBLEQ-UHFFFAOYSA-N -1 3 317.332 3.870 20 10 DHCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000028580195 1015765727 /nfs/dbraw/zinc/76/57/27/1015765727.db2.gz GULVODHCTJBQMZ-UHFFFAOYSA-N -1 3 305.399 3.625 20 10 DHCDHM C[C@@H]([NH2+][C@H](CCC(=O)[O-])c1ccccc1)c1cc(F)ccc1[O-] ZINC001593202984 994183059 /nfs/dbraw/zinc/18/30/59/994183059.db2.gz BKOWVHBLTQBGGG-MLGOLLRUSA-N -1 3 317.360 3.788 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCSC2(CCC2)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593232589 994386383 /nfs/dbraw/zinc/38/63/83/994386383.db2.gz OAFWPXFTFVZRIQ-AAEUAGOBSA-N -1 3 321.442 3.559 20 10 DHCDHM C[C@H](NCc1ccc(N(C)C)c(F)c1)c1cc(C(=O)[O-])cs1 ZINC001593298074 994710050 /nfs/dbraw/zinc/71/00/50/994710050.db2.gz DHYVMYBHXVLXBV-JTQLQIEISA-N -1 3 322.405 3.502 20 10 DHCDHM O=C(NC(c1ccccc1)c1ccccc1)c1cccc(O)c1[O-] ZINC000326688877 1015983450 /nfs/dbraw/zinc/98/34/50/1015983450.db2.gz JQQBJNDELAFRSY-UHFFFAOYSA-N -1 3 319.360 3.617 20 10 DHCDHM Cc1cc(NCc2cc(Cl)c3cccnc3c2[O-])nc(C)n1 ZINC001168527391 1016726740 /nfs/dbraw/zinc/72/67/40/1016726740.db2.gz FVAYKNMQTAGEBI-UHFFFAOYSA-N -1 3 314.776 3.613 20 10 DHCDHM O=C1CCc2cc(NCc3c([O-])cccc3Cl)ccc2N1 ZINC000148128498 1016994663 /nfs/dbraw/zinc/99/46/63/1016994663.db2.gz YKFWBNRZAUIYIK-UHFFFAOYSA-N -1 3 302.761 3.542 20 10 DHCDHM Cc1ncc(CN[C@H](C)c2cccc(C(F)(F)F)c2[O-])o1 ZINC000840794566 1017037242 /nfs/dbraw/zinc/03/72/42/1017037242.db2.gz LOCWFEDXVJMUOC-MRVPVSSYSA-N -1 3 300.280 3.558 20 10 DHCDHM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cccc(O)c1[O-] ZINC001148224554 1032374915 /nfs/dbraw/zinc/37/49/15/1032374915.db2.gz PHDRSRMMBDBRNV-QGZVFWFLSA-N -1 3 311.381 3.759 20 10 DHCDHM CC(C)O[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000701729796 1018098466 /nfs/dbraw/zinc/09/84/66/1018098466.db2.gz NVGZCMRMGRFRSM-GFCCVEGCSA-N -1 3 304.217 3.698 20 10 DHCDHM [O-]c1c(Br)cccc1CNc1nc2ccccc2[nH]1 ZINC000764933579 1018431904 /nfs/dbraw/zinc/43/19/04/1018431904.db2.gz FNNMSLYQHGNXNA-UHFFFAOYSA-N -1 3 318.174 3.643 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H](c1ccccn1)C1CC1 ZINC000922584358 1020139545 /nfs/dbraw/zinc/13/95/45/1020139545.db2.gz IQFMHNLJMQBASW-MRXNPFEDSA-N -1 3 306.768 3.821 20 10 DHCDHM CC(C)[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CCCO1 ZINC000378801100 1020519820 /nfs/dbraw/zinc/51/98/20/1020519820.db2.gz URUMVRNVSRRSAS-CQSZACIVSA-N -1 3 318.244 3.946 20 10 DHCDHM CC(C)[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CCCO1 ZINC000378801094 1020519836 /nfs/dbraw/zinc/51/98/36/1020519836.db2.gz URUMVRNVSRRSAS-AWEZNQCLSA-N -1 3 318.244 3.946 20 10 DHCDHM CCN1C(=O)c2ccccc2N[C@H]1c1cc(Cl)ccc1[O-] ZINC000030542045 1020577780 /nfs/dbraw/zinc/57/77/80/1020577780.db2.gz DLFYEFYUOLUION-OAHLLOKOSA-N -1 3 302.761 3.632 20 10 DHCDHM CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@@H](C)C1 ZINC000282130971 1020867553 /nfs/dbraw/zinc/86/75/53/1020867553.db2.gz BKPGJGNBAMSTEV-CABZTGNLSA-N -1 3 304.217 3.698 20 10 DHCDHM C[C@@H](N[C@H](C)c1cc(Cl)c(Cl)cc1[O-])c1nccn1C ZINC000850573182 1021616166 /nfs/dbraw/zinc/61/61/66/1021616166.db2.gz VUOCUMPIGZBKTC-RKDXNWHRSA-N -1 3 314.216 3.844 20 10 DHCDHM COC[C@@H]1CCCCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237078111 1021627837 /nfs/dbraw/zinc/62/78/37/1021627837.db2.gz OFZFRCAMFOPQQW-JTQLQIEISA-N -1 3 304.217 3.700 20 10 DHCDHM CNc1ccc(NCc2cc(Cl)c3cccnc3c2[O-])cn1 ZINC001168524346 1021707125 /nfs/dbraw/zinc/70/71/25/1021707125.db2.gz ZQPKLAPJQAMQOB-UHFFFAOYSA-N -1 3 314.776 3.643 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2cccc(F)c2)C1 ZINC000769307975 1023117036 /nfs/dbraw/zinc/11/70/36/1023117036.db2.gz MNMAHBPEWHVCIY-KRWDZBQOSA-N -1 3 321.779 3.758 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCCC(F)(F)CC2)c1[O-] ZINC000859534734 1033160864 /nfs/dbraw/zinc/16/08/64/1033160864.db2.gz DVCXPLOPLSTOJZ-UHFFFAOYSA-N -1 3 317.763 3.869 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@@H]1CCCc2c[nH]nc21 ZINC000268824305 1024172432 /nfs/dbraw/zinc/17/24/32/1024172432.db2.gz IQIUQQFQJFFWQK-GFCCVEGCSA-N -1 3 312.200 3.589 20 10 DHCDHM Cc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c(Cl)n1 ZINC000883301714 1024357434 /nfs/dbraw/zinc/35/74/34/1024357434.db2.gz HIHWXEZJLIABCF-SNVBAGLBSA-N -1 3 321.764 3.508 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCCC[C@H]1c1ccc(F)cc1 ZINC000790863001 1024396578 /nfs/dbraw/zinc/39/65/78/1024396578.db2.gz RVZVENXEEGYNTO-HNNXBMFYSA-N -1 3 315.344 3.604 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H]1CCc2c1cccc2O ZINC000790959050 1024407401 /nfs/dbraw/zinc/40/74/01/1024407401.db2.gz DMDGOSARWRSQCM-CYBMUJFWSA-N -1 3 307.752 3.667 20 10 DHCDHM COc1cccc(C2(NCc3c([O-])ccc(Cl)c3F)CC2)c1 ZINC000790976407 1024421654 /nfs/dbraw/zinc/42/16/54/1024421654.db2.gz BFWPLOGOXDJPFL-UHFFFAOYSA-N -1 3 321.779 3.972 20 10 DHCDHM CN(Cc1c([O-])ccc(Cl)c1F)[C@@H](CCO)c1ccccc1 ZINC000792165852 1024641240 /nfs/dbraw/zinc/64/12/40/1024641240.db2.gz LQDCYPXYQNCBKM-HNNXBMFYSA-N -1 3 323.795 3.740 20 10 DHCDHM CCCN(Cc1cccc(Cl)c1[O-])[C@H](CC)C(=O)OCC ZINC000792189146 1024646510 /nfs/dbraw/zinc/64/65/10/1024646510.db2.gz QRXKUYQATKUELI-CQSZACIVSA-N -1 3 313.825 3.599 20 10 DHCDHM Cc1cc(Br)c([O-])c(CN2CCC(F)(F)CC2)c1 ZINC000793362348 1025005052 /nfs/dbraw/zinc/00/50/52/1025005052.db2.gz QYNPOGZUJSUFGT-UHFFFAOYSA-N -1 3 320.177 3.694 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@H](C)[C@@H]2C)c1[O-] ZINC000135821206 1025286202 /nfs/dbraw/zinc/28/62/02/1025286202.db2.gz IXVWDJHMONQPJY-GXSJLCMTSA-N -1 3 313.850 3.574 20 10 DHCDHM C[C@@H]1C[C@@H](c2cccnc2)N(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877341938 1033286567 /nfs/dbraw/zinc/28/65/67/1033286567.db2.gz HLWRKUSIBLDTBX-ABAIWWIYSA-N -1 3 304.340 3.649 20 10 DHCDHM CCCCn1cc(CN[C@H](C)c2c([O-])cccc2F)c(C)n1 ZINC000886561710 1025708259 /nfs/dbraw/zinc/70/82/59/1025708259.db2.gz HCLKOQPSPRMJHR-CYBMUJFWSA-N -1 3 305.397 3.687 20 10 DHCDHM C[C@@H](Nc1ccc(O[C@@H]2CCOC2)cc1)c1c([O-])cccc1F ZINC000886575134 1025716975 /nfs/dbraw/zinc/71/69/75/1025716975.db2.gz HAEMUEQEMAOMKP-IUODEOHRSA-N -1 3 317.360 3.872 20 10 DHCDHM CCCNC(=O)c1cccc(N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886584600 1025717807 /nfs/dbraw/zinc/71/78/07/1025717807.db2.gz RVICWROWVCZUFG-LBPRGKRZSA-N -1 3 316.376 3.844 20 10 DHCDHM COCC[C@H](N[C@H](C)c1c([O-])cccc1F)c1ccc(C)o1 ZINC000886586070 1025724728 /nfs/dbraw/zinc/72/47/28/1025724728.db2.gz KKAOEMKZIXVPEL-OCCSQVGLSA-N -1 3 307.365 3.861 20 10 DHCDHM CC(=O)N1CCc2c1cccc2N[C@@H](C)c1c([O-])cccc1F ZINC000886592586 1025725887 /nfs/dbraw/zinc/72/58/87/1025725887.db2.gz XSDUPHMSEWBKDD-NSHDSACASA-N -1 3 314.360 3.613 20 10 DHCDHM COc1ccc2c(c1)[C@@H](N[C@@H](C)c1c([O-])cccc1F)CCO2 ZINC000886592201 1025727430 /nfs/dbraw/zinc/72/74/30/1025727430.db2.gz NFNBZTQKRBZASB-NHYWBVRUSA-N -1 3 317.360 3.714 20 10 DHCDHM C[C@@H](N[C@H]1CCOc2c(F)cccc21)c1c([O-])cccc1F ZINC000886597086 1025729326 /nfs/dbraw/zinc/72/93/26/1025729326.db2.gz VXIPSANVUWPRDJ-YGRLFVJLSA-N -1 3 305.324 3.845 20 10 DHCDHM CC[C@H](C)c1nnc([C@@H](C)N[C@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886598646 1025731170 /nfs/dbraw/zinc/73/11/70/1025731170.db2.gz GRTMCZLZYBDFMS-HBNTYKKESA-N -1 3 306.385 3.575 20 10 DHCDHM COC[C@H](N[C@H](C)c1c([O-])cccc1F)c1cccc(OC)c1 ZINC000886636778 1025749218 /nfs/dbraw/zinc/74/92/18/1025749218.db2.gz UYPXBYJMKZEFFO-WBMJQRKESA-N -1 3 319.376 3.578 20 10 DHCDHM C[C@H](N[C@@H](CCO)C(F)(F)F)c1ccc2ccccc2c1[O-] ZINC000886800951 1025917243 /nfs/dbraw/zinc/91/72/43/1025917243.db2.gz FKXXCNINCXVHQA-HZMBPMFUSA-N -1 3 313.319 3.509 20 10 DHCDHM CCOC1(C)CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000814170499 1027924803 /nfs/dbraw/zinc/92/48/03/1027924803.db2.gz XGMQTJBLFQVMBN-UHFFFAOYSA-N -1 3 301.789 3.576 20 10 DHCDHM COC(=O)c1cc(NCc2c([O-])cccc2Cl)ccc1C ZINC000779158914 1028478106 /nfs/dbraw/zinc/47/81/06/1028478106.db2.gz SOHBXXLKICUZAB-UHFFFAOYSA-N -1 3 305.761 3.753 20 10 DHCDHM CN(CCc1cccc2ccccc21)C(=O)c1cccc(O)c1[O-] ZINC000188346594 1028506541 /nfs/dbraw/zinc/50/65/41/1028506541.db2.gz WXZXMGIUWOSUEB-UHFFFAOYSA-N -1 3 321.376 3.566 20 10 DHCDHM C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000370708675 1028640590 /nfs/dbraw/zinc/64/05/90/1028640590.db2.gz QKQCKIMFQRKVLT-ZFWWWQNUSA-N -1 3 311.381 3.506 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc(F)c(C3CC3)c2)c([O-])c1O ZINC000799069059 1028704282 /nfs/dbraw/zinc/70/42/82/1028704282.db2.gz SUKIUBLBAVSMGH-UHFFFAOYSA-N -1 3 301.317 3.675 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC(C(F)(F)F)CC1 ZINC000816484123 1028895363 /nfs/dbraw/zinc/89/53/63/1028895363.db2.gz QANFCRXUFYPAPL-UHFFFAOYSA-N -1 3 311.706 3.959 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1ccc(F)cc1F ZINC000816543630 1028927036 /nfs/dbraw/zinc/92/70/36/1028927036.db2.gz ILEVBRJMVYYRIE-UHFFFAOYSA-N -1 3 301.695 3.753 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN(Cc1cccnc1)C1CC1 ZINC000816611676 1028963614 /nfs/dbraw/zinc/96/36/14/1028963614.db2.gz VKHHUWYQNJAEHV-UHFFFAOYSA-N -1 3 306.768 3.744 20 10 DHCDHM Cc1ncc([C@@H](C)NCc2c([O-])ccc(Cl)c2F)s1 ZINC000865701390 1029981522 /nfs/dbraw/zinc/98/15/22/1029981522.db2.gz FCXMQLCYZHQSBD-SSDOTTSWSA-N -1 3 300.786 3.800 20 10 DHCDHM [O-]c1cc(Br)ccc1CN1CCC[C@H]1c1ccc[nH]1 ZINC000824474299 1030561579 /nfs/dbraw/zinc/56/15/79/1030561579.db2.gz MPGSXEOXAOMIFS-AWEZNQCLSA-N -1 3 321.218 3.820 20 10 DHCDHM Cc1cc([C@@H]2CCCN2Cc2cc(Cl)c(C)cc2[O-])no1 ZINC000824575696 1030586298 /nfs/dbraw/zinc/58/62/98/1030586298.db2.gz NDQGDZPSHYIYKC-HNNXBMFYSA-N -1 3 306.793 3.988 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000824632663 1030597721 /nfs/dbraw/zinc/59/77/21/1030597721.db2.gz PECNYYBMTZXQMC-HNNXBMFYSA-N -1 3 323.845 3.989 20 10 DHCDHM CN(Cc1cc(Cl)ccc1[O-])Cc1ccccc1[N+](=O)[O-] ZINC000179315668 1031079469 /nfs/dbraw/zinc/07/94/69/1031079469.db2.gz SMVWLKTXPBFHOF-UHFFFAOYSA-N -1 3 306.749 3.586 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccccc1O[C@H]1CCOC1 ZINC000151685369 1033474135 /nfs/dbraw/zinc/47/41/35/1033474135.db2.gz ORLBOOMMAVXZPS-LBPRGKRZSA-N -1 3 319.788 3.825 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccc2oc(CO)cc2c1 ZINC000864041474 1034273049 /nfs/dbraw/zinc/27/30/49/1034273049.db2.gz NFQFLZPGZUNSCA-UHFFFAOYSA-N -1 3 303.745 3.896 20 10 DHCDHM Cc1cc(NCc2c([O-])cccc2Cl)nn1CC(F)(F)F ZINC000842223731 1034440281 /nfs/dbraw/zinc/44/02/81/1034440281.db2.gz OTYHFSOFYBIGAP-UHFFFAOYSA-N -1 3 319.714 3.725 20 10 DHCDHM CC(C)(C)c1ccc(C(=O)NCc2c([O-])cccc2F)cc1 ZINC001178409354 1035427780 /nfs/dbraw/zinc/42/77/80/1035427780.db2.gz DNWZKICRQOPFTR-UHFFFAOYSA-N -1 3 301.361 3.759 20 10 DHCDHM COc1cccc(F)c1CNCc1c([O-])ccc(Cl)c1F ZINC001179681252 1035491755 /nfs/dbraw/zinc/49/17/55/1035491755.db2.gz ICEATABJJVMKKI-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM O=C(NC1CC1)c1cccc(NCc2ccc(Cl)cc2[O-])c1 ZINC001180285128 1035645895 /nfs/dbraw/zinc/64/58/95/1035645895.db2.gz WZKWPQBDXRGMRU-UHFFFAOYSA-N -1 3 316.788 3.550 20 10 DHCDHM CC1(C)CN(Cc2cc(F)c(F)cc2[O-])c2ccccc2O1 ZINC001180612188 1035732372 /nfs/dbraw/zinc/73/23/72/1035732372.db2.gz IFRNAOSNBFVNPA-UHFFFAOYSA-N -1 3 305.324 3.848 20 10 DHCDHM C[C@@H]1CCCN(Cc2cc(F)cc(Br)c2[O-])C1 ZINC001235299512 1036964173 /nfs/dbraw/zinc/96/41/73/1036964173.db2.gz VLZCXJNUJRKRGO-SECBINFHSA-N -1 3 302.187 3.526 20 10 DHCDHM COc1c([O-])c(CNc2cccc(C)c2Cl)ccc1[N+](=O)[O-] ZINC000774942678 1037249504 /nfs/dbraw/zinc/24/95/04/1037249504.db2.gz RHUYQXQOFKTRNM-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCOCC2(CCCC2)C1 ZINC000776009377 1037304077 /nfs/dbraw/zinc/30/40/77/1037304077.db2.gz SGEMZLRNOQFZPE-UHFFFAOYSA-N -1 3 313.800 3.577 20 10 DHCDHM CO[C@H]1Cc2ccc(N[C@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000760879070 1038969542 /nfs/dbraw/zinc/96/95/42/1038969542.db2.gz CZFMJPVLLXZHBW-BZNIZROVSA-N -1 3 301.361 3.818 20 10 DHCDHM CCc1nn(C)cc1N[C@H](C)c1ccc(Br)cc1[O-] ZINC000273503979 130129552 /nfs/dbraw/zinc/12/95/52/130129552.db2.gz QSRKAWKWMYOBBC-SECBINFHSA-N -1 3 324.222 3.624 20 10 DHCDHM C[C@H](N[C@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273569536 130138101 /nfs/dbraw/zinc/13/81/01/130138101.db2.gz KISFPESYZRGHTF-QFYYESIMSA-N -1 3 316.332 3.778 20 10 DHCDHM C[C@@H](N[C@H]1CCc2c1cccc2F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273606024 130143612 /nfs/dbraw/zinc/14/36/12/130143612.db2.gz UDLUZADYJJUQDN-HWPZZCPQSA-N -1 3 316.332 3.778 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cnn(C)c1 ZINC000273607929 130144242 /nfs/dbraw/zinc/14/42/42/130144242.db2.gz UVFGLCUYEISKRH-IUCAKERBSA-N -1 3 314.216 3.844 20 10 DHCDHM CC[C@@H](N[C@@H](CO)c1ccccc1)c1cccc(Cl)c1[O-] ZINC000287292264 131273546 /nfs/dbraw/zinc/27/35/46/131273546.db2.gz BZBAULLJKAZUFW-CVEARBPZSA-N -1 3 305.805 3.820 20 10 DHCDHM CC[C@H](NCc1cn2ccsc2n1)c1cccc(Cl)c1[O-] ZINC000287620870 131290891 /nfs/dbraw/zinc/29/08/91/131290891.db2.gz JUQBJMMREIHDBW-ZDUSSCGKSA-N -1 3 321.833 3.996 20 10 DHCDHM COc1cc(NCc2c([O-])cccc2Cl)cc(OC)c1OC ZINC000114759782 333146769 /nfs/dbraw/zinc/14/67/69/333146769.db2.gz IIDHIGUOLIZXRE-UHFFFAOYSA-N -1 3 323.776 3.684 20 10 DHCDHM CCCOc1ccc(CN[C@@H](C)c2ccc(F)cc2[O-])cn1 ZINC000185397821 333208254 /nfs/dbraw/zinc/20/82/54/333208254.db2.gz RIECYQSAHCNULB-LBPRGKRZSA-N -1 3 304.365 3.566 20 10 DHCDHM Cc1cc([C@H]2CCCN(Cc3c([O-])ccc(Cl)c3F)C2)n[nH]1 ZINC000375985266 337024665 /nfs/dbraw/zinc/02/46/65/337024665.db2.gz MAXYSAOHFAYXCE-NSHDSACASA-N -1 3 323.799 3.596 20 10 DHCDHM Cc1cc([C@H]2CCCN(Cc3c([O-])ccc(Cl)c3F)C2)[nH]n1 ZINC000375985266 337024666 /nfs/dbraw/zinc/02/46/66/337024666.db2.gz MAXYSAOHFAYXCE-NSHDSACASA-N -1 3 323.799 3.596 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC[C@]2(C1)OCc1ccccc12 ZINC000186440827 337256170 /nfs/dbraw/zinc/25/61/70/337256170.db2.gz USSHVTQFBGEGRH-GOSISDBHSA-N -1 3 315.800 3.677 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@H]1CCOc2c(F)cccc21 ZINC000191125051 337294454 /nfs/dbraw/zinc/29/44/54/337294454.db2.gz SFCLTKVUSFJIEI-AWEZNQCLSA-N -1 3 307.752 3.798 20 10 DHCDHM CC(C)COC[C@H](NCc1cc(F)ccc1[O-])c1ccco1 ZINC000180561455 519757481 /nfs/dbraw/zinc/75/74/81/519757481.db2.gz VJURYQPEEGJMAM-HNNXBMFYSA-N -1 3 307.365 3.628 20 10 DHCDHM CC[C@H](N[C@@H](c1nc(C)no1)c1ccccc1)c1ccccc1[O-] ZINC000364957099 522708292 /nfs/dbraw/zinc/70/82/92/522708292.db2.gz XRYWSAMBQOBQDH-FUHWJXTLSA-N -1 3 323.396 3.914 20 10 DHCDHM C[C@H](NCc1cc(F)ccc1[O-])c1nc(C2CCCCC2)no1 ZINC000191577042 525433210 /nfs/dbraw/zinc/43/32/10/525433210.db2.gz GTLJTPUGDVVMSO-NSHDSACASA-N -1 3 319.380 3.813 20 10 DHCDHM C[C@H](N[C@@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)cc1[O-] ZINC000368482633 525591382 /nfs/dbraw/zinc/59/13/82/525591382.db2.gz NVBWUJYGJREPPQ-IEVXNVSRSA-N -1 3 305.324 3.843 20 10 DHCDHM Cc1ccc(C(=O)N(C)CCCCc2ccccc2)c([O-])c1O ZINC000182126381 526058503 /nfs/dbraw/zinc/05/85/03/526058503.db2.gz UWYBOHMIIFPWBD-UHFFFAOYSA-N -1 3 313.397 3.501 20 10 DHCDHM Cc1nc(CN[C@H](C)c2cc(Cl)ccc2[O-])c2n1CCCC2 ZINC000364910316 526892687 /nfs/dbraw/zinc/89/26/87/526892687.db2.gz YZQDNRHZSUEBOU-LLVKDONJSA-N -1 3 319.836 3.738 20 10 DHCDHM CC(C)COC[C@@H](N[C@@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000297833968 535181345 /nfs/dbraw/zinc/18/13/45/535181345.db2.gz RXZDQMDTRKJKPR-HZPDHXFCSA-N -1 3 315.413 3.976 20 10 DHCDHM CC[C@@H](N[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1[O-] ZINC000287308096 535809022 /nfs/dbraw/zinc/80/90/22/535809022.db2.gz CUQDWZDCDKHYJV-KGLIPLIRSA-N -1 3 305.809 3.887 20 10 DHCDHM CC[C@](C)(CC(=O)[O-])[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000828664526 601431220 /nfs/dbraw/zinc/43/12/20/601431220.db2.gz BHWOAVMGEMZQNP-LJQANCHMSA-N -1 3 313.397 3.792 20 10 DHCDHM C[C@H]1C(=O)CCN(Cc2c([O-])cccc2Cl)C12CCCC2 ZINC001140342371 1014639827 /nfs/dbraw/zinc/63/98/27/1014639827.db2.gz GSZHOKVGTLRAKY-LBPRGKRZSA-N -1 3 307.821 3.769 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1cccc(OC2CC2)c1F ZINC000896638419 1015693970 /nfs/dbraw/zinc/69/39/70/1015693970.db2.gz PPHFCGYUJJMUIZ-UHFFFAOYSA-N -1 3 305.324 3.501 20 10 DHCDHM C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593251478 994495940 /nfs/dbraw/zinc/49/59/40/994495940.db2.gz GURLZIAYHIYAFA-WDEREUQCSA-N -1 3 313.344 3.567 20 10 DHCDHM Cc1cccc(S(=O)(=O)[N-]c2cc(C(C)C)c(O)cc2C)c1 ZINC000176212224 1015879946 /nfs/dbraw/zinc/87/99/46/1015879946.db2.gz ODBFBUBMRDDBIG-UHFFFAOYSA-N -1 3 319.426 3.933 20 10 DHCDHM O=C(Nc1c(Cl)ccc2ncccc21)c1cccc(O)c1[O-] ZINC001148218916 1032375423 /nfs/dbraw/zinc/37/54/23/1032375423.db2.gz NZQAUXZKYRWFKY-UHFFFAOYSA-N -1 3 314.728 3.552 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1cnn(Cc2ccccc2)c1 ZINC000132074597 1019367977 /nfs/dbraw/zinc/36/79/77/1019367977.db2.gz SBAMOGRNPGTUTM-UHFFFAOYSA-N -1 3 313.788 3.903 20 10 DHCDHM CCNC(=O)c1ccc(C)c(N[C@@H](C)c2ccc(F)cc2[O-])c1 ZINC000170789427 1019435339 /nfs/dbraw/zinc/43/53/39/1019435339.db2.gz KFQMQRAQGPDAPC-LBPRGKRZSA-N -1 3 316.376 3.763 20 10 DHCDHM COCCOCc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000858297291 1032834470 /nfs/dbraw/zinc/83/44/70/1032834470.db2.gz DMNJNDINLJCVDT-UHFFFAOYSA-N -1 3 321.804 3.821 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1CCCc2cccnc21 ZINC000922882087 1020327710 /nfs/dbraw/zinc/32/77/10/1020327710.db2.gz NSTAYECGJRAQQH-ZDUSSCGKSA-N -1 3 306.768 3.747 20 10 DHCDHM CN(Cc1csc2ccccc12)C(=O)c1cccc(O)c1[O-] ZINC000186941850 1020589693 /nfs/dbraw/zinc/58/96/93/1020589693.db2.gz HDZULCVNDDBIAJ-UHFFFAOYSA-N -1 3 313.378 3.585 20 10 DHCDHM CSCc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000182315152 1021597041 /nfs/dbraw/zinc/59/70/41/1021597041.db2.gz YEBHALGFPKLZRL-UHFFFAOYSA-N -1 3 303.383 3.522 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN[C@@H](C)c2cscn2)c1[O-] ZINC000852417772 1022120751 /nfs/dbraw/zinc/12/07/51/1022120751.db2.gz NNUGQXVUDJERBW-QMMMGPOBSA-N -1 3 310.806 3.556 20 10 DHCDHM CC(=O)N1Cc2ccc(N[C@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000363859521 1022344480 /nfs/dbraw/zinc/34/44/80/1022344480.db2.gz SNZOECBVPXTNHR-LLVKDONJSA-N -1 3 314.360 3.567 20 10 DHCDHM CC(=O)N1Cc2ccc(N[C@@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000363859523 1022344816 /nfs/dbraw/zinc/34/48/16/1022344816.db2.gz SNZOECBVPXTNHR-NSHDSACASA-N -1 3 314.360 3.567 20 10 DHCDHM CN(Cc1ccccc1[N+](=O)[O-])Cc1c([O-])cccc1Cl ZINC000768336774 1022946648 /nfs/dbraw/zinc/94/66/48/1022946648.db2.gz NTMVLSWIDGLOFP-UHFFFAOYSA-N -1 3 306.749 3.586 20 10 DHCDHM C[C@@H](N[C@H]1CCOc2c(F)cccc21)c1cc(F)cc(F)c1[O-] ZINC000785570862 1023595916 /nfs/dbraw/zinc/59/59/16/1023595916.db2.gz VKQZLFRDWYFUJX-PSLIRLAXSA-N -1 3 323.314 3.984 20 10 DHCDHM CCCN(Cc1ccccc1O)C(=O)c1ccc(CC)cc1[O-] ZINC000787119966 1023759721 /nfs/dbraw/zinc/75/97/21/1023759721.db2.gz GOGSKJBZTROTPD-UHFFFAOYSA-N -1 3 313.397 3.713 20 10 DHCDHM C[C@H](NCc1cccnc1F)c1cccc(C(F)(F)F)c1[O-] ZINC000788805950 1023936404 /nfs/dbraw/zinc/93/64/04/1023936404.db2.gz MMTJPIXOYADRDO-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1ccccc1OC1CCC1 ZINC000883011844 1024210732 /nfs/dbraw/zinc/21/07/32/1024210732.db2.gz LAGFCFYJEQQCKO-UHFFFAOYSA-N -1 3 319.351 3.892 20 10 DHCDHM CC(C)Oc1ccc(NC(=O)c2cccc(O)c2[O-])cc1Cl ZINC000790528735 1024318703 /nfs/dbraw/zinc/31/87/03/1024318703.db2.gz WCIRKONPROGAKA-UHFFFAOYSA-N -1 3 321.760 3.791 20 10 DHCDHM CCCCOc1ccc(NC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000790563429 1024327281 /nfs/dbraw/zinc/32/72/81/1024327281.db2.gz GAJRYMGJPOQLPW-UHFFFAOYSA-N -1 3 315.369 3.837 20 10 DHCDHM CCCN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCc2ccccc21 ZINC000790597461 1024332366 /nfs/dbraw/zinc/33/23/66/1024332366.db2.gz OSBXGTWIZNXXTD-MRXNPFEDSA-N -1 3 311.381 3.638 20 10 DHCDHM CCSc1ccc([C@@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000790641681 1024350456 /nfs/dbraw/zinc/35/04/56/1024350456.db2.gz HTZSLQAJJCOUGY-LLVKDONJSA-N -1 3 317.410 3.701 20 10 DHCDHM CCN(C)c1ccccc1CNCc1c([O-])ccc(Cl)c1F ZINC000790961316 1024407438 /nfs/dbraw/zinc/40/74/38/1024407438.db2.gz RFUQLGPVOOIVAT-UHFFFAOYSA-N -1 3 322.811 3.931 20 10 DHCDHM Cc1ccc(C(C)(C)NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790986233 1024412159 /nfs/dbraw/zinc/41/21/59/1024412159.db2.gz KJNGLJMHMMFYBN-UHFFFAOYSA-N -1 3 308.784 3.913 20 10 DHCDHM COc1ccc(CN(C)Cc2c([O-])ccc(Cl)c2F)cc1 ZINC000792156816 1024637417 /nfs/dbraw/zinc/63/74/17/1024637417.db2.gz NWUFXNIAVYTOCA-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM [O-]c1cc(Br)ccc1CN[C@H](C1CC1)C(F)(F)F ZINC000825940299 1033248772 /nfs/dbraw/zinc/24/87/72/1033248772.db2.gz SBCVKXYXLQFBDO-LLVKDONJSA-N -1 3 324.140 3.585 20 10 DHCDHM COc1cc(C)c(NC(=O)c2ccc(C)c(O)c2[O-])c(C)c1C ZINC000805295136 1025570997 /nfs/dbraw/zinc/57/09/97/1025570997.db2.gz WVQUNPJNPYKUSS-UHFFFAOYSA-N -1 3 315.369 3.592 20 10 DHCDHM O=[N+]([O-])c1ccc([O-])c(CNC2(c3cccc(Cl)c3)CC2)c1 ZINC000077467830 1025900703 /nfs/dbraw/zinc/90/07/03/1025900703.db2.gz AJOJBZKVVJQOIG-UHFFFAOYSA-N -1 3 318.760 3.733 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@@H]1NCc1c([O-])ccc(Cl)c1F ZINC000808443088 1026286865 /nfs/dbraw/zinc/28/68/65/1026286865.db2.gz AILQHXKTNPQAKY-XXFAHNHDSA-N -1 3 307.752 3.797 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]1c1cccnc1 ZINC000809729667 1026595096 /nfs/dbraw/zinc/59/50/96/1026595096.db2.gz WSSIIHBBFQETKF-AWEZNQCLSA-N -1 3 306.768 3.917 20 10 DHCDHM Cc1n[nH]c(C)c1[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000809768329 1026605851 /nfs/dbraw/zinc/60/58/51/1026605851.db2.gz IBUVXYGSICOUKM-AWEZNQCLSA-N -1 3 323.799 3.862 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@H]1NCc1cc(Cl)cc(F)c1[O-] ZINC000809787457 1026625903 /nfs/dbraw/zinc/62/59/03/1026625903.db2.gz DLSPBZDSVNWLFM-PSLIRLAXSA-N -1 3 307.752 3.797 20 10 DHCDHM O=[N+]([O-])c1cccc2c1CCN(Cc1cc(Cl)ccc1[O-])C2 ZINC000769426204 1026867190 /nfs/dbraw/zinc/86/71/90/1026867190.db2.gz NKUVEDIGEWFQJX-UHFFFAOYSA-N -1 3 318.760 3.512 20 10 DHCDHM Cc1nc(NC(=O)c2cccc(O)c2[O-])ccc1-c1ccccc1 ZINC000811606690 1027040165 /nfs/dbraw/zinc/04/01/65/1027040165.db2.gz HQCNXNQMALPMFQ-UHFFFAOYSA-N -1 3 320.348 3.721 20 10 DHCDHM CCn1ccnc1CN[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000296464467 1027645897 /nfs/dbraw/zinc/64/58/97/1027645897.db2.gz NLUPZCCNEVJJPC-VIFPVBQESA-N -1 3 314.216 3.766 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])[C@@H]1[C@H]1CCCO1 ZINC000816613807 1028964627 /nfs/dbraw/zinc/96/46/27/1028964627.db2.gz FVCGCBCXOJHIGO-HUUCEWRRSA-N -1 3 313.800 3.574 20 10 DHCDHM O=C(N[C@H]1CCCc2sc(Cl)cc21)c1cccc(O)c1[O-] ZINC000817019359 1029053208 /nfs/dbraw/zinc/05/32/08/1029053208.db2.gz GLVBZDPAUGAYKT-JTQLQIEISA-N -1 3 323.801 3.620 20 10 DHCDHM Cc1nnc(-c2cc(F)ccc2NCc2cccc(F)c2[O-])o1 ZINC000373499518 1029063346 /nfs/dbraw/zinc/06/33/46/1029063346.db2.gz YNDPVIWDZSPWPE-UHFFFAOYSA-N -1 3 317.295 3.641 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000290896151 1030242285 /nfs/dbraw/zinc/24/22/85/1030242285.db2.gz LUJBBMZENHIDOF-GDBMZVCRSA-N -1 3 307.821 3.579 20 10 DHCDHM [O-]c1c(Br)cccc1CNc1ccc2c(n1)CCC2 ZINC000825124574 1030731022 /nfs/dbraw/zinc/73/10/22/1030731022.db2.gz SETWBEZXGHNRRN-UHFFFAOYSA-N -1 3 319.202 3.651 20 10 DHCDHM C[C@H](NCc1nc2c(s1)CCCC2)c1ccc(F)cc1[O-] ZINC000926917845 1030991091 /nfs/dbraw/zinc/99/10/91/1030991091.db2.gz DNBWENNSJXRQRG-JTQLQIEISA-N -1 3 306.406 3.717 20 10 DHCDHM Cc1ccc(S(=O)(=O)[N-]c2ccc(O)c(C(C)C)c2)cc1 ZINC000034530714 1031028993 /nfs/dbraw/zinc/02/89/93/1031028993.db2.gz NQQVADDLHRBNGR-UHFFFAOYSA-N -1 3 305.399 3.625 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN(Cc1ccccn1)C1CC1 ZINC000293810613 1031635110 /nfs/dbraw/zinc/63/51/10/1031635110.db2.gz FDDVPCMAUCIFLS-UHFFFAOYSA-N -1 3 306.768 3.744 20 10 DHCDHM CCn1ncc(NCc2cc(C)cc(Br)c2[O-])c1C ZINC000873197052 1031755302 /nfs/dbraw/zinc/75/53/02/1031755302.db2.gz YABGQKJGGZXGAB-UHFFFAOYSA-N -1 3 324.222 3.600 20 10 DHCDHM CC(C)O[C@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000846016172 1031809733 /nfs/dbraw/zinc/80/97/33/1031809733.db2.gz QHNQRWYBSNNMFY-ZDUSSCGKSA-N -1 3 301.789 3.574 20 10 DHCDHM C[C@@H](CO)C1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000846059179 1031815779 /nfs/dbraw/zinc/81/57/79/1031815779.db2.gz ZWXUSMFXRBXHEU-JTQLQIEISA-N -1 3 318.244 3.539 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccccc2NC2CCC2)c([O-])c1O ZINC000846436328 1031976641 /nfs/dbraw/zinc/97/66/41/1031976641.db2.gz AOUWYCSWTYIJAM-UHFFFAOYSA-N -1 3 312.369 3.623 20 10 DHCDHM CCN(Cc1ccncc1)Cc1c([O-])cccc1Br ZINC000862366043 1033832237 /nfs/dbraw/zinc/83/22/37/1033832237.db2.gz BHRQGGYSLWYHDA-UHFFFAOYSA-N -1 3 321.218 3.572 20 10 DHCDHM CN1CCN(Cc2c([O-])ccc(Cl)c2F)Cc2ccccc21 ZINC001180212967 1035623495 /nfs/dbraw/zinc/62/34/95/1035623495.db2.gz LLTUYRVHHMIQHF-UHFFFAOYSA-N -1 3 320.795 3.637 20 10 DHCDHM CC[C@@H](C)COC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001194826562 1036047252 /nfs/dbraw/zinc/04/72/52/1036047252.db2.gz NORJOQJPFKPJAX-SNVBAGLBSA-N -1 3 322.792 3.866 20 10 DHCDHM CN(Cc1ccc2c(c1)OCO2)Cc1cc(Cl)cc(F)c1[O-] ZINC000775644182 1036163436 /nfs/dbraw/zinc/16/34/36/1036163436.db2.gz FTJAZLXURHPYMS-UHFFFAOYSA-N -1 3 323.751 3.545 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC[C@@H](OCC(F)(F)F)C1 ZINC000775654915 1036240681 /nfs/dbraw/zinc/24/06/81/1036240681.db2.gz RAURVMXKLYLDMY-LLVKDONJSA-N -1 3 323.742 3.589 20 10 DHCDHM CC[C@H](NCc1cc(Cl)c(C)cc1[O-])C(=O)OC(C)(C)C ZINC001182532792 1036378688 /nfs/dbraw/zinc/37/86/88/1036378688.db2.gz GATSGLIHBQXPSA-ZDUSSCGKSA-N -1 3 313.825 3.564 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1ccsc1Br ZINC001183919771 1036710314 /nfs/dbraw/zinc/71/03/14/1036710314.db2.gz PIIIXRJTEIEJSK-UHFFFAOYSA-N -1 3 316.195 3.645 20 10 DHCDHM COc1c([O-])c(CNc2cccc(Cl)c2C)ccc1[N+](=O)[O-] ZINC000774936356 1037251026 /nfs/dbraw/zinc/25/10/26/1037251026.db2.gz RTGVWLXVEBVGER-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H](CC(F)(F)F)C1 ZINC000775136871 1037685378 /nfs/dbraw/zinc/68/53/78/1037685378.db2.gz NIOQKZYQRXJJGL-MRVPVSSYSA-N -1 3 311.706 3.959 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC[C@@H](C(F)(F)F)C2)c1[O-] ZINC000173011089 1040132991 /nfs/dbraw/zinc/13/29/91/1040132991.db2.gz OXEQLPPVIUZTCG-LLVKDONJSA-N -1 3 319.298 3.508 20 10 DHCDHM CCc1nn(C)cc1N[C@H](C)c1cc(Br)ccc1[O-] ZINC000273351743 130110080 /nfs/dbraw/zinc/11/00/80/130110080.db2.gz BVEPMBLWEUAKMG-SECBINFHSA-N -1 3 324.222 3.624 20 10 DHCDHM COc1ccccc1[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273372657 130112330 /nfs/dbraw/zinc/11/23/30/130112330.db2.gz GNBVSBBWYNMRCS-NEPJUHHUSA-N -1 3 316.357 3.721 20 10 DHCDHM COc1cccc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273390282 130115709 /nfs/dbraw/zinc/11/57/09/130115709.db2.gz KKZFVNGIPNHEOH-RYUDHWBXSA-N -1 3 316.357 3.721 20 10 DHCDHM C[C@H](N[C@@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273444775 130122754 /nfs/dbraw/zinc/12/27/54/130122754.db2.gz ZRSAEGBVNPWBHC-IINYFYTJSA-N -1 3 302.330 3.622 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)N[C@H]2CCCc3occc32)c1 ZINC000273437055 130122978 /nfs/dbraw/zinc/12/29/78/130122978.db2.gz XDTOITOLTNSCCF-NHYWBVRUSA-N -1 3 315.369 3.500 20 10 DHCDHM C[C@H](NC1(c2cccc(F)c2)CC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273517899 130130377 /nfs/dbraw/zinc/13/03/77/130130377.db2.gz SWVSJFIEABABFT-NSHDSACASA-N -1 3 316.332 3.779 20 10 DHCDHM COc1ccc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273576931 130140615 /nfs/dbraw/zinc/14/06/15/130140615.db2.gz MAPJWCDHAFPRLH-NEPJUHHUSA-N -1 3 316.357 3.721 20 10 DHCDHM C[C@@H](N[C@@H]1CCc2c1cccc2F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273606030 130144282 /nfs/dbraw/zinc/14/42/82/130144282.db2.gz UDLUZADYJJUQDN-QLJPJBMISA-N -1 3 316.332 3.778 20 10 DHCDHM C[C@@H](N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1[O-] ZINC000286892137 131254398 /nfs/dbraw/zinc/25/43/98/131254398.db2.gz DCSJTRCCGVPGKL-PXAZEXFGSA-N -1 3 320.383 3.624 20 10 DHCDHM CC[C@@H](N[C@@H](CO)c1ccc(F)cc1)c1cccc(Cl)c1[O-] ZINC000287572607 131287863 /nfs/dbraw/zinc/28/78/63/131287863.db2.gz GXJUNEYQMIOAAZ-CVEARBPZSA-N -1 3 323.795 3.959 20 10 DHCDHM CC[C@@H](NCc1cn2ccsc2n1)c1cccc(Cl)c1[O-] ZINC000287620867 131291300 /nfs/dbraw/zinc/29/13/00/131291300.db2.gz JUQBJMMREIHDBW-CYBMUJFWSA-N -1 3 321.833 3.996 20 10 DHCDHM CC[C@H](NCc1cccnc1OC)c1cccc(Cl)c1[O-] ZINC000287633665 131291467 /nfs/dbraw/zinc/29/14/67/131291467.db2.gz KNRUHTDIJGHOKF-AWEZNQCLSA-N -1 3 306.793 3.690 20 10 DHCDHM CC[C@H](C)c1nnc([C@@H](C)N[C@@H](CC)c2ccc(F)cc2[O-])[nH]1 ZINC000287733733 131297281 /nfs/dbraw/zinc/29/72/81/131297281.db2.gz YNFCDVKNRCEXHA-WDMOLILDSA-N -1 3 320.412 3.965 20 10 DHCDHM Cc1ccc(C(=O)N(C)C)cc1N[C@H](C)c1cc(F)ccc1[O-] ZINC000176983220 332967024 /nfs/dbraw/zinc/96/70/24/332967024.db2.gz RQMXGVQRSJALBK-GFCCVEGCSA-N -1 3 316.376 3.715 20 10 DHCDHM COc1c([O-])c(CN(C)[C@@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000278274747 334094377 /nfs/dbraw/zinc/09/43/77/334094377.db2.gz RZLVBWBASIGKOL-JTQLQIEISA-N -1 3 322.386 3.564 20 10 DHCDHM C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cccc(O)c1[O-] ZINC000292663238 334190388 /nfs/dbraw/zinc/19/03/88/334190388.db2.gz LPGBXFBPPNQCQU-DVOMOZLQSA-N -1 3 311.381 3.505 20 10 DHCDHM CC[C@H](NC1(c2noc(C(F)F)n2)CCC1)c1ccccc1[O-] ZINC000367827599 336830234 /nfs/dbraw/zinc/83/02/34/336830234.db2.gz DZRISFOKSXRQDQ-NSHDSACASA-N -1 3 323.343 3.833 20 10 DHCDHM Cc1cc(C=C2CCN(Cc3cccc(F)c3[O-])CC2)no1 ZINC000374897165 336999106 /nfs/dbraw/zinc/99/91/06/336999106.db2.gz POPRZYGYGKUERV-UHFFFAOYSA-N -1 3 302.349 3.507 20 10 DHCDHM Cc1cc([C@@H]2CCCN2Cc2cc(Cl)cc(C)c2[O-])no1 ZINC000375018896 337001679 /nfs/dbraw/zinc/00/16/79/337001679.db2.gz KCDDSDYPXZNIMH-HNNXBMFYSA-N -1 3 306.793 3.988 20 10 DHCDHM [O-]c1ccc2ccccc2c1CNc1cnc2c(c1)COCC2 ZINC000375052246 337002151 /nfs/dbraw/zinc/00/21/51/337002151.db2.gz BRVJTEBAKZZRCJ-UHFFFAOYSA-N -1 3 306.365 3.625 20 10 DHCDHM CC[C@H](c1ccccc1[O-])N1CCn2c(C(C)C)nnc2[C@H]1C ZINC000377633583 337056967 /nfs/dbraw/zinc/05/69/67/337056967.db2.gz VMNGDBRFWFBBGM-UKRRQHHQSA-N -1 3 314.433 3.635 20 10 DHCDHM Cc1coc(-c2cccc(NC(=O)c3ccc(C)c(O)c3[O-])c2)n1 ZINC000182603508 337189154 /nfs/dbraw/zinc/18/91/54/337189154.db2.gz LYSPWGRBZKFOLF-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@@H](C)c2cn(-c3ccccc3)nn2)c([O-])c1 ZINC000186113179 337253784 /nfs/dbraw/zinc/25/37/84/337253784.db2.gz RLKSYVCSXOULTB-CABCVRRESA-N -1 3 322.412 3.693 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)CCCC(=O)N2)c1cc(F)ccc1[O-] ZINC000186445579 337256223 /nfs/dbraw/zinc/25/62/23/337256223.db2.gz DAJXNBVMINJIKS-LLVKDONJSA-N -1 3 314.360 3.979 20 10 DHCDHM CCOc1ccccc1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000191213691 521504278 /nfs/dbraw/zinc/50/42/78/521504278.db2.gz XTNYZKLNERDZKW-NSHDSACASA-N -1 3 307.340 3.920 20 10 DHCDHM C[C@H](NCC1(C)OCCCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000190667362 525317515 /nfs/dbraw/zinc/31/75/15/525317515.db2.gz FPRAXFHADGQYAP-VIFPVBQESA-N -1 3 320.216 3.503 20 10 DHCDHM C[C@H](N[C@@H]1CN(C)Cc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000364793676 525585740 /nfs/dbraw/zinc/58/57/40/525585740.db2.gz QMKQKUIQGWLGDX-MEDUHNTESA-N -1 3 318.367 3.508 20 10 DHCDHM CC[C@@H](NCc1csc([C@@H](C)OC)n1)c1ccc(F)cc1[O-] ZINC000285937439 535806292 /nfs/dbraw/zinc/80/62/92/535806292.db2.gz FNTSCQJOWNEMDD-QMTHXVAHSA-N -1 3 324.421 3.936 20 10 DHCDHM COc1ccc(CN[C@@H](C)c2cc(Cl)ccc2[O-])c(OC)c1 ZINC000273380870 536896948 /nfs/dbraw/zinc/89/69/48/536896948.db2.gz IFYNOPSSPNUNRC-NSHDSACASA-N -1 3 321.804 3.914 20 10 DHCDHM C[C@@H](c1ccccc1)[N@H+](CCCC(=O)[O-])Cc1ccccc1[O-] ZINC000833548749 605078017 /nfs/dbraw/zinc/07/80/17/605078017.db2.gz MBYFINILXOHGEC-HNNXBMFYSA-N -1 3 313.397 3.820 20 10 DHCDHM C[C@@H](c1ccccc1)[N@@H+](CCCC(=O)[O-])Cc1ccccc1[O-] ZINC000833548749 605078024 /nfs/dbraw/zinc/07/80/24/605078024.db2.gz MBYFINILXOHGEC-HNNXBMFYSA-N -1 3 313.397 3.820 20 10 DHCDHM C[C@@H]1C[C@H](c2cccnc2)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894461198 1013379263 /nfs/dbraw/zinc/37/92/63/1013379263.db2.gz CYURPFHMYNVYSC-BDJLRTHQSA-N -1 3 304.340 3.649 20 10 DHCDHM C[C@]12CCN(Cc3cc(F)cc(F)c3[O-])C[C@H]1C2(Cl)Cl ZINC000894689560 1013456832 /nfs/dbraw/zinc/45/68/32/1013456832.db2.gz DVVVBIUIXOKOFC-YPMHNXCESA-N -1 3 322.182 3.686 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCC(Cc2nccs2)CC1 ZINC000895439017 1015152602 /nfs/dbraw/zinc/15/26/02/1015152602.db2.gz SGOGLALTDZKNLO-UHFFFAOYSA-N -1 3 324.396 3.582 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1ccccc1OCC1CC1 ZINC000896639218 1015693786 /nfs/dbraw/zinc/69/37/86/1015693786.db2.gz BFZFGWPTWQLGPJ-UHFFFAOYSA-N -1 3 301.361 3.610 20 10 DHCDHM CCCn1c2ccccc2nc1CNCc1c([O-])cccc1F ZINC000896639225 1015693418 /nfs/dbraw/zinc/69/34/18/1015693418.db2.gz BHXSPKWSXIAYTR-UHFFFAOYSA-N -1 3 313.376 3.581 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCSC2(CCC2)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593232607 994386223 /nfs/dbraw/zinc/38/62/23/994386223.db2.gz OAFWPXFTFVZRIQ-YPMHNXCESA-N -1 3 321.442 3.559 20 10 DHCDHM Cc1nc2cc(NC(=O)c3cccc(O)c3[O-])c(C)cc2s1 ZINC001148219204 1032374376 /nfs/dbraw/zinc/37/43/76/1032374376.db2.gz WXZYOURYZTZSLU-UHFFFAOYSA-N -1 3 314.366 3.577 20 10 DHCDHM [O-]c1c(CN2CCC[C@@H](CC(F)(F)F)C2)ccc(F)c1F ZINC000877594985 1033373458 /nfs/dbraw/zinc/37/34/58/1033373458.db2.gz ORCQGVNWLPBADE-VIFPVBQESA-N -1 3 309.278 3.835 20 10 DHCDHM CCSc1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000780939258 1017193649 /nfs/dbraw/zinc/19/36/49/1017193649.db2.gz PMHVLOVMKUQBNT-UHFFFAOYSA-N -1 3 303.383 3.771 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(Br)c2[O-])C1 ZINC000708133892 1017667012 /nfs/dbraw/zinc/66/70/12/1017667012.db2.gz NYAQEDBLBRIVDZ-MRVPVSSYSA-N -1 3 304.615 3.650 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2occc2C)c1[O-] ZINC000386787826 1019023604 /nfs/dbraw/zinc/02/36/04/1019023604.db2.gz LJDWOZZJNBIUPE-UHFFFAOYSA-N -1 3 307.777 3.782 20 10 DHCDHM CCOc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1CO ZINC000170789599 1019438471 /nfs/dbraw/zinc/43/84/71/1019438471.db2.gz VBGUOWQYPKNZIT-LLVKDONJSA-N -1 3 305.349 3.595 20 10 DHCDHM Cc1ccc(C(=O)N2CC3(CCCC3)c3ccccc32)c([O-])c1O ZINC000179540189 1020402396 /nfs/dbraw/zinc/40/23/96/1020402396.db2.gz PAPVUMUIFSLRLH-UHFFFAOYSA-N -1 3 323.392 3.878 20 10 DHCDHM CCC(F)(F)CN[C@@H](C)c1ccc(Br)cc1[O-] ZINC000858507244 1032926255 /nfs/dbraw/zinc/92/62/55/1032926255.db2.gz NEFKSXXHCJKYSS-QMMMGPOBSA-N -1 3 308.166 3.851 20 10 DHCDHM [O-]c1c(CNc2cccc(F)n2)cc(Cl)c2cccnc12 ZINC001168523764 1021508608 /nfs/dbraw/zinc/50/86/08/1021508608.db2.gz RYEOWCJCAZSNGA-UHFFFAOYSA-N -1 3 303.724 3.740 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822146 1033472664 /nfs/dbraw/zinc/47/26/64/1033472664.db2.gz PCFIHBJBCMOWMW-CYBMUJFWSA-N -1 3 323.742 3.507 20 10 DHCDHM COC1(C)CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000272375815 1022501685 /nfs/dbraw/zinc/50/16/85/1022501685.db2.gz QGNIOXAIHVUZQZ-UHFFFAOYSA-N -1 3 304.217 3.700 20 10 DHCDHM COCCN(Cc1cccs1)Cc1c([O-])cccc1Cl ZINC000768199072 1022914659 /nfs/dbraw/zinc/91/46/59/1022914659.db2.gz XOFPMYZCVAMYKK-UHFFFAOYSA-N -1 3 311.834 3.756 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@H](CO)c1ccsc1 ZINC000769936313 1023250514 /nfs/dbraw/zinc/25/05/14/1023250514.db2.gz XHKCBBMKBPCBBN-GFCCVEGCSA-N -1 3 318.225 3.584 20 10 DHCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1cc2ccccc2s1 ZINC000785835396 1023624219 /nfs/dbraw/zinc/62/42/19/1023624219.db2.gz SDZKGCJOAQHAKW-SNVBAGLBSA-N -1 3 313.378 3.804 20 10 DHCDHM C[C@H](Nc1ccc2ccc(=O)n(C)c2c1)c1ccc(F)cc1[O-] ZINC000786942777 1023745792 /nfs/dbraw/zinc/74/57/92/1023745792.db2.gz ZDBUWWIVCIEMCN-NSHDSACASA-N -1 3 312.344 3.556 20 10 DHCDHM Cc1csc([C@H](NCc2cc(F)cc(F)c2[O-])C2CC2)n1 ZINC000883018612 1024211940 /nfs/dbraw/zinc/21/19/40/1024211940.db2.gz JNLABMZAOOCPEK-CYBMUJFWSA-N -1 3 310.369 3.676 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]1c1ccccn1 ZINC000792162530 1024639198 /nfs/dbraw/zinc/63/91/98/1024639198.db2.gz KIKVUPLIDAZNCD-CQSZACIVSA-N -1 3 306.768 3.917 20 10 DHCDHM [O-]c1ccc(F)cc1CN(Cc1c(F)cccc1F)C1CC1 ZINC000792185043 1024646667 /nfs/dbraw/zinc/64/66/67/1024646667.db2.gz ZKIBJSRBNZZFTO-UHFFFAOYSA-N -1 3 307.315 3.974 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCC[C@H]1c1ccc[nH]1 ZINC000127459908 1024680302 /nfs/dbraw/zinc/68/03/02/1024680302.db2.gz ZIASVTNFABAOJV-AWEZNQCLSA-N -1 3 321.218 3.820 20 10 DHCDHM [O-]c1cc(Br)ccc1CN[C@@H](C1CC1)C(F)(F)F ZINC000825940300 1033249202 /nfs/dbraw/zinc/24/92/02/1033249202.db2.gz SBCVKXYXLQFBDO-NSHDSACASA-N -1 3 324.140 3.585 20 10 DHCDHM CN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000054430397 1025114904 /nfs/dbraw/zinc/11/49/04/1025114904.db2.gz KWLXFNUVOLUYTL-AWEZNQCLSA-N -1 3 323.179 3.895 20 10 DHCDHM CCc1ccc(N(CC(C)C)C(=O)c2cccc(O)c2[O-])cc1 ZINC000794125360 1025221627 /nfs/dbraw/zinc/22/16/27/1025221627.db2.gz CIPWWJWGGGQVSH-UHFFFAOYSA-N -1 3 313.397 3.963 20 10 DHCDHM C[C@@H]1C[C@H](c2cccnc2)N(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877341939 1033287167 /nfs/dbraw/zinc/28/71/67/1033287167.db2.gz HLWRKUSIBLDTBX-IAQYHMDHSA-N -1 3 304.340 3.649 20 10 DHCDHM COc1ccc2c(c1)OCC[C@@H]2N[C@@H](C)c1c([O-])cccc1F ZINC000886533143 1025681634 /nfs/dbraw/zinc/68/16/34/1025681634.db2.gz VTKXNEXZWSAXFD-NHYWBVRUSA-N -1 3 317.360 3.714 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)OCCCO2)c1c([O-])cccc1F ZINC000886563908 1025710049 /nfs/dbraw/zinc/71/00/49/1025710049.db2.gz IWYNUNBIDMCYLX-NSHDSACASA-N -1 3 303.333 3.866 20 10 DHCDHM COCCOc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1F ZINC000886568887 1025713025 /nfs/dbraw/zinc/71/30/25/1025713025.db2.gz ZBFHLGCCKXAZNG-NSHDSACASA-N -1 3 323.339 3.869 20 10 DHCDHM C[C@@H](N[C@H]1CCCC1(F)F)c1ccc(Br)cc1[O-] ZINC000806179760 1025835730 /nfs/dbraw/zinc/83/57/30/1025835730.db2.gz GZVAGKISXPYGTR-PELKAZGASA-N -1 3 320.177 3.993 20 10 DHCDHM Cc1cnn(C2CCN(Cc3c([O-])ccc(Cl)c3F)CC2)c1 ZINC000364745874 1027883381 /nfs/dbraw/zinc/88/33/81/1027883381.db2.gz IVSSGAFDKQACOG-UHFFFAOYSA-N -1 3 323.799 3.527 20 10 DHCDHM CC(C)c1ccc2c(c1)CCCN2C(=O)c1cccc(O)c1[O-] ZINC000188215857 1028503999 /nfs/dbraw/zinc/50/39/99/1028503999.db2.gz GGZXDZUAFUPZGO-UHFFFAOYSA-N -1 3 311.381 3.814 20 10 DHCDHM C[C@H](NCc1cscn1)c1cccc(C(F)(F)F)c1[O-] ZINC000815571349 1028565004 /nfs/dbraw/zinc/56/50/04/1028565004.db2.gz BDACQBRIMHUQOQ-QMMMGPOBSA-N -1 3 302.321 3.718 20 10 DHCDHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2CC)cc1 ZINC000189434089 1028577460 /nfs/dbraw/zinc/57/74/60/1028577460.db2.gz ZDQOPSJUFHYYLD-UHFFFAOYSA-N -1 3 319.426 3.708 20 10 DHCDHM CC[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1nccs1 ZINC000816552410 1028922214 /nfs/dbraw/zinc/92/22/14/1028922214.db2.gz LMULGKDOAWPPSE-LLVKDONJSA-N -1 3 300.786 3.882 20 10 DHCDHM Cc1n[nH]cc1C1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816603772 1028958515 /nfs/dbraw/zinc/95/85/15/1028958515.db2.gz PBYRNFVAIPHLMV-UHFFFAOYSA-N -1 3 323.799 3.596 20 10 DHCDHM CCc1ccc([C@H](NC(=O)c2cccc(O)c2[O-])C(C)C)cc1 ZINC001135978061 1029232234 /nfs/dbraw/zinc/23/22/34/1029232234.db2.gz GXGFTDMYRPHSJL-QGZVFWFLSA-N -1 3 313.397 3.787 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1nnc(CC2CCCC2)o1 ZINC000777515859 1030085742 /nfs/dbraw/zinc/08/57/42/1030085742.db2.gz RARIJOFGNGYRKG-UHFFFAOYSA-N -1 3 307.781 3.773 20 10 DHCDHM O=[N+]([O-])c1ccc([O-])c(CNCc2ccc(C3CC3)cc2F)c1 ZINC000291656079 1030584261 /nfs/dbraw/zinc/58/42/61/1030584261.db2.gz DISLOJHFCLEKTO-UHFFFAOYSA-N -1 3 316.332 3.607 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000824632664 1030598013 /nfs/dbraw/zinc/59/80/13/1030598013.db2.gz PECNYYBMTZXQMC-OAHLLOKOSA-N -1 3 323.845 3.989 20 10 DHCDHM CC1(C)CCN(Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144299928 1031439828 /nfs/dbraw/zinc/43/98/28/1031439828.db2.gz MQWMVUMCMBVDOG-UHFFFAOYSA-N -1 3 302.187 3.526 20 10 DHCDHM COC[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1ccc(C)o1 ZINC000293513264 1031497901 /nfs/dbraw/zinc/49/79/01/1031497901.db2.gz CHWRHPRXIWDNHH-CYBMUJFWSA-N -1 3 313.756 3.563 20 10 DHCDHM CCCc1nc(C)c(CN[C@@H](C)c2ccc(F)c(F)c2[O-])o1 ZINC000293749714 1031601970 /nfs/dbraw/zinc/60/19/70/1031601970.db2.gz RHQUADNNRSMRGK-VIFPVBQESA-N -1 3 310.344 3.770 20 10 DHCDHM CC(C)c1ncc2c(n1)CCN(Cc1c([O-])cccc1Cl)C2 ZINC000527617664 1031774601 /nfs/dbraw/zinc/77/46/01/1031774601.db2.gz CRVBKWGNROVORX-UHFFFAOYSA-N -1 3 317.820 3.517 20 10 DHCDHM CC(C)N(CC(=O)c1ccccc1)Cc1cc(F)c(F)cc1[O-] ZINC001142527113 1031906820 /nfs/dbraw/zinc/90/68/20/1031906820.db2.gz KZBFNOYGERIBFN-UHFFFAOYSA-N -1 3 319.351 3.764 20 10 DHCDHM C[C@@H](NCc1cc(F)cc(F)c1[O-])c1cnn(CC2CCC2)c1 ZINC000898184700 1031985727 /nfs/dbraw/zinc/98/57/27/1031985727.db2.gz VPFCTIUTDOPGID-LLVKDONJSA-N -1 3 321.371 3.518 20 10 DHCDHM C[C@@H]1C[C@@H](C(F)(F)F)CCN1Cc1ccc(F)c(F)c1[O-] ZINC000877563009 1033357640 /nfs/dbraw/zinc/35/76/40/1033357640.db2.gz FAVAEYYTZAOKPC-SCZZXKLOSA-N -1 3 309.278 3.833 20 10 DHCDHM C[C@H](c1ccco1)N(C)Cc1c([O-])cccc1Br ZINC000862219502 1033784311 /nfs/dbraw/zinc/78/43/11/1033784311.db2.gz HMQCHDMDYWHQLT-SNVBAGLBSA-N -1 3 310.191 3.941 20 10 DHCDHM C[C@H](Nc1cccc(-n2nccn2)c1)c1ccc(Cl)cc1[O-] ZINC000864023605 1034262821 /nfs/dbraw/zinc/26/28/21/1034262821.db2.gz SCIOADSYMADGMS-NSHDSACASA-N -1 3 314.776 3.799 20 10 DHCDHM COc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])c(OC)c1OC ZINC000186345047 1034620790 /nfs/dbraw/zinc/62/07/90/1034620790.db2.gz LYFLMVDJZWUYMW-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM C[C@H]1[C@@H](C(F)(F)F)CCCN1Cc1cc(F)cc(F)c1[O-] ZINC001180970703 1035798769 /nfs/dbraw/zinc/79/87/69/1035798769.db2.gz WBKRXVGVKNVVRO-KWQFWETISA-N -1 3 309.278 3.833 20 10 DHCDHM CC[C@H](C)COC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001194826561 1036046258 /nfs/dbraw/zinc/04/62/58/1036046258.db2.gz NORJOQJPFKPJAX-JTQLQIEISA-N -1 3 322.792 3.866 20 10 DHCDHM CC(C)CCOC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001194892945 1036083674 /nfs/dbraw/zinc/08/36/74/1036083674.db2.gz HPSAGNJWJCBYJQ-UHFFFAOYSA-N -1 3 322.792 3.866 20 10 DHCDHM COC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1C ZINC000762651041 1036892453 /nfs/dbraw/zinc/89/24/53/1036892453.db2.gz GHDRKBOBRHVPTE-UHFFFAOYSA-N -1 3 305.761 3.753 20 10 DHCDHM O=[N+]([O-])c1cnc(NCc2c([O-])cccc2F)c2ccccc21 ZINC001187677560 1037688914 /nfs/dbraw/zinc/68/89/14/1037688914.db2.gz NJCMOGJRCCGRSS-UHFFFAOYSA-N -1 3 313.288 3.600 20 10 DHCDHM CC(C)[C@H](NCc1cc(Cl)ccc1[O-])C(=O)OC(C)(C)C ZINC000776251364 1038068142 /nfs/dbraw/zinc/06/81/42/1038068142.db2.gz CSWPZXNSRRUJMB-AWEZNQCLSA-N -1 3 313.825 3.502 20 10 DHCDHM CC[C@H](NCc1ccco1)c1cc(Br)ccc1[O-] ZINC000022169318 182312163 /nfs/dbraw/zinc/31/21/63/182312163.db2.gz XBDUNJDNEQZDGP-ZDUSSCGKSA-N -1 3 310.191 3.989 20 10 DHCDHM C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273569531 130138980 /nfs/dbraw/zinc/13/89/80/130138980.db2.gz KISFPESYZRGHTF-HWPZZCPQSA-N -1 3 316.332 3.778 20 10 DHCDHM C[C@H](N[C@@H](C)C(F)(F)F)c1ccc(Br)cc1[O-] ZINC000287262321 131272484 /nfs/dbraw/zinc/27/24/84/131272484.db2.gz ILZHQWYHTNDZEJ-BQBZGAKWSA-N -1 3 312.129 3.756 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cc(Br)ccc1[O-])C(F)(F)F ZINC000287310428 131274321 /nfs/dbraw/zinc/27/43/21/131274321.db2.gz LEHIEQKYBUWWFZ-NKWVEPMBSA-N -1 3 312.129 3.756 20 10 DHCDHM CC[C@@H](N[C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(F)cc1[O-] ZINC000287733677 131298215 /nfs/dbraw/zinc/29/82/15/131298215.db2.gz YNFCDVKNRCEXHA-COPLHBTASA-N -1 3 320.412 3.965 20 10 DHCDHM CCNC(=O)c1ccc(C)c(N[C@@H](C)c2cc(F)ccc2[O-])c1 ZINC000176985070 332967020 /nfs/dbraw/zinc/96/70/20/332967020.db2.gz RFALYNIOPSPSIG-LBPRGKRZSA-N -1 3 316.376 3.763 20 10 DHCDHM CC[C@@H](C)NC(=O)c1ccc(NCc2cc(F)ccc2[O-])cc1 ZINC000280689144 334119258 /nfs/dbraw/zinc/11/92/58/334119258.db2.gz OFGQCXBVXUBLRA-GFCCVEGCSA-N -1 3 316.376 3.672 20 10 DHCDHM Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])CO2 ZINC000372621750 336936379 /nfs/dbraw/zinc/93/63/79/336936379.db2.gz SDXLPLCJTHECJD-HZMBPMFUSA-N -1 3 305.324 3.763 20 10 DHCDHM CO[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000378636941 337077290 /nfs/dbraw/zinc/07/72/90/337077290.db2.gz YKMXGDQMQKAIEI-GFCCVEGCSA-N -1 3 304.217 3.700 20 10 DHCDHM [O-]c1ccc(Cl)cc1CNCc1ncoc1-c1ccccc1 ZINC000360035853 337084173 /nfs/dbraw/zinc/08/41/73/337084173.db2.gz KYLWJTBVAJQJRA-UHFFFAOYSA-N -1 3 314.772 3.990 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccccc1[O-])c1noc(-c2ccccc2)n1 ZINC000183562691 337192325 /nfs/dbraw/zinc/19/23/25/337192325.db2.gz VMFWGGQNAVLECS-STQMWFEESA-N -1 3 309.369 3.854 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)CN(C)C(=O)N2)c1ccc(F)cc1[O-] ZINC000186552739 337257452 /nfs/dbraw/zinc/25/74/52/337257452.db2.gz HGYPCNWWEPDLAT-JTQLQIEISA-N -1 3 315.348 3.682 20 10 DHCDHM CN(Cc1ncc(-c2ccccc2F)o1)Cc1ccccc1[O-] ZINC000119527179 337394846 /nfs/dbraw/zinc/39/48/46/337394846.db2.gz GVSVHJRVNYVJDO-UHFFFAOYSA-N -1 3 312.344 3.818 20 10 DHCDHM CC[C@H](N[C@H]1CCCn2nc(C(C)C)nc21)c1ccccc1[O-] ZINC000156317670 522754034 /nfs/dbraw/zinc/75/40/34/522754034.db2.gz KNMVURVDZIIFLV-GJZGRUSLSA-N -1 3 314.433 3.683 20 10 DHCDHM CCC[N@H+](Cc1ccc(C(=O)[O-])s1)Cc1ccccc1[O-] ZINC000829496550 601947011 /nfs/dbraw/zinc/94/70/11/601947011.db2.gz ICELRHQLFOZRLD-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM CCC[N@@H+](Cc1ccc(C(=O)[O-])s1)Cc1ccccc1[O-] ZINC000829496550 601947015 /nfs/dbraw/zinc/94/70/15/601947015.db2.gz ICELRHQLFOZRLD-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000829496442 604770196 /nfs/dbraw/zinc/77/01/96/604770196.db2.gz AMSPGFDJFCFAFA-KRWDZBQOSA-N -1 3 317.360 3.569 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000829496442 604770199 /nfs/dbraw/zinc/77/01/99/604770199.db2.gz AMSPGFDJFCFAFA-KRWDZBQOSA-N -1 3 317.360 3.569 20 10 DHCDHM CC[C@@H](N[C@@H](C)c1ncc(C(=O)[O-])s1)c1ccc(C)cc1O ZINC001595281289 980332484 /nfs/dbraw/zinc/33/24/84/980332484.db2.gz LMZDCLMEAPQEKK-CMPLNLGQSA-N -1 3 320.414 3.657 20 10 DHCDHM CC[C@@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1ccc(C)cc1[O-] ZINC001595305528 980448370 /nfs/dbraw/zinc/44/83/70/980448370.db2.gz QZESDWIIIGSELQ-QGZVFWFLSA-N -1 3 313.397 3.569 20 10 DHCDHM CC(C)(NCc1ccc(F)c(F)c1[O-])c1ccc(F)cc1F ZINC000895855315 1015333303 /nfs/dbraw/zinc/33/33/03/1015333303.db2.gz SNHRUQYLIYFVLK-UHFFFAOYSA-N -1 3 313.294 3.974 20 10 DHCDHM COCC[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1ccco1 ZINC000276867278 1015719149 /nfs/dbraw/zinc/71/91/49/1015719149.db2.gz DIVTZAIHJXZOET-ZWNOBZJWSA-N -1 3 311.328 3.692 20 10 DHCDHM C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593208304 994224650 /nfs/dbraw/zinc/22/46/50/994224650.db2.gz AUOYJNOTSWFCTH-ZDUSSCGKSA-N -1 3 311.381 3.820 20 10 DHCDHM C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593299001 994717930 /nfs/dbraw/zinc/71/79/30/994717930.db2.gz PCFWSBNDDMOWQO-JTQLQIEISA-N -1 3 305.761 3.595 20 10 DHCDHM [O-]c1c(CN2CCn3nc(C4CC4)cc3C2)ccc2ccccc21 ZINC000896937953 1016940768 /nfs/dbraw/zinc/94/07/68/1016940768.db2.gz FRCWJAJKVYZOQN-UHFFFAOYSA-N -1 3 319.408 3.635 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN[C@H]1CCCc2cccnc21 ZINC000897076143 1017039273 /nfs/dbraw/zinc/03/92/73/1017039273.db2.gz SOEOPPFMUXWMAJ-AWEZNQCLSA-N -1 3 306.768 3.747 20 10 DHCDHM [O-]c1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])cc1F ZINC000120494352 1012632425 /nfs/dbraw/zinc/63/24/25/1012632425.db2.gz QWQFBXMKOXUZMK-UHFFFAOYSA-N -1 3 316.159 3.834 20 10 DHCDHM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185707069 1017119745 /nfs/dbraw/zinc/11/97/45/1017119745.db2.gz DYXRIBNKDSXQKW-AWEZNQCLSA-N -1 3 315.369 3.757 20 10 DHCDHM CC[C@@H](NCC(C)(F)F)c1cc(Br)ccc1[O-] ZINC000700111147 1017819277 /nfs/dbraw/zinc/81/92/77/1017819277.db2.gz SVZMPSMRCGNKRJ-SNVBAGLBSA-N -1 3 308.166 3.851 20 10 DHCDHM C[C@@H]1CCCN(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715702572 1018940101 /nfs/dbraw/zinc/94/01/01/1018940101.db2.gz LXEUWVSKSPYVEI-SECBINFHSA-N -1 3 302.187 3.526 20 10 DHCDHM C[C@@H](Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)cc1[O-] ZINC000170788930 1019434843 /nfs/dbraw/zinc/43/48/43/1019434843.db2.gz FOHFKRUYOQCEAD-LLVKDONJSA-N -1 3 314.360 3.597 20 10 DHCDHM CCOc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1CO ZINC000170789596 1019436892 /nfs/dbraw/zinc/43/68/92/1019436892.db2.gz VBGUOWQYPKNZIT-NSHDSACASA-N -1 3 305.349 3.595 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@H]1c2ccccc2OC[C@@H]1F ZINC000922525272 1020113885 /nfs/dbraw/zinc/11/38/85/1020113885.db2.gz KWNNJLLNSDVEDS-BBRMVZONSA-N -1 3 307.752 3.607 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@H]1c2ccccc2OC[C@H]1F ZINC000922525273 1020114436 /nfs/dbraw/zinc/11/44/36/1020114436.db2.gz KWNNJLLNSDVEDS-CJNGLKHVSA-N -1 3 307.752 3.607 20 10 DHCDHM CN(Cc1ccc2ccccc2c1)C(=O)c1cccc(O)c1[O-] ZINC000776316508 1021281874 /nfs/dbraw/zinc/28/18/74/1021281874.db2.gz LAZDLCYBJAZCBI-UHFFFAOYSA-N -1 3 307.349 3.523 20 10 DHCDHM CCCCOc1ccccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000780904261 1021447464 /nfs/dbraw/zinc/44/74/64/1021447464.db2.gz AECPVOPERPTCRQ-UHFFFAOYSA-N -1 3 315.369 3.837 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2C[C@H](C)S[C@@H](C)C2)c1[O-] ZINC000070384285 1021657730 /nfs/dbraw/zinc/65/77/30/1021657730.db2.gz ZXSGLFATMWWIFB-UWVGGRQHSA-N -1 3 313.850 3.574 20 10 DHCDHM [O-]c1cccc(Cl)c1CN(Cc1ccco1)C[C@H]1CCCO1 ZINC000119081029 1021786538 /nfs/dbraw/zinc/78/65/38/1021786538.db2.gz BQVSFDPWXKGYBZ-CQSZACIVSA-N -1 3 321.804 3.820 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc3nc(C4CC4)oc3c2)c([O-])c1O ZINC000179539433 1022464522 /nfs/dbraw/zinc/46/45/22/1022464522.db2.gz OTDDYZPSAMZVMN-UHFFFAOYSA-N -1 3 324.336 3.677 20 10 DHCDHM COc1ccc(CN(C)Cc2c([O-])cccc2Cl)c(OC)c1 ZINC000768168685 1022910889 /nfs/dbraw/zinc/91/08/89/1022910889.db2.gz LOCFSPZNIVABGN-UHFFFAOYSA-N -1 3 321.804 3.695 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](c2ccccc2)C1 ZINC000768238585 1022925256 /nfs/dbraw/zinc/92/52/56/1022925256.db2.gz QSUNLPYOSTVNNN-KRWDZBQOSA-N -1 3 303.789 3.619 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@H]1c1ccccc1 ZINC000769502835 1023168176 /nfs/dbraw/zinc/16/81/76/1023168176.db2.gz AUFCURFBCKFBMT-INIZCTEOSA-N -1 3 303.789 3.619 20 10 DHCDHM CC(C)(C)[C@H]1CN(C(=O)c2cccc(O)c2[O-])c2ccccc21 ZINC000769645467 1023190721 /nfs/dbraw/zinc/19/07/21/1023190721.db2.gz VLFXYHPQYFHFLN-AWEZNQCLSA-N -1 3 311.381 3.888 20 10 DHCDHM COc1cc(Cl)c(C)cc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000770467089 1023315350 /nfs/dbraw/zinc/31/53/50/1023315350.db2.gz UTTNOOVNGKSUAV-UHFFFAOYSA-N -1 3 321.760 3.629 20 10 DHCDHM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(O)c(C)c2)c1C ZINC000771220603 1023412447 /nfs/dbraw/zinc/41/24/47/1023412447.db2.gz YCVZMNZWHFYZJG-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM C[C@H](N[C@H]1CCOc2c(F)cccc21)c1cc(F)cc(F)c1[O-] ZINC000785571005 1023596101 /nfs/dbraw/zinc/59/61/01/1023596101.db2.gz VKQZLFRDWYFUJX-VFZGTOFNSA-N -1 3 323.314 3.984 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CC[C@@H](C(F)(F)F)C2)c1[O-] ZINC000313725753 1023636666 /nfs/dbraw/zinc/63/66/66/1023636666.db2.gz ABDALZOCYLGXIX-SNVBAGLBSA-N -1 3 321.726 3.632 20 10 DHCDHM CC(C)(C)Oc1cccc(CNCc2cc(F)cc(F)c2[O-])n1 ZINC000883079972 1024230984 /nfs/dbraw/zinc/23/09/84/1024230984.db2.gz LWVFDCWKWLHVCR-UHFFFAOYSA-N -1 3 322.355 3.533 20 10 DHCDHM CC(C)c1nc2cc(NC(=O)c3cccc(O)c3[O-])ccc2o1 ZINC000790532703 1024321224 /nfs/dbraw/zinc/32/12/24/1024321224.db2.gz OHQRPVDTDVMATG-UHFFFAOYSA-N -1 3 312.325 3.615 20 10 DHCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)s1 ZINC000790713189 1024362554 /nfs/dbraw/zinc/36/25/54/1024362554.db2.gz PYIBZEJXWGSVBF-SECBINFHSA-N -1 3 311.790 3.694 20 10 DHCDHM COc1ccc(C2(NCc3c([O-])ccc(Cl)c3F)CC2)cc1 ZINC000790961481 1024406379 /nfs/dbraw/zinc/40/63/79/1024406379.db2.gz VXIJIRKWENOORY-UHFFFAOYSA-N -1 3 321.779 3.972 20 10 DHCDHM C[C@H]1[C@H](C(F)(F)F)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000793232250 1024949168 /nfs/dbraw/zinc/94/91/68/1024949168.db2.gz VCQLPZHHYAVSQO-IONNQARKSA-N -1 3 311.706 3.957 20 10 DHCDHM C[C@@H](N[C@H](C)c1c([O-])cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561873 1025706394 /nfs/dbraw/zinc/70/63/94/1025706394.db2.gz LPDUWBCMSJDSTI-GHMZBOCLSA-N -1 3 304.321 3.851 20 10 DHCDHM COc1ccccc1C1(N[C@H](C)c2c([O-])cccc2F)CC1 ZINC000886630007 1025749456 /nfs/dbraw/zinc/74/94/56/1025749456.db2.gz SJUGVGGKIPZYSO-GFCCVEGCSA-N -1 3 301.361 3.880 20 10 DHCDHM Cc1cc(-c2nnc(NCc3c([O-])cccc3Cl)o2)c(C)o1 ZINC000758468848 1026407096 /nfs/dbraw/zinc/40/70/96/1026407096.db2.gz XBBUEHDNZJFYLI-UHFFFAOYSA-N -1 3 319.748 3.918 20 10 DHCDHM CN(C)c1ccccc1CN(C)Cc1cc(Cl)cc(F)c1[O-] ZINC000809787830 1026626125 /nfs/dbraw/zinc/62/61/25/1026626125.db2.gz KGPXVJTWYWUXTC-UHFFFAOYSA-N -1 3 322.811 3.883 20 10 DHCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC3(CCC3)[C@H]2C2CC2)c1[O-] ZINC000811513696 1027029378 /nfs/dbraw/zinc/02/93/78/1027029378.db2.gz MKTCJFHZNUJYSJ-OAHLLOKOSA-N -1 3 322.792 3.718 20 10 DHCDHM CC1(C)CN(Cc2cccc(Br)c2[O-])[C@H]1C1CC1 ZINC000811513917 1027029475 /nfs/dbraw/zinc/02/94/75/1027029475.db2.gz VUOOTQRCEQENNE-AWEZNQCLSA-N -1 3 310.235 3.775 20 10 DHCDHM O=C1N[C@H](c2cc(Cl)ccc2[O-])Nc2cc(Cl)ccc21 ZINC000048447861 1028084900 /nfs/dbraw/zinc/08/49/00/1028084900.db2.gz ZAFPQFGMEOZYNE-CYBMUJFWSA-N -1 3 309.152 3.553 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(C)Cc2ccc(F)cc2F)c1[O-] ZINC000748050420 1028776715 /nfs/dbraw/zinc/77/67/15/1028776715.db2.gz APEUMJYBSWTDDQ-UHFFFAOYSA-N -1 3 323.314 3.644 20 10 DHCDHM Cn1cccc1[C@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816482306 1028894135 /nfs/dbraw/zinc/89/41/35/1028894135.db2.gz BBCBAHBSECCGNF-OAHLLOKOSA-N -1 3 308.784 3.860 20 10 DHCDHM CN(Cc1cc(Cl)cn1C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816520283 1028904653 /nfs/dbraw/zinc/90/46/53/1028904653.db2.gz LFHVTCZSOSIBRZ-UHFFFAOYSA-N -1 3 317.191 3.809 20 10 DHCDHM Cc1nn(C)cc1[C@@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816520545 1028933151 /nfs/dbraw/zinc/93/31/51/1028933151.db2.gz RRIGULSSEFEWLS-HNNXBMFYSA-N -1 3 323.799 3.564 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1nnc(Cc2ccccc2)o1 ZINC000794960048 1030454898 /nfs/dbraw/zinc/45/48/98/1030454898.db2.gz JKHBBCPHVYNEOW-UHFFFAOYSA-N -1 3 315.760 3.632 20 10 DHCDHM CC[C@H](NCc1ncc(Cl)s1)c1ccc(F)cc1[O-] ZINC000872113324 1031505567 /nfs/dbraw/zinc/50/55/67/1031505567.db2.gz OHVVJOFMAMHJQM-JTQLQIEISA-N -1 3 300.786 3.882 20 10 DHCDHM CC1(C)CCc2onc(CNCc3cc(Cl)ccc3[O-])c2C1 ZINC000873175009 1031738925 /nfs/dbraw/zinc/73/89/25/1031738925.db2.gz CZDAJZDXHJXJAN-UHFFFAOYSA-N -1 3 320.820 3.838 20 10 DHCDHM C[C@@]12CCN(Cc3cc(Cl)c(F)cc3[O-])C[C@@H]1C2(F)F ZINC000294085477 1031790062 /nfs/dbraw/zinc/79/00/62/1031790062.db2.gz ZDYDFRMQIDTAQY-QWHCGFSZSA-N -1 3 305.727 3.662 20 10 DHCDHM C[C@@H](c1ccncc1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000183712377 1034414659 /nfs/dbraw/zinc/41/46/59/1034414659.db2.gz VWIGKWBHFZZDGE-JTQLQIEISA-N -1 3 321.764 3.542 20 10 DHCDHM Cc1ncoc1-c1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC001178329795 1035422523 /nfs/dbraw/zinc/42/25/23/1035422523.db2.gz CACOOUQAKKCOOZ-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CNCc1noc2cc(F)ccc21 ZINC001179429936 1035477217 /nfs/dbraw/zinc/47/72/17/1035477217.db2.gz MKLNFFAFPGCVPG-UHFFFAOYSA-N -1 3 324.714 3.755 20 10 DHCDHM Cc1cc([O-])c(CN2CCC=C(Br)C2)c(Cl)c1 ZINC001181206581 1035857020 /nfs/dbraw/zinc/85/70/20/1035857020.db2.gz WCOFXRUNNFGVKL-UHFFFAOYSA-N -1 3 316.626 3.839 20 10 DHCDHM CC(C)[C@H](C)C(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001181502215 1035927151 /nfs/dbraw/zinc/92/71/51/1035927151.db2.gz QGSVGUOKBACLPH-JTQLQIEISA-N -1 3 306.793 3.502 20 10 DHCDHM CN1C(=O)CCc2cc(NCc3c([O-])cccc3Cl)ccc21 ZINC000130331033 1036123514 /nfs/dbraw/zinc/12/35/14/1036123514.db2.gz STRLQONOOLWCKE-UHFFFAOYSA-N -1 3 316.788 3.567 20 10 DHCDHM CC(C)COC1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775660028 1036268113 /nfs/dbraw/zinc/26/81/13/1036268113.db2.gz SJEDWEHTIPALDK-UHFFFAOYSA-N -1 3 315.816 3.822 20 10 DHCDHM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(O)cc2C)c1C ZINC000151872860 1036693184 /nfs/dbraw/zinc/69/31/84/1036693184.db2.gz CRBRATBPQWVCFU-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)N[C@@H](c1cccs1)C1CC1 ZINC000913973450 1036953281 /nfs/dbraw/zinc/95/32/81/1036953281.db2.gz HFMQWELIYZMNED-OAHLLOKOSA-N -1 3 320.389 3.543 20 10 DHCDHM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(O)c(F)c2)cc1 ZINC001191249595 1038465837 /nfs/dbraw/zinc/46/58/37/1038465837.db2.gz WQDYVBCWFDRPAC-UHFFFAOYSA-N -1 3 323.389 3.675 20 10 DHCDHM CO[C@@H]1Cc2ccc(N[C@@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000760879072 1038968018 /nfs/dbraw/zinc/96/80/18/1038968018.db2.gz CZFMJPVLLXZHBW-MEDUHNTESA-N -1 3 301.361 3.818 20 10 DHCDHM CC(=O)c1cc(F)cc(CNC(C)(C)c2nc(C)cs2)c1[O-] ZINC000079437234 185171391 /nfs/dbraw/zinc/17/13/91/185171391.db2.gz RWLNJLKJVMJKHB-UHFFFAOYSA-N -1 3 322.405 3.524 20 10 DHCDHM CC[C@@H](c1ccncc1)N(C)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000092223780 193176210 /nfs/dbraw/zinc/17/62/10/193176210.db2.gz PYFDGRWIGYGCLD-KRWDZBQOSA-N -1 3 316.376 3.712 20 10 DHCDHM COc1ccccc1[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273372659 130113100 /nfs/dbraw/zinc/11/31/00/130113100.db2.gz GNBVSBBWYNMRCS-RYUDHWBXSA-N -1 3 316.357 3.721 20 10 DHCDHM COc1cc(OC)c(N[C@H](C)c2ccc(F)cc2[O-])cc1F ZINC000273429662 130120257 /nfs/dbraw/zinc/12/02/57/130120257.db2.gz KVOPZVJRSDUDPP-SECBINFHSA-N -1 3 309.312 3.861 20 10 DHCDHM C[C@H](N[C@@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273569534 130139405 /nfs/dbraw/zinc/13/94/05/130139405.db2.gz KISFPESYZRGHTF-MGPLVRAMSA-N -1 3 316.332 3.778 20 10 DHCDHM COc1ccc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273576934 130140543 /nfs/dbraw/zinc/14/05/43/130140543.db2.gz MAPJWCDHAFPRLH-VXGBXAGGSA-N -1 3 316.357 3.721 20 10 DHCDHM COc1cc(Cl)cc(CN2CCCC[C@@H]2c2cc[nH]n2)c1[O-] ZINC000289331202 131375382 /nfs/dbraw/zinc/37/53/82/131375382.db2.gz GVSCGIWYUPWFQR-CQSZACIVSA-N -1 3 321.808 3.505 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@H]2CCc3cccc([O-])c32)o1 ZINC000297861673 132037742 /nfs/dbraw/zinc/03/77/42/132037742.db2.gz UEHBYKVZNVMTDU-GJZGRUSLSA-N -1 3 301.386 3.512 20 10 DHCDHM CC[C@@H](NCc1cnc2n1CCCC2)c1cccc(Cl)c1[O-] ZINC000367573845 336825641 /nfs/dbraw/zinc/82/56/41/336825641.db2.gz GDWUQDYILRQEID-OAHLLOKOSA-N -1 3 319.836 3.819 20 10 DHCDHM C[C@H](N[C@H]1c2ccc(F)cc2O[C@H]1C)c1ccc(F)c(F)c1[O-] ZINC000367578630 336825749 /nfs/dbraw/zinc/82/57/49/336825749.db2.gz WKDJOMKMQVGOHL-OMQMVUIESA-N -1 3 323.314 3.982 20 10 DHCDHM CC[C@H](N[C@@H]1COc2cc(F)cc(F)c21)c1ccccc1[O-] ZINC000372336763 336928538 /nfs/dbraw/zinc/92/85/38/336928538.db2.gz JNXBPSBBSNEQSF-UONOGXRCSA-N -1 3 305.324 3.845 20 10 DHCDHM Cc1ccc([C@H](C)N[C@H]2CCCn3nc(C(C)C)nc32)c([O-])c1 ZINC000185684565 337250118 /nfs/dbraw/zinc/25/01/18/337250118.db2.gz JMLZGGXNUALAHV-ZFWWWQNUSA-N -1 3 314.433 3.601 20 10 DHCDHM CC(C)Oc1ccc(CN[C@H](C)c2ccc(F)c(F)c2[O-])cn1 ZINC000191206376 519779980 /nfs/dbraw/zinc/77/99/80/519779980.db2.gz DTGZXXJLQFDKMZ-LLVKDONJSA-N -1 3 322.355 3.703 20 10 DHCDHM C[C@@H](N[C@H]1CCOc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000191185809 525688350 /nfs/dbraw/zinc/68/83/50/525688350.db2.gz IUJYNFUFRIEVDD-YGRLFVJLSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](Nc1ccc(OC2COC2)cc1)c1cc(Cl)ccc1[O-] ZINC000188644039 525710419 /nfs/dbraw/zinc/71/04/19/525710419.db2.gz DRQLEDDKBRWQKE-LLVKDONJSA-N -1 3 319.788 3.996 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000365664656 526347633 /nfs/dbraw/zinc/34/76/33/526347633.db2.gz WJJFBCCQXBZUJX-CVEARBPZSA-N -1 3 307.821 3.579 20 10 DHCDHM O=[N+]([O-])c1cc(Cl)cc(CN[C@H]2CCCc3occc32)c1[O-] ZINC000237961355 527333396 /nfs/dbraw/zinc/33/33/96/527333396.db2.gz MVLRSPWSAMEDKR-LBPRGKRZSA-N -1 3 322.748 3.714 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCC(C(F)F)CC2)c1[O-] ZINC000307882324 1014341536 /nfs/dbraw/zinc/34/15/36/1014341536.db2.gz UCCQMXNINGSAQP-UHFFFAOYSA-N -1 3 317.763 3.725 20 10 DHCDHM C[C@H](Cc1ccccc1F)[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592896671 979797993 /nfs/dbraw/zinc/79/79/93/979797993.db2.gz RFDKXYYXGGAOMD-VXGBXAGGSA-N -1 3 317.360 3.511 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)c2ccncc2)c1[O-] ZINC000091989031 1014800254 /nfs/dbraw/zinc/80/02/54/1014800254.db2.gz JTKGLRLDNOQQJQ-NSHDSACASA-N -1 3 318.804 3.836 20 10 DHCDHM CCCCN(Cc1ccccc1O)[C@H](C(=O)[O-])c1ccsc1 ZINC001595747848 982415533 /nfs/dbraw/zinc/41/55/33/982415533.db2.gz KLPZBMNVMPUZHY-INIZCTEOSA-N -1 3 319.426 3.882 20 10 DHCDHM C[C@@H]([NH2+][C@@H](CCC(=O)[O-])c1ccccc1)c1cc(F)ccc1[O-] ZINC001593202985 994183366 /nfs/dbraw/zinc/18/33/66/994183366.db2.gz BKOWVHBLTQBGGG-WBMJQRKESA-N -1 3 317.360 3.788 20 10 DHCDHM Cc1cc([C@H](C)NC(=O)c2cccc(O)c2[O-])ccc1Cl ZINC001148224549 1032374677 /nfs/dbraw/zinc/37/46/77/1032374677.db2.gz PCMAZDCEZMMZMF-JTQLQIEISA-N -1 3 305.761 3.551 20 10 DHCDHM Cc1cc(Cl)nc(CN[C@H](C)c2ccc(F)c(F)c2[O-])c1 ZINC000282750255 1032481139 /nfs/dbraw/zinc/48/11/39/1032481139.db2.gz NSAFBVJFCLCBKY-SECBINFHSA-N -1 3 312.747 3.878 20 10 DHCDHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1 ZINC000185857215 1017461205 /nfs/dbraw/zinc/46/12/05/1017461205.db2.gz BIXRWRIZXMUULU-INIZCTEOSA-N -1 3 311.381 3.692 20 10 DHCDHM COc1cc(OC)c(OC)cc1N[C@@H](C)c1ccc(F)cc1[O-] ZINC000186476741 1018830955 /nfs/dbraw/zinc/83/09/55/1018830955.db2.gz NMPMBGDHAVFZLL-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000282565651 1020459560 /nfs/dbraw/zinc/45/95/60/1020459560.db2.gz UQSWEYQIZUIZIJ-MUJYYYPQSA-N -1 3 323.392 3.649 20 10 DHCDHM Cc1cc(Cl)nc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000282494323 1020616559 /nfs/dbraw/zinc/61/65/59/1020616559.db2.gz HWBLMFGTLXVFLZ-JTQLQIEISA-N -1 3 321.764 3.508 20 10 DHCDHM CSc1ccc(NC(=O)c2cccc(O)c2[O-])cc1Cl ZINC000776348096 1021302323 /nfs/dbraw/zinc/30/23/23/1021302323.db2.gz HPEIDLQFVOBHGT-UHFFFAOYSA-N -1 3 309.774 3.725 20 10 DHCDHM COc1cccc(OC)c1CNCc1c([O-])cc(C)cc1Cl ZINC000850355018 1021483573 /nfs/dbraw/zinc/48/35/73/1021483573.db2.gz BBEFJVAWRBBJOO-UHFFFAOYSA-N -1 3 321.804 3.661 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc(COC(C)C)cc2)c([O-])c1O ZINC000182225644 1021558303 /nfs/dbraw/zinc/55/83/03/1021558303.db2.gz JWEFVFVBRWRZIJ-UHFFFAOYSA-N -1 3 315.369 3.584 20 10 DHCDHM Cc1ccc(C(=O)N(CC2CCC2)c2ccccc2)c([O-])c1O ZINC000182579201 1021720796 /nfs/dbraw/zinc/72/07/96/1021720796.db2.gz DPOFGZGMOXKBJR-UHFFFAOYSA-N -1 3 311.381 3.853 20 10 DHCDHM O=C(Nc1ccc2c3c(cccc31)CC2)c1cccc(O)c1[O-] ZINC000776635998 1022195622 /nfs/dbraw/zinc/19/56/22/1022195622.db2.gz OANZDRQQSNDAJK-UHFFFAOYSA-N -1 3 305.333 3.602 20 10 DHCDHM CN(Cc1cccc(Br)c1[O-])Cc1ccccc1F ZINC000768174627 1022913775 /nfs/dbraw/zinc/91/37/75/1022913775.db2.gz YVFKNSNBHJXHGB-UHFFFAOYSA-N -1 3 324.193 3.926 20 10 DHCDHM CCc1nc([C@H]2CCCCN2Cc2c([O-])cccc2Cl)no1 ZINC000768967318 1023062112 /nfs/dbraw/zinc/06/21/12/1023062112.db2.gz OXDPAVBDNKANEP-CYBMUJFWSA-N -1 3 321.808 3.718 20 10 DHCDHM Cc1noc([C@@H]2CCCCN2Cc2cc(Cl)c(C)cc2[O-])n1 ZINC000825892730 1033122983 /nfs/dbraw/zinc/12/29/83/1033122983.db2.gz IBODFRFFYTZZIN-AWEZNQCLSA-N -1 3 321.808 3.773 20 10 DHCDHM CC(C)CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000770330302 1023298448 /nfs/dbraw/zinc/29/84/48/1023298448.db2.gz XDTSPCISYZSAPS-ZDUSSCGKSA-N -1 3 318.244 3.946 20 10 DHCDHM CCCCOc1ncccc1CNCc1cc(F)cc(F)c1[O-] ZINC000882922841 1024176131 /nfs/dbraw/zinc/17/61/31/1024176131.db2.gz PNZZFOYTTZOLSH-UHFFFAOYSA-N -1 3 322.355 3.534 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNC1(c2ccccc2F)CCC1 ZINC000883151897 1024260373 /nfs/dbraw/zinc/26/03/73/1024260373.db2.gz BPKBYKAJSHDWDY-UHFFFAOYSA-N -1 3 307.315 3.979 20 10 DHCDHM COc1ccc(C2CC2)cc1CNCc1cc(F)cc(F)c1[O-] ZINC000883257145 1024324659 /nfs/dbraw/zinc/32/46/59/1024324659.db2.gz SSASEQQBSSQBHH-UHFFFAOYSA-N -1 3 319.351 3.846 20 10 DHCDHM Cc1ccc2[nH]c(CNCc3c([O-])ccc(Cl)c3F)nc2c1 ZINC000790970391 1024409166 /nfs/dbraw/zinc/40/91/66/1024409166.db2.gz HNJOONRTYHKSHH-UHFFFAOYSA-N -1 3 319.767 3.659 20 10 DHCDHM Cc1ccc2nc(CNCc3c([O-])ccc(Cl)c3F)[nH]c2c1 ZINC000790970391 1024409176 /nfs/dbraw/zinc/40/91/76/1024409176.db2.gz HNJOONRTYHKSHH-UHFFFAOYSA-N -1 3 319.767 3.659 20 10 DHCDHM CC[C@@](C)(NCc1ccc(F)c(F)c1[O-])c1nc(C)cs1 ZINC000877045168 1033216640 /nfs/dbraw/zinc/21/66/40/1033216640.db2.gz QYPGRXYMBPILGV-OAHLLOKOSA-N -1 3 312.385 3.850 20 10 DHCDHM CN(Cc1ccc2c(c1)OCO2)Cc1c([O-])ccc(Cl)c1F ZINC000792156436 1024637285 /nfs/dbraw/zinc/63/72/85/1024637285.db2.gz FHSXWNSVSHOSIO-UHFFFAOYSA-N -1 3 323.751 3.545 20 10 DHCDHM CC(C)(C)OC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792167327 1024641091 /nfs/dbraw/zinc/64/10/91/1024641091.db2.gz NGAYYYAJEJBAGF-UHFFFAOYSA-N -1 3 315.816 3.964 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CNCc1cccnc1F ZINC000793281484 1024982171 /nfs/dbraw/zinc/98/21/71/1024982171.db2.gz QKTNHEGDISIAJY-UHFFFAOYSA-N -1 3 301.148 3.523 20 10 DHCDHM CN1C(=O)c2ccc(Cl)cc2N[C@H]1c1cc(Cl)ccc1[O-] ZINC000054430395 1025115041 /nfs/dbraw/zinc/11/50/41/1025115041.db2.gz KWLXFNUVOLUYTL-CQSZACIVSA-N -1 3 323.179 3.895 20 10 DHCDHM COc1ccc(OC)c([C@@H](C)N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886491363 1025649432 /nfs/dbraw/zinc/64/94/32/1025649432.db2.gz ASLQXJUNNAGDOS-NEPJUHHUSA-N -1 3 319.376 3.960 20 10 DHCDHM COc1cccc2c1OCC[C@@H]2N[C@@H](C)c1c([O-])cccc1F ZINC000886547971 1025693226 /nfs/dbraw/zinc/69/32/26/1025693226.db2.gz VLIZJOFZUKLGRF-FZMZJTMJSA-N -1 3 317.360 3.714 20 10 DHCDHM COc1cc(F)c(N[C@H](C)c2c([O-])cccc2F)cc1OC ZINC000886579278 1025715625 /nfs/dbraw/zinc/71/56/25/1025715625.db2.gz HRCKOZOFCMTTIJ-SECBINFHSA-N -1 3 309.312 3.861 20 10 DHCDHM COCC[C@H](N[C@@H](C)c1c([O-])cccc1F)c1ccc(C)o1 ZINC000886586069 1025724499 /nfs/dbraw/zinc/72/44/99/1025724499.db2.gz KKAOEMKZIXVPEL-JSGCOSHPSA-N -1 3 307.365 3.861 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CNCc1ccc(F)cn1 ZINC000763520381 1025987407 /nfs/dbraw/zinc/98/74/07/1025987407.db2.gz DMHMJTWMDVWWTL-UHFFFAOYSA-N -1 3 301.148 3.523 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@H]1NCc1c([O-])ccc(Cl)c1F ZINC000808443083 1026285722 /nfs/dbraw/zinc/28/57/22/1026285722.db2.gz AILQHXKTNPQAKY-ABKXIKBNSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@H]1NCc1c([O-])ccc(Cl)c1F ZINC000808443084 1026286002 /nfs/dbraw/zinc/28/60/02/1026286002.db2.gz AILQHXKTNPQAKY-FVMDXXJSSA-N -1 3 307.752 3.797 20 10 DHCDHM CC[C@@H](NCc1cocn1)c1ccc(C(F)(F)F)cc1[O-] ZINC000810232027 1026715069 /nfs/dbraw/zinc/71/50/69/1026715069.db2.gz USOIZPGWPHTDMB-GFCCVEGCSA-N -1 3 300.280 3.640 20 10 DHCDHM C[C@@H]1CN(Cc2cccc(Br)c2[O-])CCC1(F)F ZINC000811512716 1027029006 /nfs/dbraw/zinc/02/90/06/1027029006.db2.gz QJUQAFKTNYZRMF-SECBINFHSA-N -1 3 320.177 3.632 20 10 DHCDHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126396386 1027549061 /nfs/dbraw/zinc/54/90/61/1027549061.db2.gz CNOAMQDAQBYLDH-JTQLQIEISA-N -1 3 305.761 3.584 20 10 DHCDHM Cc1ccoc1CN(C)Cc1cccc(Br)c1[O-] ZINC000814174551 1027910266 /nfs/dbraw/zinc/91/02/66/1027910266.db2.gz GADWNVVZVYDPPT-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM [O-]c1c(Br)cccc1CNc1cc2c(cn1)CCC2 ZINC000815159169 1028385220 /nfs/dbraw/zinc/38/52/20/1028385220.db2.gz KONIICINDOMJKF-UHFFFAOYSA-N -1 3 319.202 3.651 20 10 DHCDHM COc1ccccc1CN(C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816481093 1028890358 /nfs/dbraw/zinc/89/03/58/1028890358.db2.gz INONLLXSSNXIDF-UHFFFAOYSA-N -1 3 309.768 3.825 20 10 DHCDHM COc1ccc(CNCc2cc(Cl)c(F)cc2[O-])c(F)c1 ZINC000816556934 1028941660 /nfs/dbraw/zinc/94/16/60/1028941660.db2.gz YSBOIMYHHCRIHU-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@@H]1NCc1cc(Cl)c(F)cc1[O-] ZINC000816613222 1028963145 /nfs/dbraw/zinc/96/31/45/1028963145.db2.gz MTHKBPYTXOUSDN-JDNHERCYSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@H]1NCc1cc(Cl)c(F)cc1[O-] ZINC000816613221 1028964261 /nfs/dbraw/zinc/96/42/61/1028964261.db2.gz MTHKBPYTXOUSDN-FVMDXXJSSA-N -1 3 307.752 3.797 20 10 DHCDHM Cc1cc([O-])c(CN2CCOC[C@@H]2c2ccco2)cc1Cl ZINC000824802194 1030644029 /nfs/dbraw/zinc/64/40/29/1030644029.db2.gz IHCKJYAWBYFDEA-CQSZACIVSA-N -1 3 307.777 3.521 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@H](c3ccsc3)C2)cc1Cl ZINC000824894826 1030661695 /nfs/dbraw/zinc/66/16/95/1030661695.db2.gz LFGXGJKCUKXOCM-INIZCTEOSA-N -1 3 323.845 3.989 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@H](c3ccco3)C2)cc1Cl ZINC000824905757 1030665185 /nfs/dbraw/zinc/66/51/85/1030665185.db2.gz BYTYWMXJUWOXNO-INIZCTEOSA-N -1 3 307.777 3.521 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(Cc2cccs2)C2CC2)c1[O-] ZINC000122712257 1030829507 /nfs/dbraw/zinc/82/95/07/1030829507.db2.gz SDTRPAHIJFSMMT-UHFFFAOYSA-N -1 3 319.401 3.960 20 10 DHCDHM Cc1nccnc1[C@@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000873187978 1031748552 /nfs/dbraw/zinc/74/85/52/1031748552.db2.gz DUVMPHQHHKSNSU-SECBINFHSA-N -1 3 312.200 3.648 20 10 DHCDHM [O-]c1ccc(Cl)cc1CNCc1ncc(C(F)(F)F)s1 ZINC000846056330 1031816538 /nfs/dbraw/zinc/81/65/38/1031816538.db2.gz VCIIXMICTAFLNO-UHFFFAOYSA-N -1 3 322.739 3.811 20 10 DHCDHM C[C@H](c1ccccn1)N(C)Cc1c([O-])cccc1Br ZINC000862301716 1033815239 /nfs/dbraw/zinc/81/52/39/1033815239.db2.gz IGQHRZLIJVKREM-LLVKDONJSA-N -1 3 321.218 3.743 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@H](c1nccs1)C(F)(F)F ZINC000862431075 1033849991 /nfs/dbraw/zinc/84/99/91/1033849991.db2.gz DGFFQRHVLLFVRX-SNVBAGLBSA-N -1 3 322.739 3.895 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CC(Cc2cccs2)C1 ZINC000862537621 1033880578 /nfs/dbraw/zinc/88/05/78/1033880578.db2.gz DCEZGGQVAXVFKQ-UHFFFAOYSA-N -1 3 311.809 3.921 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN[C@H](C)c2ncc(C)s2)c1[O-] ZINC000185001454 1034518579 /nfs/dbraw/zinc/51/85/79/1034518579.db2.gz UCVSFRVAVALFPI-SECBINFHSA-N -1 3 324.833 3.864 20 10 DHCDHM Cc1ccc(SCC(=O)NCc2c([O-])cccc2F)c(C)c1 ZINC001178410600 1035428149 /nfs/dbraw/zinc/42/81/49/1035428149.db2.gz VJFVLYLTCNDWQF-UHFFFAOYSA-N -1 3 319.401 3.557 20 10 DHCDHM CC(C)Sc1ccccc1C(=O)NCc1c([O-])cccc1F ZINC001178413211 1035429105 /nfs/dbraw/zinc/42/91/05/1035429105.db2.gz OPWGRWQAGDTZOE-UHFFFAOYSA-N -1 3 319.401 3.962 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@@H]1C[C@]1(F)c1ccccc1 ZINC001178998072 1035460804 /nfs/dbraw/zinc/46/08/04/1035460804.db2.gz BGGOKCCTRZFDBG-ZBFHGGJFSA-N -1 3 309.743 3.912 20 10 DHCDHM CCC1(C(=O)NCc2cc(Cl)c3cccnc3c2[O-])CCC1 ZINC001179027200 1035462127 /nfs/dbraw/zinc/46/21/27/1035462127.db2.gz WAZGPICDKWFZFW-UHFFFAOYSA-N -1 3 318.804 3.790 20 10 DHCDHM COC(=O)Nc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000148914397 1035483607 /nfs/dbraw/zinc/48/36/07/1035483607.db2.gz CITMZYGQTKMZIV-UHFFFAOYSA-N -1 3 306.749 3.836 20 10 DHCDHM [O-]c1cc(Cl)ccc1CN1CCO[C@H](c2ccccc2F)C1 ZINC001180048907 1035565089 /nfs/dbraw/zinc/56/50/89/1035565089.db2.gz YSLJDVVBTRWPKD-KRWDZBQOSA-N -1 3 321.779 3.758 20 10 DHCDHM O=C1CCC[C@H]2CN(Cc3cc(Cl)cc(Cl)c3[O-])C[C@@H]12 ZINC001203586473 1036826851 /nfs/dbraw/zinc/82/68/51/1036826851.db2.gz OHODLPHRDQWCGA-JOYOIKCWSA-N -1 3 314.212 3.500 20 10 DHCDHM Cc1c(C)c([N-]S(=O)(=O)c2ccc3occc3c2)ccc1O ZINC001198858715 1037147642 /nfs/dbraw/zinc/14/76/42/1037147642.db2.gz GRXBEIKUAFLWMP-UHFFFAOYSA-N -1 3 317.366 3.556 20 10 DHCDHM COc1c([O-])c(CNc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000774934364 1037242599 /nfs/dbraw/zinc/24/25/99/1037242599.db2.gz IBEIOBNUQRIHKR-UHFFFAOYSA-N -1 3 308.721 3.575 20 10 DHCDHM COc1c([O-])c(CN(C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000775057691 1037515063 /nfs/dbraw/zinc/51/50/63/1037515063.db2.gz PPCQGALPFWMBIM-UHFFFAOYSA-N -1 3 316.357 3.562 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CNCc1ccc2c(n1)CCCC2 ZINC000775180595 1037935068 /nfs/dbraw/zinc/93/50/68/1037935068.db2.gz GQYLTGNGUCIPCX-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(O)c(C)c2)cc1 ZINC001191249342 1038477279 /nfs/dbraw/zinc/47/72/79/1038477279.db2.gz QWPPPMGZTZNECB-UHFFFAOYSA-N -1 3 319.426 3.844 20 10 DHCDHM [O-]c1c(F)cc(Br)cc1Nc1ccncc1Cl ZINC001212160374 1038522241 /nfs/dbraw/zinc/52/22/41/1038522241.db2.gz QBAHKKSTEWQDFF-UHFFFAOYSA-N -1 3 317.545 3.508 20 10 DHCDHM CC[C@@H](NCc1ccn(C)n1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775527013 1038644607 /nfs/dbraw/zinc/64/46/07/1038644607.db2.gz VKWJAAXDYBLETJ-GFCCVEGCSA-N -1 3 314.216 3.673 20 10 DHCDHM Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])ccc1F ZINC000273363788 130111591 /nfs/dbraw/zinc/11/15/91/130111591.db2.gz DPRJSMFGMHPDHL-LLVKDONJSA-N -1 3 304.321 3.599 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1cn[nH]c1 ZINC000273484367 130126259 /nfs/dbraw/zinc/12/62/59/130126259.db2.gz MYOHAJDUFMCQNI-YUMQZZPRSA-N -1 3 300.189 3.834 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cnn(C)c1)c1ccc(Cl)c(Cl)c1[O-] ZINC000273607928 130143807 /nfs/dbraw/zinc/14/38/07/130143807.db2.gz UVFGLCUYEISKRH-DTWKUNHWSA-N -1 3 314.216 3.844 20 10 DHCDHM CCCOc1ccc(CN[C@@H](C)c2c(F)cncc2F)c([O-])c1 ZINC000285571703 131182115 /nfs/dbraw/zinc/18/21/15/131182115.db2.gz UHIOOLBSMYHNOF-NSHDSACASA-N -1 3 322.355 3.705 20 10 DHCDHM CC[C@@H](N[C@H](CO)c1ccccc1)c1cccc(Cl)c1[O-] ZINC000287292274 131273374 /nfs/dbraw/zinc/27/33/74/131273374.db2.gz BZBAULLJKAZUFW-HZPDHXFCSA-N -1 3 305.805 3.820 20 10 DHCDHM [O-]c1ccc(Br)cc1CN[C@@H](C1CC1)C(F)(F)F ZINC000288474959 131327457 /nfs/dbraw/zinc/32/74/57/131327457.db2.gz PGXLWYCNPPNKGI-NSHDSACASA-N -1 3 324.140 3.585 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@@H]2CCc3cccc([O-])c32)o1 ZINC000297861669 132037417 /nfs/dbraw/zinc/03/74/17/132037417.db2.gz UEHBYKVZNVMTDU-CABCVRRESA-N -1 3 301.386 3.512 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC(C(F)(F)F)CC2)c1[O-] ZINC000132258086 332124703 /nfs/dbraw/zinc/12/47/03/332124703.db2.gz MJIFVVOJMPWLAA-UHFFFAOYSA-N -1 3 319.298 3.508 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2[O-])on1 ZINC000185357585 333207609 /nfs/dbraw/zinc/20/76/09/333207609.db2.gz KNOXCKLBBVTYNV-QMMMGPOBSA-N -1 3 301.173 3.846 20 10 DHCDHM CC1(C)C[C@@H](O)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000295243064 335134394 /nfs/dbraw/zinc/13/43/94/335134394.db2.gz PKBZZRDSQAVCNF-LBPRGKRZSA-N -1 3 318.244 3.682 20 10 DHCDHM Cc1ccc(-c2ncco2)cc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000370366721 336883385 /nfs/dbraw/zinc/88/33/85/336883385.db2.gz QXJJTUHLGRGIIQ-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(F)(c2cccnc2)CC1 ZINC000375303399 337007552 /nfs/dbraw/zinc/00/75/52/337007552.db2.gz OGAFORQSWACWRX-UHFFFAOYSA-N -1 3 320.795 3.901 20 10 DHCDHM C[C@H](N[C@@H]1CCOc2c(F)cccc21)c1ccc(F)cc1[O-] ZINC000375345063 337008502 /nfs/dbraw/zinc/00/85/02/337008502.db2.gz KTJUROZQUQEYSY-ZUZCIYMTSA-N -1 3 305.324 3.845 20 10 DHCDHM Cc1ccc([C@H](C)N[C@H](C)c2cn(-c3ccccc3)nn2)c([O-])c1 ZINC000186113233 337253822 /nfs/dbraw/zinc/25/38/22/337253822.db2.gz RLKSYVCSXOULTB-LSDHHAIUSA-N -1 3 322.412 3.693 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)CCCC(=O)N2)c1cc(F)ccc1[O-] ZINC000186445564 337256193 /nfs/dbraw/zinc/25/61/93/337256193.db2.gz DAJXNBVMINJIKS-NSHDSACASA-N -1 3 314.360 3.979 20 10 DHCDHM CC[C@@H](N[C@@H](c1nc(C)no1)c1ccccc1)c1ccccc1[O-] ZINC000364957100 522921048 /nfs/dbraw/zinc/92/10/48/522921048.db2.gz XRYWSAMBQOBQDH-SJLPKXTDSA-N -1 3 323.396 3.914 20 10 DHCDHM COc1ccc(CN[C@@H](C)c2cc(Cl)ccc2[O-])cc1O ZINC000185300607 524074222 /nfs/dbraw/zinc/07/42/22/524074222.db2.gz FELNEEDGVAQBCP-JTQLQIEISA-N -1 3 307.777 3.611 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cccc([N+](=O)[O-])c1 ZINC000191222931 525531058 /nfs/dbraw/zinc/53/10/58/525531058.db2.gz XJMXOLHIZZPPDV-UWVGGRQHSA-N -1 3 322.311 3.990 20 10 DHCDHM C[C@H](N[C@@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)c(F)c1[O-] ZINC000364809009 525592724 /nfs/dbraw/zinc/59/27/24/525592724.db2.gz MQBUGTSENQIMEW-UTEYVOQOSA-N -1 3 323.314 3.982 20 10 DHCDHM C[C@@H](N[C@H]1CCOc2c(F)cccc21)c1ccc(F)cc1[O-] ZINC000188060678 525688252 /nfs/dbraw/zinc/68/82/52/525688252.db2.gz KTJUROZQUQEYSY-BMIGLBTASA-N -1 3 305.324 3.845 20 10 DHCDHM CCOc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273391993 535462557 /nfs/dbraw/zinc/46/25/57/535462557.db2.gz LAUQJPTYRFZEPU-LBPRGKRZSA-N -1 3 316.357 3.550 20 10 DHCDHM CC[C@@H](Nc1cc(CCOC)ccn1)c1ccc(F)cc1[O-] ZINC000287357664 535809514 /nfs/dbraw/zinc/80/95/14/535809514.db2.gz HBUVSWPBIIFILI-OAHLLOKOSA-N -1 3 304.365 3.678 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H]1c1ccncc1 ZINC000293912893 1013115717 /nfs/dbraw/zinc/11/57/17/1013115717.db2.gz LWPGCYLVHZNYOV-OAHLLOKOSA-N -1 3 306.768 3.917 20 10 DHCDHM COc1cc(C)c(NCc2c([O-])cccc2Cl)cc1OC ZINC000083607925 1013987519 /nfs/dbraw/zinc/98/75/19/1013987519.db2.gz WWJVCYIITSELJW-UHFFFAOYSA-N -1 3 307.777 3.983 20 10 DHCDHM C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592478094 978249003 /nfs/dbraw/zinc/24/90/03/978249003.db2.gz QPVWKHMWCFYUJY-UWVGGRQHSA-N -1 3 319.323 3.862 20 10 DHCDHM C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)c1cc(C(=O)[O-])ccc1[O-] ZINC001592704924 979165551 /nfs/dbraw/zinc/16/55/51/979165551.db2.gz AEMJBXQQZUENJD-VXGBXAGGSA-N -1 3 317.360 3.684 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1c(F)cccc1N1CCCC1 ZINC000896641341 1015695295 /nfs/dbraw/zinc/69/52/95/1015695295.db2.gz QPBDEAPPVKZPSZ-UHFFFAOYSA-N -1 3 318.367 3.560 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593219449 994299899 /nfs/dbraw/zinc/29/98/99/994299899.db2.gz OEYVWSNVJKZYFX-YVEFUNNKSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593231810 994379338 /nfs/dbraw/zinc/37/93/38/994379338.db2.gz LIENKBHWRMOMDJ-QLJPJBMISA-N -1 3 315.344 3.568 20 10 DHCDHM CC[C@H]1CO[C@@](C)(CCC(C)C)N1C(=O)c1cccc(O)c1[O-] ZINC001148218576 1032375166 /nfs/dbraw/zinc/37/51/66/1032375166.db2.gz GDBBULIZTGKCRO-UGSOOPFHSA-N -1 3 321.417 3.501 20 10 DHCDHM O=C(NC1(c2cccc3ccccc32)CC1)c1cccc(O)c1[O-] ZINC001148224153 1032375294 /nfs/dbraw/zinc/37/52/94/1032375294.db2.gz DUUXTXFNEPRSFS-UHFFFAOYSA-N -1 3 319.360 3.670 20 10 DHCDHM C[C@H](NCc1ccn(C2CCCC2)n1)c1ccc(F)cc1[O-] ZINC000186138128 1017907043 /nfs/dbraw/zinc/90/70/43/1017907043.db2.gz BYNJFFAKPOEOKP-LBPRGKRZSA-N -1 3 303.381 3.694 20 10 DHCDHM [O-]c1cccc(F)c1CN1CCSC[C@@H]1c1ccccc1 ZINC001137837414 1018650151 /nfs/dbraw/zinc/65/01/51/1018650151.db2.gz FZWVIXYAKHFKTC-MRXNPFEDSA-N -1 3 303.402 3.821 20 10 DHCDHM CCN(C(=O)c1ccc(C)c(O)c1[O-])c1cccc(Cl)c1 ZINC000780885274 1018760887 /nfs/dbraw/zinc/76/08/87/1018760887.db2.gz KBPUMMMLZQHAKD-UHFFFAOYSA-N -1 3 305.761 3.726 20 10 DHCDHM Cc1ccc([C@H]2CCCCN2C(=O)c2cccc(O)c2[O-])cc1 ZINC000187168901 1019214264 /nfs/dbraw/zinc/21/42/64/1019214264.db2.gz IRZPUJGBDBCCST-MRXNPFEDSA-N -1 3 311.381 3.774 20 10 DHCDHM CCCNC(=O)c1cccc(N[C@@H](C)c2ccc(F)cc2[O-])c1 ZINC000170789093 1019435743 /nfs/dbraw/zinc/43/57/43/1019435743.db2.gz VUAVQPYMXPHPHO-LBPRGKRZSA-N -1 3 316.376 3.844 20 10 DHCDHM C[C@@H](NCc1c([O-])cccc1Cl)c1nc(C(C)(C)C)no1 ZINC000742390892 1021111367 /nfs/dbraw/zinc/11/13/67/1021111367.db2.gz TWEZJGKFDAXICS-SECBINFHSA-N -1 3 309.797 3.577 20 10 DHCDHM C[C@@H](N[C@@H](C)c1nccn1C)c1cc(Cl)c(Cl)cc1[O-] ZINC000850573179 1021616984 /nfs/dbraw/zinc/61/69/84/1021616984.db2.gz VUOCUMPIGZBKTC-BDAKNGLRSA-N -1 3 314.216 3.844 20 10 DHCDHM CCN(Cc1ccncc1)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000271018926 1022454916 /nfs/dbraw/zinc/45/49/16/1022454916.db2.gz NMWIHKHHOZSUFN-UHFFFAOYSA-N -1 3 318.804 3.665 20 10 DHCDHM CN(Cc1cccs1)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000768159343 1022908466 /nfs/dbraw/zinc/90/84/66/1022908466.db2.gz APPWZZGPYFPNRC-UHFFFAOYSA-N -1 3 312.778 3.647 20 10 DHCDHM CC(C)N(Cc1ccco1)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000768250972 1022934439 /nfs/dbraw/zinc/93/44/39/1022934439.db2.gz YPHBXQDPNURWLY-UHFFFAOYSA-N -1 3 324.764 3.957 20 10 DHCDHM CC(C)(C)[C@@H]1CN(C(=O)c2cccc(O)c2[O-])c2ccccc21 ZINC000769645469 1023190110 /nfs/dbraw/zinc/19/01/10/1023190110.db2.gz VLFXYHPQYFHFLN-CQSZACIVSA-N -1 3 311.381 3.888 20 10 DHCDHM CC[C@@H](Nc1ccc2c(c1)N(C)CCO2)c1ccc(F)cc1[O-] ZINC000796925640 1024104210 /nfs/dbraw/zinc/10/42/10/1024104210.db2.gz KVSNGRJOTYSFEX-OAHLLOKOSA-N -1 3 316.376 3.923 20 10 DHCDHM Cc1ccc2c(c1C)OC[C@H]2NCc1cc(F)cc(F)c1[O-] ZINC000882986599 1024194459 /nfs/dbraw/zinc/19/44/59/1024194459.db2.gz DHOWPAARXACBKA-OAHLLOKOSA-N -1 3 305.324 3.511 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)Nc2ccc(C)cc2F)c1 ZINC000756856721 1024201068 /nfs/dbraw/zinc/20/10/68/1024201068.db2.gz HSKVWRNQDGTSPU-LLVKDONJSA-N -1 3 303.333 3.799 20 10 DHCDHM COc1ccc(C)cc1CNCc1c([O-])ccc(Cl)c1F ZINC000790949136 1024402206 /nfs/dbraw/zinc/40/22/06/1024402206.db2.gz JPZJIBUGFSKITD-UHFFFAOYSA-N -1 3 309.768 3.792 20 10 DHCDHM COc1c([O-])c(CNc2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000278932962 1024539187 /nfs/dbraw/zinc/53/91/87/1024539187.db2.gz WQIHPNXSHDSILB-UHFFFAOYSA-N -1 3 302.330 3.538 20 10 DHCDHM CC(C)(NCc1cc(F)cc(F)c1[O-])c1ccc(F)cc1F ZINC000886350531 1025600249 /nfs/dbraw/zinc/60/02/49/1025600249.db2.gz XXBRCIQTTZQBBV-UHFFFAOYSA-N -1 3 313.294 3.974 20 10 DHCDHM COc1cc(F)c(N[C@@H](C)c2c([O-])cccc2F)cc1OC ZINC000886579279 1025717288 /nfs/dbraw/zinc/71/72/88/1025717288.db2.gz HRCKOZOFCMTTIJ-VIFPVBQESA-N -1 3 309.312 3.861 20 10 DHCDHM C[C@@H](N[C@@H]1CCOc2c(F)cccc21)c1c([O-])cccc1F ZINC000886597085 1025730095 /nfs/dbraw/zinc/73/00/95/1025730095.db2.gz VXIPSANVUWPRDJ-QMTHXVAHSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@H](N[C@@H]1CCCC1(F)F)c1ccc(Br)cc1[O-] ZINC000806179762 1025834716 /nfs/dbraw/zinc/83/47/16/1025834716.db2.gz GZVAGKISXPYGTR-QPUJVOFHSA-N -1 3 320.177 3.993 20 10 DHCDHM Cc1n[nH]c(C)c1[C@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000809768330 1026605662 /nfs/dbraw/zinc/60/56/62/1026605662.db2.gz IBUVXYGSICOUKM-CQSZACIVSA-N -1 3 323.799 3.862 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCC(F)(F)[C@@H](C)C2)c1[O-] ZINC000810045303 1026668884 /nfs/dbraw/zinc/66/88/84/1026668884.db2.gz KCHCPRXWNCPCHS-VIFPVBQESA-N -1 3 317.763 3.725 20 10 DHCDHM CC1(C)CN(Cc2c([O-])cccc2Cl)C[C@@H](C(F)(F)F)O1 ZINC000814176625 1027910514 /nfs/dbraw/zinc/91/05/14/1027910514.db2.gz SKRNETUSHUTDHG-LBPRGKRZSA-N -1 3 323.742 3.587 20 10 DHCDHM C[C@]12CCN(Cc3cc(Cl)cc(F)c3[O-])C[C@H]1C2(F)F ZINC000814170298 1027923931 /nfs/dbraw/zinc/92/39/31/1027923931.db2.gz UTZVINIUPMIAML-YPMHNXCESA-N -1 3 305.727 3.662 20 10 DHCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C ZINC000189426783 1028578981 /nfs/dbraw/zinc/57/89/81/1028578981.db2.gz WRYCADHJNIHZID-UHFFFAOYSA-N -1 3 319.426 3.681 20 10 DHCDHM CN(C)c1ccc(CN(C)Cc2cccc([O-])c2Cl)cc1 ZINC000816477771 1028889757 /nfs/dbraw/zinc/88/97/57/1028889757.db2.gz JQLYIABPFSUALF-UHFFFAOYSA-N -1 3 304.821 3.744 20 10 DHCDHM CC(C)Oc1ncccc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000816527882 1028936486 /nfs/dbraw/zinc/93/64/86/1028936486.db2.gz COUNKAHACQKFEB-UHFFFAOYSA-N -1 3 324.783 3.657 20 10 DHCDHM CN(Cc1ncc(Cl)n1C)Cc1ccc2ccccc2c1[O-] ZINC000816564731 1028948804 /nfs/dbraw/zinc/94/88/04/1028948804.db2.gz OKJTYYTUJQWEED-UHFFFAOYSA-N -1 3 315.804 3.564 20 10 DHCDHM C[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1c(F)cncc1F ZINC000816609649 1028960998 /nfs/dbraw/zinc/96/09/98/1028960998.db2.gz IIEFSXKATATKRW-SSDOTTSWSA-N -1 3 316.710 3.709 20 10 DHCDHM O=C(N[C@@H]1CCCc2sc(Cl)cc21)c1cccc(O)c1[O-] ZINC000817019360 1029054024 /nfs/dbraw/zinc/05/40/24/1029054024.db2.gz GLVBZDPAUGAYKT-SNVBAGLBSA-N -1 3 323.801 3.620 20 10 DHCDHM CC(=O)Nc1ccc(C)c(NCc2c([O-])cccc2Cl)c1 ZINC000155480605 1029238650 /nfs/dbraw/zinc/23/86/50/1029238650.db2.gz WEBYROUZICXCRS-UHFFFAOYSA-N -1 3 304.777 3.925 20 10 DHCDHM C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928383631 1031292874 /nfs/dbraw/zinc/29/28/74/1031292874.db2.gz IWCLTIBXNQWNIA-BBRMVZONSA-N -1 3 311.381 3.506 20 10 DHCDHM COc1ccccc1[C@@H](C)N(C)Cc1cc(F)c(F)cc1[O-] ZINC001142527511 1031911544 /nfs/dbraw/zinc/91/15/44/1031911544.db2.gz XKWMBDZIFALVLG-LLVKDONJSA-N -1 3 307.340 3.872 20 10 DHCDHM C[C@H]1C[C@H](C(F)(F)F)CCN1Cc1ccc(F)c(F)c1[O-] ZINC000877563011 1033359138 /nfs/dbraw/zinc/35/91/38/1033359138.db2.gz FAVAEYYTZAOKPC-WCBMZHEXSA-N -1 3 309.278 3.833 20 10 DHCDHM Cc1cc([O-])c([C@H]2NC(C)(C)C(=O)N2CC(C)(C)C)cc1Cl ZINC000877856659 1033489714 /nfs/dbraw/zinc/48/97/14/1033489714.db2.gz GUQJJTZFMYKXGI-AWEZNQCLSA-N -1 3 324.852 3.609 20 10 DHCDHM CC1(CC(F)F)CN(Cc2c([O-])cccc2Br)C1 ZINC000862399871 1033841839 /nfs/dbraw/zinc/84/18/39/1033841839.db2.gz FRASEEJMSXUDEX-UHFFFAOYSA-N -1 3 320.177 3.632 20 10 DHCDHM CC[C@@H](Nc1cccc(-n2nccn2)c1)c1ccc(F)cc1[O-] ZINC000864022202 1034259741 /nfs/dbraw/zinc/25/97/41/1034259741.db2.gz IMUPZOYTPWZGTK-MRXNPFEDSA-N -1 3 312.348 3.675 20 10 DHCDHM COCCOc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1F ZINC000186288597 1034616384 /nfs/dbraw/zinc/61/63/84/1034616384.db2.gz HNIUZUZKORTLCN-LLVKDONJSA-N -1 3 323.339 3.869 20 10 DHCDHM C[C@@H](NCc1cc(COC(C)(C)C)on1)c1ccc(F)cc1[O-] ZINC000186831752 1034662895 /nfs/dbraw/zinc/66/28/95/1034662895.db2.gz RDTUVYKMPOIGFW-LLVKDONJSA-N -1 3 322.380 3.685 20 10 DHCDHM Cc1ccc(C(=O)N2C[C@H](C(C)C)c3ccccc32)c([O-])c1O ZINC000773777488 1035450766 /nfs/dbraw/zinc/45/07/66/1035450766.db2.gz STVHVFCTGPWIIP-OAHLLOKOSA-N -1 3 311.381 3.806 20 10 DHCDHM Cc1cc(O)cc(C)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC001195159019 1036165355 /nfs/dbraw/zinc/16/53/55/1036165355.db2.gz KKFAZIQOBBIYDY-UHFFFAOYSA-N -1 3 319.426 3.933 20 10 DHCDHM COc1nn(C)cc1N[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774382926 1036309818 /nfs/dbraw/zinc/30/98/18/1036309818.db2.gz WWIXFIFMCNDPLM-SSDOTTSWSA-N -1 3 316.188 3.614 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC001183909599 1036704809 /nfs/dbraw/zinc/70/48/09/1036704809.db2.gz OZYICMVHLQCCNH-HOTGVXAUSA-N -1 3 314.816 3.509 20 10 DHCDHM C[C@H]1CCCN(Cc2cc(F)cc(Br)c2[O-])C1 ZINC001235299516 1036963774 /nfs/dbraw/zinc/96/37/74/1036963774.db2.gz VLZCXJNUJRKRGO-VIFPVBQESA-N -1 3 302.187 3.526 20 10 DHCDHM COc1c([O-])c(CNc2ccccc2SC)ccc1[N+](=O)[O-] ZINC000774934367 1037243180 /nfs/dbraw/zinc/24/31/80/1037243180.db2.gz IELGBBWHGXGYRV-UHFFFAOYSA-N -1 3 320.370 3.643 20 10 DHCDHM Cc1cc(NCc2c([O-])cccc2Cl)ccc1C(=O)N(C)C ZINC000775118138 1037634364 /nfs/dbraw/zinc/63/43/64/1037634364.db2.gz KKDBKTACFUJGDU-UHFFFAOYSA-N -1 3 318.804 3.668 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCc2ccccc2C1 ZINC000005948408 181299944 /nfs/dbraw/zinc/29/99/44/181299944.db2.gz VQFOJOXBZUOTDZ-UHFFFAOYSA-N -1 3 318.214 3.713 20 10 DHCDHM C[C@H](NC1(c2ccccc2F)CC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273486820 130127402 /nfs/dbraw/zinc/12/74/02/130127402.db2.gz NIZHESMFSVSEFL-NSHDSACASA-N -1 3 316.332 3.779 20 10 DHCDHM C[C@@H](NCc1ccccc1[O-])c1nc(C(F)(F)F)cs1 ZINC000274663926 130253327 /nfs/dbraw/zinc/25/33/27/130253327.db2.gz WULMVLXQLKWQJK-MRVPVSSYSA-N -1 3 302.321 3.718 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000286148494 131222646 /nfs/dbraw/zinc/22/26/46/131222646.db2.gz NYVYVGCHOXPPAW-OIISXLGYSA-N -1 3 323.392 3.506 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccc([N+](=O)[O-])cc1 ZINC000297255474 335152259 /nfs/dbraw/zinc/15/22/59/335152259.db2.gz JOSHWXUHRQEIQQ-QWRGUYRKSA-N -1 3 304.321 3.851 20 10 DHCDHM C[C@@H](NCc1ncccc1N(C)C)c1ccc2ccccc2c1[O-] ZINC000289802839 334167987 /nfs/dbraw/zinc/16/79/87/334167987.db2.gz OBJVPGBMXVRDOW-CQSZACIVSA-N -1 3 321.424 3.857 20 10 DHCDHM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cccc(O)c1[O-] ZINC000292663241 334190379 /nfs/dbraw/zinc/19/03/79/334190379.db2.gz LPGBXFBPPNQCQU-IOASZLSFSA-N -1 3 311.381 3.505 20 10 DHCDHM CC[C@@H](c1ccccc1[O-])N1CCCC[C@@H]1c1noc(C)n1 ZINC000377615652 337056366 /nfs/dbraw/zinc/05/63/66/337056366.db2.gz MZDWLXVAXLBXMD-LSDHHAIUSA-N -1 3 301.390 3.762 20 10 DHCDHM CC[C@H](c1ccccc1[O-])N1CCCC[C@@H]1c1noc(C)n1 ZINC000377615651 337056376 /nfs/dbraw/zinc/05/63/76/337056376.db2.gz MZDWLXVAXLBXMD-HUUCEWRRSA-N -1 3 301.390 3.762 20 10 DHCDHM CC[C@@H](c1ccccc1[O-])N1CCn2c(C(C)C)nnc2[C@@H]1C ZINC000377633584 337056998 /nfs/dbraw/zinc/05/69/98/337056998.db2.gz VMNGDBRFWFBBGM-ZFWWWQNUSA-N -1 3 314.433 3.635 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000186440843 337256254 /nfs/dbraw/zinc/25/62/54/337256254.db2.gz USSHVTQFBGEGRH-SFHVURJKSA-N -1 3 315.800 3.677 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](c2ccccc2)CC1 ZINC000187069513 337261721 /nfs/dbraw/zinc/26/17/21/337261721.db2.gz LMOCMWQVZKNJIP-HNNXBMFYSA-N -1 3 311.381 3.508 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@@H](CC)c2ccccc2[O-])o1 ZINC000156014214 524051291 /nfs/dbraw/zinc/05/12/91/524051291.db2.gz ABXHBMIVYCPLFL-HOTGVXAUSA-N -1 3 303.402 3.976 20 10 DHCDHM CC[C@@H](NCc1cc(F)ccc1OC)c1ccc(F)cc1[O-] ZINC000287357888 535805524 /nfs/dbraw/zinc/80/55/24/535805524.db2.gz HEJNPNZGRHLVGY-OAHLLOKOSA-N -1 3 307.340 3.920 20 10 DHCDHM COCC[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccc(C)o1 ZINC000273478307 536807782 /nfs/dbraw/zinc/80/77/82/536807782.db2.gz TZDSSGKSFYJQQY-SWLSCSKDSA-N -1 3 307.365 3.861 20 10 DHCDHM CCC[N@H+](Cc1ccc(C(=O)[O-])c(F)c1)Cc1ccccc1[O-] ZINC000829497238 601626493 /nfs/dbraw/zinc/62/64/93/601626493.db2.gz ZUUZJLNFWPFPDY-UHFFFAOYSA-N -1 3 317.360 3.642 20 10 DHCDHM CCC[N@@H+](Cc1ccc(C(=O)[O-])c(F)c1)Cc1ccccc1[O-] ZINC000829497238 601626495 /nfs/dbraw/zinc/62/64/95/601626495.db2.gz ZUUZJLNFWPFPDY-UHFFFAOYSA-N -1 3 317.360 3.642 20 10 DHCDHM Cc1noc(C)c1C(C)(C)NCc1cc(Cl)c(F)cc1[O-] ZINC000294088073 1013124658 /nfs/dbraw/zinc/12/46/58/1013124658.db2.gz ZLXZFUOYSTYWEC-UHFFFAOYSA-N -1 3 312.772 3.814 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Br)cc(F)c2[O-])[C@H](C)C1 ZINC000715714121 1018952248 /nfs/dbraw/zinc/95/22/48/1018952248.db2.gz VQUKDHIZYCEVRX-NXEZZACHSA-N -1 3 316.214 3.914 20 10 DHCDHM C[S@](=O)Cc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000134085062 1013919760 /nfs/dbraw/zinc/91/97/60/1013919760.db2.gz NJXAADFOWFZVKT-HXUWFJFHSA-N -1 3 309.818 3.536 20 10 DHCDHM CC(=O)Nc1ccc(NCc2c([O-])cccc2Cl)cc1C ZINC000083607957 1013986774 /nfs/dbraw/zinc/98/67/74/1013986774.db2.gz QDMGPAUQCLUYOA-UHFFFAOYSA-N -1 3 304.777 3.925 20 10 DHCDHM CC[C@H](c1ccccc1)[N@H+](CC(=O)[O-])Cc1ccc(C)cc1[O-] ZINC001595363235 980779777 /nfs/dbraw/zinc/77/97/77/980779777.db2.gz YXCGHPNILOIBHL-QGZVFWFLSA-N -1 3 313.397 3.739 20 10 DHCDHM CC[C@H](c1ccccc1)[N@@H+](CC(=O)[O-])Cc1ccc(C)cc1[O-] ZINC001595363235 980779780 /nfs/dbraw/zinc/77/97/80/980779780.db2.gz YXCGHPNILOIBHL-QGZVFWFLSA-N -1 3 313.397 3.739 20 10 DHCDHM CCC[N@H+](Cc1csc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC001595890788 982922099 /nfs/dbraw/zinc/92/20/99/982922099.db2.gz DYCOJXWRUKXXRV-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM CCC[N@@H+](Cc1csc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC001595890788 982922104 /nfs/dbraw/zinc/92/21/04/982922104.db2.gz DYCOJXWRUKXXRV-UHFFFAOYSA-N -1 3 305.399 3.564 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC2(CCCCO2)CC1 ZINC000895654565 1015241453 /nfs/dbraw/zinc/24/14/53/1015241453.db2.gz UCRPIFNZOCWRQN-UHFFFAOYSA-N -1 3 313.800 3.720 20 10 DHCDHM C[C@@H]([NH2+][C@H]1CCC[C@@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599841215 988836800 /nfs/dbraw/zinc/83/68/00/988836800.db2.gz RRYTWRDWOOXZGC-ILXRZTDVSA-N -1 3 305.418 3.857 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1nccc2c1CCCC2 ZINC000896280668 1015532735 /nfs/dbraw/zinc/53/27/35/1015532735.db2.gz HUFCIDXEEMKFNT-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593251477 994496406 /nfs/dbraw/zinc/49/64/06/994496406.db2.gz GURLZIAYHIYAFA-QWRGUYRKSA-N -1 3 313.344 3.567 20 10 DHCDHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185765534 1017158747 /nfs/dbraw/zinc/15/87/47/1017158747.db2.gz PAACDRZEZPTIIL-BXUZGUMPSA-N -1 3 315.369 3.613 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000928712618 1017699816 /nfs/dbraw/zinc/69/98/16/1017699816.db2.gz URXKTVYZDRQCLL-UWVGGRQHSA-N -1 3 319.298 3.516 20 10 DHCDHM O=C(c1ccncc1)c1ccccc1Nc1cccc([O-])c1F ZINC001212554540 1018459370 /nfs/dbraw/zinc/45/93/70/1018459370.db2.gz ZFKJBIQZPAXFBG-UHFFFAOYSA-N -1 3 308.312 3.901 20 10 DHCDHM CC1CCN(Cc2cc(Br)cc(F)c2[O-])CC1 ZINC000715701623 1018939319 /nfs/dbraw/zinc/93/93/19/1018939319.db2.gz DZKSFBFDIGRTEE-UHFFFAOYSA-N -1 3 302.187 3.526 20 10 DHCDHM Cc1ccc([C@@H]2CCCCN2C(=O)c2cccc(O)c2[O-])cc1 ZINC000187168882 1019213768 /nfs/dbraw/zinc/21/37/68/1019213768.db2.gz IRZPUJGBDBCCST-INIZCTEOSA-N -1 3 311.381 3.774 20 10 DHCDHM C[C@@H](Nc1cccc(N2CCCC2=O)c1)c1ccc(F)cc1[O-] ZINC000170788979 1019435893 /nfs/dbraw/zinc/43/58/93/1019435893.db2.gz AUSWFWMEKKTTCE-GFCCVEGCSA-N -1 3 314.360 3.831 20 10 DHCDHM Cc1ccc2c(c1)C(=O)N(C)[C@@H](c1cc(Cl)ccc1[O-])N2 ZINC000153729834 1020558287 /nfs/dbraw/zinc/55/82/87/1020558287.db2.gz URGNPANUKIOGQN-HNNXBMFYSA-N -1 3 302.761 3.550 20 10 DHCDHM C[C@@H](Nc1cnn(CCF)c1)c1cccc(C(F)(F)F)c1[O-] ZINC000858491857 1032916653 /nfs/dbraw/zinc/91/66/53/1032916653.db2.gz PNOMSXVQYRNVPZ-SECBINFHSA-N -1 3 317.286 3.750 20 10 DHCDHM CCC(F)(F)CN[C@H](C)c1ccc(Br)cc1[O-] ZINC000858507240 1032926501 /nfs/dbraw/zinc/92/65/01/1032926501.db2.gz NEFKSXXHCJKYSS-MRVPVSSYSA-N -1 3 308.166 3.851 20 10 DHCDHM CC(=O)N(C)c1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000742379235 1021115609 /nfs/dbraw/zinc/11/56/09/1021115609.db2.gz PBHZLDSUGGKPTP-UHFFFAOYSA-N -1 3 304.777 3.640 20 10 DHCDHM O=C(Nc1ccc(Oc2ccccc2)nc1)c1cccc(O)c1[O-] ZINC000776632413 1022188764 /nfs/dbraw/zinc/18/87/64/1022188764.db2.gz RTGNZXWTEQXBMA-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM Cc1nc(C(C)(C)NCc2cc(F)cc(F)c2[O-])sc1C ZINC000883016219 1024213906 /nfs/dbraw/zinc/21/39/06/1024213906.db2.gz QXUJWAPXOBNVJB-UHFFFAOYSA-N -1 3 312.385 3.769 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)Nc2cc(C)ccc2OC)c1 ZINC000756870918 1024245755 /nfs/dbraw/zinc/24/57/55/1024245755.db2.gz NDDOYMACXSSCSN-LBPRGKRZSA-N -1 3 315.369 3.669 20 10 DHCDHM CC(C)C[C@@H](NC(=O)c1cccc(O)c1[O-])c1cccs1 ZINC000790561069 1024327168 /nfs/dbraw/zinc/32/71/68/1024327168.db2.gz RNPGUDUOUDIANN-GFCCVEGCSA-N -1 3 305.399 3.677 20 10 DHCDHM CC(C)CN(Cc1ccccc1F)C(=O)c1cccc(O)c1[O-] ZINC000790750643 1024371830 /nfs/dbraw/zinc/37/18/30/1024371830.db2.gz NLDIPYHSHUJJOP-UHFFFAOYSA-N -1 3 317.360 3.535 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1CCC1CCCC1 ZINC000790893577 1024394325 /nfs/dbraw/zinc/39/43/25/1024394325.db2.gz IULQTNVTUSBXRL-CQSZACIVSA-N -1 3 303.402 3.673 20 10 DHCDHM CN(C)c1ccccc1CNCc1c([O-])ccc(Cl)c1F ZINC000790966851 1024409837 /nfs/dbraw/zinc/40/98/37/1024409837.db2.gz WMPKZOUISCMLAW-UHFFFAOYSA-N -1 3 308.784 3.541 20 10 DHCDHM CCc1cnccc1[C@@H](C)NCc1c([O-])ccc(Cl)c1F ZINC000790980668 1024424041 /nfs/dbraw/zinc/42/40/41/1024424041.db2.gz BOZJVLXOCLJIEI-SNVBAGLBSA-N -1 3 308.784 3.993 20 10 DHCDHM CCCN(Cc1cccc(Cl)c1[O-])[C@@H](CC)C(=O)OCC ZINC000792189144 1024645699 /nfs/dbraw/zinc/64/56/99/1024645699.db2.gz QRXKUYQATKUELI-AWEZNQCLSA-N -1 3 313.825 3.599 20 10 DHCDHM C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000793232253 1024950048 /nfs/dbraw/zinc/95/00/48/1024950048.db2.gz VCQLPZHHYAVSQO-VXNVDRBHSA-N -1 3 311.706 3.957 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@H](C)c2c([O-])cccc2F)o1 ZINC000886532073 1025679576 /nfs/dbraw/zinc/67/95/76/1025679576.db2.gz CTSRDBOQYNOFCB-RISCZKNCSA-N -1 3 307.365 3.725 20 10 DHCDHM C[C@@H](N[C@H]1CCCC1(F)F)c1cc(Br)ccc1[O-] ZINC000806179221 1025833991 /nfs/dbraw/zinc/83/39/91/1025833991.db2.gz BJYVSPBJVKMNEL-PELKAZGASA-N -1 3 320.177 3.993 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN(Cc1cccnc1)C1CC1 ZINC000809763036 1026620276 /nfs/dbraw/zinc/62/02/76/1026620276.db2.gz HZTTYEDJRXJBGV-UHFFFAOYSA-N -1 3 306.768 3.744 20 10 DHCDHM C[C@@H]1Oc2ccccc2[C@H]1NCc1cc(Cl)cc(F)c1[O-] ZINC000809787459 1026625534 /nfs/dbraw/zinc/62/55/34/1026625534.db2.gz DLSPBZDSVNWLFM-VFZGTOFNSA-N -1 3 307.752 3.797 20 10 DHCDHM [O-]c1cc2c(cc1CN1CCn3cncc3C1)oc1ccccc12 ZINC000811787627 1027092028 /nfs/dbraw/zinc/09/20/28/1027092028.db2.gz NJPNFTPYYQJYPV-UHFFFAOYSA-N -1 3 319.364 3.504 20 10 DHCDHM C[C@]12CCN(Cc3c([O-])ccc(Cl)c3F)C[C@H]1C2(F)F ZINC000814169238 1027924474 /nfs/dbraw/zinc/92/44/74/1027924474.db2.gz FRORZYBXAYXXPH-YPMHNXCESA-N -1 3 305.727 3.662 20 10 DHCDHM C[C@@]12CCN(Cc3c([O-])ccc(Cl)c3F)C[C@@H]1C2(F)F ZINC000814169236 1027925439 /nfs/dbraw/zinc/92/54/39/1027925439.db2.gz FRORZYBXAYXXPH-WCQYABFASA-N -1 3 305.727 3.662 20 10 DHCDHM COc1ccc(F)cc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000779055589 1028085418 /nfs/dbraw/zinc/08/54/18/1028085418.db2.gz LCKZWXOIWOMOCX-VIFPVBQESA-N -1 3 311.303 3.669 20 10 DHCDHM C[C@@H](N[C@@H]1COc2cccc(F)c21)c1cc(Cl)ccc1[O-] ZINC000368411271 1028353291 /nfs/dbraw/zinc/35/32/91/1028353291.db2.gz NMAVBTNOBQKMCG-NOZJJQNGSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(N(C)C)cc1 ZINC000815136268 1028394694 /nfs/dbraw/zinc/39/46/94/1028394694.db2.gz TWCKDYNQCICJRU-LBPRGKRZSA-N -1 3 304.821 3.962 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H]1c1ccccn1 ZINC000816487378 1028893512 /nfs/dbraw/zinc/89/35/12/1028893512.db2.gz LCFASNCEMOCGHN-OAHLLOKOSA-N -1 3 306.768 3.917 20 10 DHCDHM Cc1cc([C@H]2CCCN2Cc2cc(Cl)c(F)cc2[O-])on1 ZINC000816492877 1028899518 /nfs/dbraw/zinc/89/95/18/1028899518.db2.gz HQGQNTUJRGMLOW-CYBMUJFWSA-N -1 3 310.756 3.818 20 10 DHCDHM Cc1ccc(C(=O)N2CC(C)(C)Cc3ccccc32)c([O-])c1O ZINC000816902971 1029034542 /nfs/dbraw/zinc/03/45/42/1029034542.db2.gz OBZKVKZZIPLLEM-UHFFFAOYSA-N -1 3 311.381 3.635 20 10 DHCDHM CCc1ccc([C@@H](NC(=O)c2cccc(O)c2[O-])C(C)C)cc1 ZINC001135978060 1029233769 /nfs/dbraw/zinc/23/37/69/1029233769.db2.gz GXGFTDMYRPHSJL-KRWDZBQOSA-N -1 3 313.397 3.787 20 10 DHCDHM CCO[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000155455845 1029235962 /nfs/dbraw/zinc/23/59/62/1029235962.db2.gz CWCJRMFEWZMNOI-GFCCVEGCSA-N -1 3 304.217 3.700 20 10 DHCDHM C[C@H](Nc1cccc2c1OCCCO2)c1ccc(F)cc1[O-] ZINC000866619861 1030409882 /nfs/dbraw/zinc/40/98/82/1030409882.db2.gz VWHLWEUQORSLMI-NSHDSACASA-N -1 3 303.333 3.866 20 10 DHCDHM CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1(C)C ZINC000824820854 1030649024 /nfs/dbraw/zinc/64/90/24/1030649024.db2.gz OWHFTXUCPKNIGQ-CYBMUJFWSA-N -1 3 318.244 3.946 20 10 DHCDHM Cc1nnsc1CN[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000293751303 1031602076 /nfs/dbraw/zinc/60/20/76/1031602076.db2.gz RLDDVNIVHPEOCG-LURJTMIESA-N -1 3 318.229 3.710 20 10 DHCDHM COCC[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1ccco1 ZINC000293753085 1031604386 /nfs/dbraw/zinc/60/43/86/1031604386.db2.gz YGXLDCYMEOORRM-CYBMUJFWSA-N -1 3 313.756 3.645 20 10 DHCDHM CC1(C)CN(Cc2cc(F)c(F)cc2[O-])Cc2ccccc21 ZINC001142527056 1031906986 /nfs/dbraw/zinc/90/69/86/1031906986.db2.gz ISCCKWNQCDMIQP-UHFFFAOYSA-N -1 3 303.352 3.964 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@@H](C)c2ccc(F)cc2[O-])o1 ZINC000185548037 1034556525 /nfs/dbraw/zinc/55/65/25/1034556525.db2.gz LUROQLKHYMCTGT-XHDPSFHLSA-N -1 3 307.365 3.725 20 10 DHCDHM C[C@H](Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(F)cc1[O-] ZINC000186320795 1034619374 /nfs/dbraw/zinc/61/93/74/1034619374.db2.gz VSJBPTJLLSSDQG-BLLLJJGKSA-N -1 3 317.360 3.872 20 10 DHCDHM [O-]c1c(CN2CC3(C2)CC(F)(F)C3)cccc1C(F)(F)F ZINC001233415879 1035968744 /nfs/dbraw/zinc/96/87/44/1035968744.db2.gz LZZHSBXGYQTWKM-UHFFFAOYSA-N -1 3 307.262 3.642 20 10 DHCDHM Cc1cc(CN[C@H](C)c2cc(Cl)c(Cl)cc2[O-])ncn1 ZINC000774266029 1036266880 /nfs/dbraw/zinc/26/68/80/1036266880.db2.gz MYJOREZWJCZIDW-SECBINFHSA-N -1 3 312.200 3.648 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC(c2ccccn2)CC1 ZINC000775661136 1036280098 /nfs/dbraw/zinc/28/00/98/1036280098.db2.gz JYKCNIZFIOYUBD-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM COc1c([O-])c(CNc2ccc(C)cc2Cl)ccc1[N+](=O)[O-] ZINC000774942197 1037249448 /nfs/dbraw/zinc/24/94/48/1037249448.db2.gz NZUWBBZWYWUTLR-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM [O-]c1c(Cl)cccc1CNCc1ccn(-c2ccccc2)n1 ZINC000776094224 1037427387 /nfs/dbraw/zinc/42/73/87/1037427387.db2.gz KHQPJCVPNCZBKY-UHFFFAOYSA-N -1 3 313.788 3.521 20 10 DHCDHM COc1c2ccccc2oc1CNCc1cc(F)cc(F)c1[O-] ZINC001202066392 1038005150 /nfs/dbraw/zinc/00/51/50/1038005150.db2.gz WTEMPDHJAHKLDA-UHFFFAOYSA-N -1 3 319.307 3.715 20 10 DHCDHM CC[C@@H](NCc1cc[nH]n1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775501807 1038591650 /nfs/dbraw/zinc/59/16/50/1038591650.db2.gz LKSFKCYEOFKLTH-LLVKDONJSA-N -1 3 300.189 3.663 20 10 DHCDHM COc1cccc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273390280 130115795 /nfs/dbraw/zinc/11/57/95/130115795.db2.gz KKZFVNGIPNHEOH-NWDGAFQWSA-N -1 3 316.357 3.721 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cn[nH]c1)c1ccc(Cl)c(Cl)c1[O-] ZINC000273484365 130125766 /nfs/dbraw/zinc/12/57/66/130125766.db2.gz MYOHAJDUFMCQNI-JGVFFNPUSA-N -1 3 300.189 3.834 20 10 DHCDHM C[C@@H](NC1(c2cccc(F)c2)CC1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273517896 130131256 /nfs/dbraw/zinc/13/12/56/130131256.db2.gz SWVSJFIEABABFT-LLVKDONJSA-N -1 3 316.332 3.779 20 10 DHCDHM COc1cc(Cl)cc(CN2CCC[C@H]2c2ccc[nH]2)c1[O-] ZINC000273723058 130159017 /nfs/dbraw/zinc/15/90/17/130159017.db2.gz ITCNHYNUPADBFP-AWEZNQCLSA-N -1 3 306.793 3.719 20 10 DHCDHM Cc1noc(C(C)(C)NCc2cc(-c3ccccc3)ccc2[O-])n1 ZINC000284206518 131059032 /nfs/dbraw/zinc/05/90/32/131059032.db2.gz ZEUMIARHSKGSGP-UHFFFAOYSA-N -1 3 323.396 3.776 20 10 DHCDHM CCc1noc(CC)c1CN[C@@H](CC)c1ccc(F)cc1[O-] ZINC000285520218 131176720 /nfs/dbraw/zinc/17/67/20/131176720.db2.gz BBZYYJMTRFQWLB-AWEZNQCLSA-N -1 3 306.381 3.885 20 10 DHCDHM CC[C@@H](NCc1ccc(OC)cc1OC)c1ccc(F)cc1[O-] ZINC000285906146 131209189 /nfs/dbraw/zinc/20/91/89/131209189.db2.gz CXRINKZJEZRKNM-MRXNPFEDSA-N -1 3 319.376 3.789 20 10 DHCDHM CCOc1ccc(N[C@@H](CC)c2ccc(F)cc2[O-])cc1CO ZINC000285996771 131214130 /nfs/dbraw/zinc/21/41/30/131214130.db2.gz HHGATHZFWAVBTG-INIZCTEOSA-N -1 3 319.376 3.986 20 10 DHCDHM CC[C@@H](NCc1cn2ccc(C)cc2n1)c1ccc(F)cc1[O-] ZINC000286232809 131225761 /nfs/dbraw/zinc/22/57/61/131225761.db2.gz SXORGHOSISTGFK-MRXNPFEDSA-N -1 3 313.376 3.728 20 10 DHCDHM C[C@@H](N[C@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1[O-] ZINC000287035337 131260488 /nfs/dbraw/zinc/26/04/88/131260488.db2.gz MBIHSRRBJXKUTF-BDJLRTHQSA-N -1 3 323.795 3.959 20 10 DHCDHM CC[C@H](N[C@@H](CO)c1ccc(F)cc1)c1cccc(Cl)c1[O-] ZINC000287572611 131288294 /nfs/dbraw/zinc/28/82/94/131288294.db2.gz GXJUNEYQMIOAAZ-HOTGVXAUSA-N -1 3 323.795 3.959 20 10 DHCDHM COC[C@@H](N[C@H](C)c1cc(Cl)ccc1[O-])c1ccc(C)o1 ZINC000185630161 333210860 /nfs/dbraw/zinc/21/08/60/333210860.db2.gz DOFMKLNRCAKQAI-BXUZGUMPSA-N -1 3 309.793 3.985 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@@H](C)c2cc(F)ccc2[O-])cs1 ZINC000273460896 334047223 /nfs/dbraw/zinc/04/72/23/334047223.db2.gz CQDIWLMCQHGBMN-UWVGGRQHSA-N -1 3 310.394 3.546 20 10 DHCDHM CC[C@H](N[C@H]1COc2cccc(F)c21)c1ccc(F)cc1[O-] ZINC000367620528 336826787 /nfs/dbraw/zinc/82/67/87/336826787.db2.gz YFCUKPDANWSEQX-KBPBESRZSA-N -1 3 305.324 3.845 20 10 DHCDHM Cc1cccc(-c2nnc([C@@H](C)N(C)Cc3ccccc3[O-])o2)c1 ZINC000377600656 337055873 /nfs/dbraw/zinc/05/58/73/337055873.db2.gz KEVQJPFSKIBUTG-CQSZACIVSA-N -1 3 323.396 3.944 20 10 DHCDHM CC[C@@H](c1ccccc1[O-])N1CCCC[C@H]1c1noc(C)n1 ZINC000377615650 337056310 /nfs/dbraw/zinc/05/63/10/337056310.db2.gz MZDWLXVAXLBXMD-GJZGRUSLSA-N -1 3 301.390 3.762 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](c2ccccc2)CC1 ZINC000187069494 337261684 /nfs/dbraw/zinc/26/16/84/337261684.db2.gz LMOCMWQVZKNJIP-OAHLLOKOSA-N -1 3 311.381 3.508 20 10 DHCDHM C[C@@H](c1nnc(-c2ccccc2)o1)N(C)Cc1ccccc1[O-] ZINC000109773454 337388546 /nfs/dbraw/zinc/38/85/46/337388546.db2.gz FBXVZQQVHBWLFD-ZDUSSCGKSA-N -1 3 309.369 3.635 20 10 DHCDHM CC[C@@H](N[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1[O-] ZINC000287308108 535808313 /nfs/dbraw/zinc/80/83/13/535808313.db2.gz CUQDWZDCDKHYJV-ZIAGYGMSSA-N -1 3 305.809 3.887 20 10 DHCDHM CC[C@H](N[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1[O-] ZINC000287308091 535945918 /nfs/dbraw/zinc/94/59/18/535945918.db2.gz CUQDWZDCDKHYJV-KBPBESRZSA-N -1 3 305.809 3.887 20 10 DHCDHM CC[C@H](C)c1nnc([C@H](C)N[C@@H](CC)c2ccc(F)cc2[O-])[nH]1 ZINC000287733715 536026981 /nfs/dbraw/zinc/02/69/81/536026981.db2.gz YNFCDVKNRCEXHA-MJVIPROJSA-N -1 3 320.412 3.965 20 10 DHCDHM CC[C@@](C)(CC(=O)[O-])[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000828664525 601431327 /nfs/dbraw/zinc/43/13/27/601431327.db2.gz BHWOAVMGEMZQNP-IBGZPJMESA-N -1 3 313.397 3.792 20 10 DHCDHM C[S@@](=O)Cc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000134084859 1013918636 /nfs/dbraw/zinc/91/86/36/1013918636.db2.gz NJXAADFOWFZVKT-FQEVSTJZSA-N -1 3 309.818 3.536 20 10 DHCDHM C[C@@H](C[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])c1cccc(F)c1 ZINC001592704923 979165280 /nfs/dbraw/zinc/16/52/80/979165280.db2.gz AEMJBXQQZUENJD-RYUDHWBXSA-N -1 3 317.360 3.684 20 10 DHCDHM CC[C@H](C)c1nc([C@@H](C)N[C@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000276816332 1015679777 /nfs/dbraw/zinc/67/97/77/1015679777.db2.gz AGZILKAEYIZTBO-IVZWLZJFSA-N -1 3 324.375 3.714 20 10 DHCDHM C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593251475 994495971 /nfs/dbraw/zinc/49/59/71/994495971.db2.gz GURLZIAYHIYAFA-GHMZBOCLSA-N -1 3 313.344 3.567 20 10 DHCDHM C[C@H](NCc1ccc([C@@H]2C[C@@H]2C)o1)c1cc(C(=O)[O-])ccc1O ZINC001593296756 994697915 /nfs/dbraw/zinc/69/79/15/994697915.db2.gz PTJWBHPKOBJVEC-COPLHBTASA-N -1 3 315.369 3.658 20 10 DHCDHM CC[C@@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccccc1F ZINC000847022850 1032182390 /nfs/dbraw/zinc/18/23/90/1032182390.db2.gz YUNQZAYVSIRPDY-OAHLLOKOSA-N -1 3 304.321 3.680 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1c1cc2ccccc2[nH]1 ZINC001148213891 1032372211 /nfs/dbraw/zinc/37/22/11/1032372211.db2.gz MPUQZOQHPIADCB-INIZCTEOSA-N -1 3 322.364 3.556 20 10 DHCDHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185765551 1017159657 /nfs/dbraw/zinc/15/96/57/1017159657.db2.gz PAACDRZEZPTIIL-FZMZJTMJSA-N -1 3 315.369 3.613 20 10 DHCDHM CC(C)(CC(=O)NCc1c([O-])cccc1F)CC(F)(F)F ZINC000928710972 1017662495 /nfs/dbraw/zinc/66/24/95/1017662495.db2.gz OSOBONJZFMPNCY-UHFFFAOYSA-N -1 3 307.287 3.516 20 10 DHCDHM C[C@H](NCc1nc2c(s1)CCCC2)c1c([O-])cccc1F ZINC000926920288 1032772623 /nfs/dbraw/zinc/77/26/23/1032772623.db2.gz UHAVYRRRUJKDFB-JTQLQIEISA-N -1 3 306.406 3.717 20 10 DHCDHM O=C(Nc1nc(-c2cccs2)cs1)c1cccc(O)c1[O-] ZINC000186815200 1020491266 /nfs/dbraw/zinc/49/12/66/1020491266.db2.gz WYWBZCGABQPACI-UHFFFAOYSA-N -1 3 318.379 3.535 20 10 DHCDHM CCN1C(=O)c2ccccc2N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000030542041 1020578647 /nfs/dbraw/zinc/57/86/47/1020578647.db2.gz DLFYEFYUOLUION-HNNXBMFYSA-N -1 3 302.761 3.632 20 10 DHCDHM COCCOCc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1 ZINC000858549883 1032941305 /nfs/dbraw/zinc/94/13/05/1032941305.db2.gz FPCGPGFXOFWMES-CYBMUJFWSA-N -1 3 319.376 3.867 20 10 DHCDHM CN(Cc1cncs1)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236798146 1021279337 /nfs/dbraw/zinc/27/93/37/1021279337.db2.gz HIUVQBORUNRGBC-UHFFFAOYSA-N -1 3 303.214 3.788 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1CCc2ccc(O)cc21 ZINC000850386990 1021503303 /nfs/dbraw/zinc/50/33/03/1021503303.db2.gz OCOLIHZUXKESOD-AWEZNQCLSA-N -1 3 307.752 3.667 20 10 DHCDHM CCc1ncncc1NCc1cc(Cl)c2cccnc2c1[O-] ZINC001168523707 1021510732 /nfs/dbraw/zinc/51/07/32/1021510732.db2.gz RRYGLTIWGVTMID-UHFFFAOYSA-N -1 3 314.776 3.558 20 10 DHCDHM [O-]c1c(CNc2ccc(F)cn2)cc(Cl)c2cccnc12 ZINC001168524250 1021663335 /nfs/dbraw/zinc/66/33/35/1021663335.db2.gz YHZBCSRNWKCAQL-UHFFFAOYSA-N -1 3 303.724 3.740 20 10 DHCDHM CCCc1cc(C(=O)NCc2c([O-])cccc2F)sc1C ZINC001156169982 1022070934 /nfs/dbraw/zinc/07/09/34/1022070934.db2.gz ANFNELRIUNOIIZ-UHFFFAOYSA-N -1 3 307.390 3.784 20 10 DHCDHM CN(Cc1ccc(F)cc1)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000768175794 1022912573 /nfs/dbraw/zinc/91/25/73/1022912573.db2.gz WGMOQTQHISTENJ-UHFFFAOYSA-N -1 3 324.739 3.725 20 10 DHCDHM CCc1ccc([C@H]2COCCN2Cc2cc(Cl)ccc2[O-])o1 ZINC000769445366 1023154653 /nfs/dbraw/zinc/15/46/53/1023154653.db2.gz GFHJPBOCKBBYKP-OAHLLOKOSA-N -1 3 321.804 3.775 20 10 DHCDHM Cc1ccccc1[C@@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000769446718 1023156157 /nfs/dbraw/zinc/15/61/57/1023156157.db2.gz SGLGHFQVKWKELC-SFHVURJKSA-N -1 3 317.816 3.928 20 10 DHCDHM [O-]c1c(CN2CCC(OC3CCCC3)CC2)ccc(F)c1F ZINC000876659955 1033117593 /nfs/dbraw/zinc/11/75/93/1033117593.db2.gz KDESTIUUBMVIPF-UHFFFAOYSA-N -1 3 311.372 3.594 20 10 DHCDHM O=C(Nc1ccccc1Cc1ccccc1)c1cccc(O)c1[O-] ZINC000184770738 1023999092 /nfs/dbraw/zinc/99/90/92/1023999092.db2.gz UAHRJMDTYCGMLB-UHFFFAOYSA-N -1 3 319.360 3.941 20 10 DHCDHM CC(C)C[C@H](NC(=O)c1cccc(O)c1[O-])c1cccs1 ZINC000790561072 1024326316 /nfs/dbraw/zinc/32/63/16/1024326316.db2.gz RNPGUDUOUDIANN-LBPRGKRZSA-N -1 3 305.399 3.677 20 10 DHCDHM COc1ccc(NCc2c([O-])cccc2Cl)c(OC)c1OC ZINC000271255656 1024477244 /nfs/dbraw/zinc/47/72/44/1024477244.db2.gz FSHCDHLWEWRRSQ-UHFFFAOYSA-N -1 3 323.776 3.684 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN(CCCO)Cc1ccccc1 ZINC000792167166 1024641134 /nfs/dbraw/zinc/64/11/34/1024641134.db2.gz CIWKDPQERXFYJZ-UHFFFAOYSA-N -1 3 323.795 3.569 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCC[C@@H]1c1ccc[nH]1 ZINC000127459676 1024679616 /nfs/dbraw/zinc/67/96/16/1024679616.db2.gz ZIASVTNFABAOJV-CQSZACIVSA-N -1 3 321.218 3.820 20 10 DHCDHM CC[C@@H](C)Oc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000318723026 1024846052 /nfs/dbraw/zinc/84/60/52/1024846052.db2.gz FNSAIXIRBVBXIW-LLVKDONJSA-N -1 3 301.342 3.527 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc(F)cc2NC(C)C)c([O-])c1O ZINC000780950175 1024860474 /nfs/dbraw/zinc/86/04/74/1024860474.db2.gz PTSCEYOWFTULIA-UHFFFAOYSA-N -1 3 318.348 3.618 20 10 DHCDHM CC(C)(C)Oc1cccc(CNCc2ccc(F)c(F)c2[O-])n1 ZINC000877127158 1033246142 /nfs/dbraw/zinc/24/61/42/1033246142.db2.gz AQLCCMUJMCXVEH-UHFFFAOYSA-N -1 3 322.355 3.533 20 10 DHCDHM C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000804526016 1025338183 /nfs/dbraw/zinc/33/81/83/1025338183.db2.gz IWFOUMFVIVEQGO-CZUORRHYSA-N -1 3 311.381 3.711 20 10 DHCDHM C[C@H](N[C@H]1CCOc2ccc(F)cc21)c1c([O-])cccc1F ZINC000886547309 1025696631 /nfs/dbraw/zinc/69/66/31/1025696631.db2.gz IZXKZPNGMAHXOM-HZMBPMFUSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@H](Nc1ccc(N2CCCC2)nc1)c1c([O-])cccc1F ZINC000886577962 1025716315 /nfs/dbraw/zinc/71/63/15/1025716315.db2.gz DHKXNGMSVDGSQH-LBPRGKRZSA-N -1 3 301.365 3.700 20 10 DHCDHM CCNC(=O)c1ccc(C)c(N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886584116 1025718848 /nfs/dbraw/zinc/71/88/48/1025718848.db2.gz IZBPCTYPBODIOQ-LBPRGKRZSA-N -1 3 316.376 3.763 20 10 DHCDHM Cc1c(N[C@@H](C)c2c([O-])cccc2F)cnn1C1CCOCC1 ZINC000886615423 1025739796 /nfs/dbraw/zinc/73/97/96/1025739796.db2.gz GCYSUGDDGRXJEY-NSHDSACASA-N -1 3 319.380 3.561 20 10 DHCDHM Cc1cc(Br)c([O-])c(CN[C@@H]2CCCC2(F)F)c1 ZINC000808431840 1026301202 /nfs/dbraw/zinc/30/12/02/1026301202.db2.gz NJYPGHWNXKMOLY-LLVKDONJSA-N -1 3 320.177 3.741 20 10 DHCDHM CC1(C)CN(Cc2cccc(Br)c2[O-])[C@@H]1C1CC1 ZINC000811513918 1027028241 /nfs/dbraw/zinc/02/82/41/1027028241.db2.gz VUOOTQRCEQENNE-CQSZACIVSA-N -1 3 310.235 3.775 20 10 DHCDHM O=C(Nc1ccc(Oc2cccnc2)cc1)c1cccc(O)c1[O-] ZINC000811545551 1027031772 /nfs/dbraw/zinc/03/17/72/1027031772.db2.gz HDEFTUAOOQRJCJ-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1ccc(Cl)cn1 ZINC000816560346 1028946559 /nfs/dbraw/zinc/94/65/59/1028946559.db2.gz LSNOIYUOTLSLHN-UHFFFAOYSA-N -1 3 301.148 3.523 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])[C@H]1[C@@H]1CCCO1 ZINC000816613806 1028966328 /nfs/dbraw/zinc/96/63/28/1028966328.db2.gz FVCGCBCXOJHIGO-GJZGRUSLSA-N -1 3 313.800 3.574 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccn(C2CCSCC2)n1 ZINC000865667226 1029968903 /nfs/dbraw/zinc/96/89/03/1029968903.db2.gz BDCTYWREIARFKT-UHFFFAOYSA-N -1 3 323.849 3.922 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1cccc(OCC(F)F)n1 ZINC000777521873 1030089172 /nfs/dbraw/zinc/08/91/72/1030089172.db2.gz VLXZXFJFPYLCGG-UHFFFAOYSA-N -1 3 314.719 3.697 20 10 DHCDHM Cc1cc([C@H]2CCCN2Cc2cc(Cl)c(C)cc2[O-])no1 ZINC000824575697 1030584989 /nfs/dbraw/zinc/58/49/89/1030584989.db2.gz NDQGDZPSHYIYKC-OAHLLOKOSA-N -1 3 306.793 3.988 20 10 DHCDHM CC[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccccc1F ZINC000844394817 1031097680 /nfs/dbraw/zinc/09/76/80/1031097680.db2.gz YUNQZAYVSIRPDY-HNNXBMFYSA-N -1 3 304.321 3.680 20 10 DHCDHM C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928383637 1031293645 /nfs/dbraw/zinc/29/36/45/1031293645.db2.gz IWCLTIBXNQWNIA-XJKSGUPXSA-N -1 3 311.381 3.506 20 10 DHCDHM CC1(C)CCN(Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144300011 1031440243 /nfs/dbraw/zinc/44/02/43/1031440243.db2.gz NYHCSYUZBGGASX-UHFFFAOYSA-N -1 3 316.214 3.916 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCCCCC1 ZINC001144298792 1031436681 /nfs/dbraw/zinc/43/66/81/1031436681.db2.gz JHAJBGTYORJSLH-UHFFFAOYSA-N -1 3 302.187 3.670 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CC2CCC1CC2 ZINC001144306642 1031455522 /nfs/dbraw/zinc/45/55/22/1031455522.db2.gz KNYJWLXMEZRPCE-UHFFFAOYSA-N -1 3 314.198 3.668 20 10 DHCDHM CCOc1cccc(F)c1CNCc1cccc(Cl)c1[O-] ZINC000898216655 1031977087 /nfs/dbraw/zinc/97/70/87/1031977087.db2.gz ZZEKKDNVMIGYAY-UHFFFAOYSA-N -1 3 309.768 3.873 20 10 DHCDHM [O-]c1c(CN2CCC(CC(F)(F)F)CC2)ccc(F)c1F ZINC000877508220 1033332001 /nfs/dbraw/zinc/33/20/01/1033332001.db2.gz SSISDNMONQCDQB-UHFFFAOYSA-N -1 3 309.278 3.835 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccc(O[C@@H]2CCOC2)cc1 ZINC000152809143 1033543730 /nfs/dbraw/zinc/54/37/30/1033543730.db2.gz OPOGUTJSIOYLJF-CQSZACIVSA-N -1 3 319.788 3.825 20 10 DHCDHM C[C@@H](c1cccnc1)N(C)Cc1c([O-])cccc1Br ZINC000862322971 1033814914 /nfs/dbraw/zinc/81/49/14/1033814914.db2.gz QVLHTHJKGFPJNF-NSHDSACASA-N -1 3 321.218 3.743 20 10 DHCDHM C[C@H](c1cccnc1)N(C)Cc1c([O-])cccc1Br ZINC000862322969 1033816895 /nfs/dbraw/zinc/81/68/95/1033816895.db2.gz QVLHTHJKGFPJNF-LLVKDONJSA-N -1 3 321.218 3.743 20 10 DHCDHM [O-]c1cc(Br)ccc1CN1CC(CC(F)(F)F)C1 ZINC000826113659 1034060469 /nfs/dbraw/zinc/06/04/69/1034060469.db2.gz OCVWKAGLRNKDAZ-UHFFFAOYSA-N -1 3 324.140 3.539 20 10 DHCDHM CCc1ccc([C@H](COC)N[C@H](C)c2ccc(F)cc2[O-])o1 ZINC000185548093 1034558140 /nfs/dbraw/zinc/55/81/40/1034558140.db2.gz LUROQLKHYMCTGT-ABAIWWIYSA-N -1 3 307.365 3.725 20 10 DHCDHM CC(C)(C)c1ccc(NC(=O)c2cccc(O)c2[O-])cc1F ZINC001176441446 1035264972 /nfs/dbraw/zinc/26/49/72/1035264972.db2.gz QHXICEYBCAXOBY-UHFFFAOYSA-N -1 3 303.333 3.787 20 10 DHCDHM C[C@@H]1[C@H](C(F)(F)F)CCCN1Cc1cc(F)cc(F)c1[O-] ZINC001180970704 1035798267 /nfs/dbraw/zinc/79/82/67/1035798267.db2.gz WBKRXVGVKNVVRO-LDYMZIIASA-N -1 3 309.278 3.833 20 10 DHCDHM Cc1nnc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2[O-])s1 ZINC000774357130 1036314457 /nfs/dbraw/zinc/31/44/57/1036314457.db2.gz YZOOLCCHOQMCQR-LURJTMIESA-N -1 3 318.229 3.710 20 10 DHCDHM CC(C)CCO[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC001183093870 1036520645 /nfs/dbraw/zinc/52/06/45/1036520645.db2.gz GLBJIIBSUDJEQV-GFCCVEGCSA-N -1 3 315.816 3.822 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC[C@@](F)(c2ccccc2)C1 ZINC001183410936 1036582120 /nfs/dbraw/zinc/58/21/20/1036582120.db2.gz XSCVFCCKFDIWME-SFHVURJKSA-N -1 3 303.352 3.992 20 10 DHCDHM COc1c([O-])c(CNc2ccc(C)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000774914954 1037214197 /nfs/dbraw/zinc/21/41/97/1037214197.db2.gz OUJGDNCAEUBLDG-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM COc1c([O-])c(CNc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000774926255 1037237366 /nfs/dbraw/zinc/23/73/66/1037237366.db2.gz GZNLPLRYLHMVGW-UHFFFAOYSA-N -1 3 308.721 3.575 20 10 DHCDHM CC(=O)Nc1cc(N[C@@H](C)c2ccc(F)cc2[O-])ccc1C ZINC000170789433 1038964952 /nfs/dbraw/zinc/96/49/52/1038964952.db2.gz BAHPHGOAHYKCSV-NSHDSACASA-N -1 3 302.349 3.971 20 10 DHCDHM Cc1ncc(CNCc2cc(Cl)cc(Cl)c2[O-])s1 ZINC000040997461 183155009 /nfs/dbraw/zinc/15/50/09/183155009.db2.gz UXNULMGMBDQUIS-UHFFFAOYSA-N -1 3 303.214 3.754 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)NC2(c3ccccc3)CC2)c1 ZINC000273345713 130109658 /nfs/dbraw/zinc/10/96/58/130109658.db2.gz ANXXGCFMUXVWRB-CYBMUJFWSA-N -1 3 311.381 3.519 20 10 DHCDHM C[C@@H](N[C@@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273444777 130121711 /nfs/dbraw/zinc/12/17/11/130121711.db2.gz ZRSAEGBVNPWBHC-QMTHXVAHSA-N -1 3 302.330 3.622 20 10 DHCDHM C[C@H](N[C@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273444773 130122478 /nfs/dbraw/zinc/12/24/78/130122478.db2.gz ZRSAEGBVNPWBHC-HZMBPMFUSA-N -1 3 302.330 3.622 20 10 DHCDHM COc1ccc2c(c1)[C@@H](NCc1c([O-])cccc1Cl)CCO2 ZINC000274223971 130220360 /nfs/dbraw/zinc/22/03/60/130220360.db2.gz CEYTYOMTFUNTDX-HNNXBMFYSA-N -1 3 319.788 3.668 20 10 DHCDHM CC[C@H](Nc1ccc(OC2COC2)cc1)c1ccc(F)cc1[O-] ZINC000287297627 131273396 /nfs/dbraw/zinc/27/33/96/131273396.db2.gz DMBDNXIHFOBPPW-KRWDZBQOSA-N -1 3 317.360 3.872 20 10 DHCDHM CC[C@@H](N[C@H](CO)c1ccc(F)cc1)c1cccc(Cl)c1[O-] ZINC000287572616 131288406 /nfs/dbraw/zinc/28/84/06/131288406.db2.gz GXJUNEYQMIOAAZ-HZPDHXFCSA-N -1 3 323.795 3.959 20 10 DHCDHM COc1cc(Cl)cc(CN2CCC[C@H](C(F)(F)F)C2)c1[O-] ZINC000184673379 333363839 /nfs/dbraw/zinc/36/38/39/333363839.db2.gz VZKFYUINZBYEBR-JTQLQIEISA-N -1 3 323.742 3.829 20 10 DHCDHM CC[C@H](C)NC(=O)c1ccc(NCc2cc(F)ccc2[O-])cc1 ZINC000280689147 334119313 /nfs/dbraw/zinc/11/93/13/334119313.db2.gz OFGQCXBVXUBLRA-LBPRGKRZSA-N -1 3 316.376 3.672 20 10 DHCDHM C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000370708656 336891705 /nfs/dbraw/zinc/89/17/05/336891705.db2.gz QKQCKIMFQRKVLT-HIFRSBDPSA-N -1 3 311.381 3.506 20 10 DHCDHM C[C@@H](N[C@H]1COc2c1cccc2Cl)c1ccc(F)cc1[O-] ZINC000375242783 337006468 /nfs/dbraw/zinc/00/64/68/337006468.db2.gz QOIQESFTKJUYEH-OTYXRUKQSA-N -1 3 307.752 3.969 20 10 DHCDHM Cc1cnc(-c2cccc(NC(=O)c3ccc(C)c(O)c3[O-])c2)o1 ZINC000378054186 337065680 /nfs/dbraw/zinc/06/56/80/337065680.db2.gz GEYBXCWMLMQWRO-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM Cc1nc([C@@H]2CCCCN2Cc2cc(Cl)cc(C)c2[O-])no1 ZINC000378445328 337072931 /nfs/dbraw/zinc/07/29/31/337072931.db2.gz SWXHVDIMBNOJSL-AWEZNQCLSA-N -1 3 321.808 3.773 20 10 DHCDHM Cc1coc(-c2cc(NC(=O)c3cccc(O)c3[O-])ccc2C)n1 ZINC000187194129 337263644 /nfs/dbraw/zinc/26/36/44/337263644.db2.gz UJAYLXQAQMAIDR-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM COc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2[O-])c(OC)c1 ZINC000320573585 337598396 /nfs/dbraw/zinc/59/83/96/337598396.db2.gz QWWVTEJUKKQDBS-RYUDHWBXSA-N -1 3 319.376 3.960 20 10 DHCDHM C[C@H](N[C@H]1c2cccc(F)c2O[C@H]1C)c1ccc(F)cc1[O-] ZINC000368482635 525638139 /nfs/dbraw/zinc/63/81/39/525638139.db2.gz NVBWUJYGJREPPQ-XQJJYNOISA-N -1 3 305.324 3.843 20 10 DHCDHM CCSc1cccc(CNCc2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000274446980 535742228 /nfs/dbraw/zinc/74/22/28/535742228.db2.gz PZDQJRYOGCJBAZ-UHFFFAOYSA-N -1 3 318.398 3.702 20 10 DHCDHM C[C@H](c1ccccc1)[N@H+](CCCC(=O)[O-])Cc1ccccc1[O-] ZINC000833548750 605077653 /nfs/dbraw/zinc/07/76/53/605077653.db2.gz MBYFINILXOHGEC-OAHLLOKOSA-N -1 3 313.397 3.820 20 10 DHCDHM C[C@H](c1ccccc1)[N@@H+](CCCC(=O)[O-])Cc1ccccc1[O-] ZINC000833548750 605077660 /nfs/dbraw/zinc/07/76/60/605077660.db2.gz MBYFINILXOHGEC-OAHLLOKOSA-N -1 3 313.397 3.820 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2ccsc2)c1[O-] ZINC000050134123 1017117870 /nfs/dbraw/zinc/11/78/70/1017117870.db2.gz ZTCWEVOAMWGSEP-UHFFFAOYSA-N -1 3 309.818 3.942 20 10 DHCDHM C[C@H](CCc1ccccc1)[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592541266 978428649 /nfs/dbraw/zinc/42/86/49/978428649.db2.gz WJBFEDXQMHITQP-ZIAGYGMSSA-N -1 3 313.397 3.762 20 10 DHCDHM CCC(CC)(C[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-])SC ZINC001595077177 979350911 /nfs/dbraw/zinc/35/09/11/979350911.db2.gz BFOVCKSWRQWQRS-LLVKDONJSA-N -1 3 311.447 3.663 20 10 DHCDHM CCC(CC)(C[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])SC ZINC001595077178 979350991 /nfs/dbraw/zinc/35/09/91/979350991.db2.gz BFOVCKSWRQWQRS-NSHDSACASA-N -1 3 311.447 3.663 20 10 DHCDHM C[C@@H]([NH2+][C@@H](C)Cc1ccccc1F)c1cc(C(=O)[O-])ccc1[O-] ZINC001592896668 979798383 /nfs/dbraw/zinc/79/83/83/979798383.db2.gz RFDKXYYXGGAOMD-NWDGAFQWSA-N -1 3 317.360 3.511 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])[C@@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC001595890913 982921912 /nfs/dbraw/zinc/92/19/12/982921912.db2.gz GCOKVSLFUFAXFH-ZDUSSCGKSA-N -1 3 317.385 3.965 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC001595890913 982921917 /nfs/dbraw/zinc/92/19/17/982921917.db2.gz GCOKVSLFUFAXFH-ZDUSSCGKSA-N -1 3 317.385 3.965 20 10 DHCDHM Cc1ccc(C(=O)N2CCCSc3ccccc32)c([O-])c1O ZINC000780861753 1015776814 /nfs/dbraw/zinc/77/68/14/1015776814.db2.gz UXGRWZVHDHDNHM-UHFFFAOYSA-N -1 3 315.394 3.549 20 10 DHCDHM C[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1cc(C(=O)[O-])ccc1O ZINC001593296760 994698513 /nfs/dbraw/zinc/69/85/13/994698513.db2.gz PTJWBHPKOBJVEC-SUNKGSAMSA-N -1 3 315.369 3.658 20 10 DHCDHM Cc1ncc(CN[C@@H](C)c2cccc(C(F)(F)F)c2[O-])o1 ZINC000840794567 1017037868 /nfs/dbraw/zinc/03/78/68/1017037868.db2.gz LOCWFEDXVJMUOC-QMMMGPOBSA-N -1 3 300.280 3.558 20 10 DHCDHM Cc1ncc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2[O-])o1 ZINC000840794312 1017042743 /nfs/dbraw/zinc/04/27/43/1017042743.db2.gz HDJMWLLRQADSLB-ZETCQYMHSA-N -1 3 301.173 3.846 20 10 DHCDHM O=C(Nc1cnc2cc(Cl)ccc2c1)c1cccc(O)c1[O-] ZINC001148211924 1032372428 /nfs/dbraw/zinc/37/24/28/1032372428.db2.gz CQNAQLWGIIDEMO-UHFFFAOYSA-N -1 3 314.728 3.552 20 10 DHCDHM CC(C)Cn1cccc(NCc2cc3ccccc3cc2[O-])c1=O ZINC001171407050 1032600344 /nfs/dbraw/zinc/60/03/44/1032600344.db2.gz JVIKWSOAOCZFGQ-UHFFFAOYSA-N -1 3 322.408 3.975 20 10 DHCDHM C[C@@H](Nc1ccc2oc(N(C)C)nc2c1)c1ccc(F)cc1[O-] ZINC000186475037 1018830584 /nfs/dbraw/zinc/83/05/84/1018830584.db2.gz OJAJWEMJEACGLL-SNVBAGLBSA-N -1 3 315.348 3.912 20 10 DHCDHM COCc1ccc(NCc2c([O-])cccc2Cl)cc1OC ZINC000858309691 1032837661 /nfs/dbraw/zinc/83/76/61/1032837661.db2.gz GIHKZBDKFHQKNU-UHFFFAOYSA-N -1 3 307.777 3.813 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1nccc2c1CCCC2 ZINC000922467297 1020086403 /nfs/dbraw/zinc/08/64/03/1020086403.db2.gz SJOIYUPPCVNSML-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H](c1ccccn1)C1CC1 ZINC000922584357 1020139168 /nfs/dbraw/zinc/13/91/68/1020139168.db2.gz IQFMHNLJMQBASW-INIZCTEOSA-N -1 3 306.768 3.821 20 10 DHCDHM COc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1NC(C)=O ZINC000186315739 1020235848 /nfs/dbraw/zinc/23/58/48/1020235848.db2.gz WKHYACFHJUVCJE-SNVBAGLBSA-N -1 3 318.348 3.671 20 10 DHCDHM COCCOc1ccccc1N[C@@H](C)c1ccc(F)cc1[O-] ZINC000186426645 1020416141 /nfs/dbraw/zinc/41/61/41/1020416141.db2.gz BSGLZQXLRPHGKD-LBPRGKRZSA-N -1 3 305.349 3.730 20 10 DHCDHM C[C@H](N[C@H]1COc2cccc(F)c21)c1cc(Cl)ccc1[O-] ZINC000368411275 1020695540 /nfs/dbraw/zinc/69/55/40/1020695540.db2.gz NMAVBTNOBQKMCG-ZANVPECISA-N -1 3 307.752 3.969 20 10 DHCDHM CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@H](C)C1 ZINC000282130968 1020867472 /nfs/dbraw/zinc/86/74/72/1020867472.db2.gz BKPGJGNBAMSTEV-BXKDBHETSA-N -1 3 304.217 3.698 20 10 DHCDHM CN(Cc1ccon1)Cc1cc2oc3ccccc3c2cc1[O-] ZINC000739878687 1020919070 /nfs/dbraw/zinc/91/90/70/1020919070.db2.gz GHLLQOZSIMJTJW-UHFFFAOYSA-N -1 3 308.337 3.912 20 10 DHCDHM CN(Cc1ccon1)Cc1c2c(ccc1[O-])oc1c2CCCC1 ZINC000739878410 1020919172 /nfs/dbraw/zinc/91/91/72/1020919172.db2.gz DPIWGWOXDSKNGY-UHFFFAOYSA-N -1 3 312.369 3.637 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccccc2OC(C)(C)C)c([O-])c1O ZINC000182456496 1021663916 /nfs/dbraw/zinc/66/39/16/1021663916.db2.gz QEBGIYMQSHXHEO-UHFFFAOYSA-N -1 3 315.369 3.836 20 10 DHCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])c1cccc(Cl)c1 ZINC000776628429 1022188892 /nfs/dbraw/zinc/18/88/92/1022188892.db2.gz SLPOCAKVSAAUDM-CYBMUJFWSA-N -1 3 305.761 3.632 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1ccc2c(n1)CCCC2 ZINC000767726985 1022787969 /nfs/dbraw/zinc/78/79/69/1022787969.db2.gz FHJBFUSZVZWZCY-UHFFFAOYSA-N -1 3 320.795 3.748 20 10 DHCDHM CN(Cc1nc2ccccc2n1C)Cc1c([O-])cccc1Cl ZINC000125411654 1023535456 /nfs/dbraw/zinc/53/54/56/1023535456.db2.gz KALAENSZBLVEJP-UHFFFAOYSA-N -1 3 315.804 3.564 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCCC2(CCCCC2)CC1 ZINC000787519557 1023800157 /nfs/dbraw/zinc/80/01/57/1023800157.db2.gz GQWWWGQNFORQIM-UHFFFAOYSA-N -1 3 303.402 3.674 20 10 DHCDHM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cccc(O)c1[O-] ZINC000790471224 1024308447 /nfs/dbraw/zinc/30/84/47/1024308447.db2.gz HIFATBPRJDMCGZ-UHFFFAOYSA-N -1 3 313.397 3.668 20 10 DHCDHM CC[C@H](NC1(c2ncccn2)CCC1)c1cc(Cl)ccc1[O-] ZINC000883311447 1024362584 /nfs/dbraw/zinc/36/25/84/1024362584.db2.gz AFAGNDHYPGKMAO-AWEZNQCLSA-N -1 3 317.820 3.956 20 10 DHCDHM COc1c([O-])c(CNc2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000278904190 1024405596 /nfs/dbraw/zinc/40/55/96/1024405596.db2.gz ROFLIQIYJUSHKL-UHFFFAOYSA-N -1 3 302.330 3.538 20 10 DHCDHM COc1ccc(F)cc1CNCc1c([O-])ccc(Cl)c1F ZINC000790987974 1024411141 /nfs/dbraw/zinc/41/11/41/1024411141.db2.gz KABQBVTWORYYTL-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM COCC[C@@H](NCc1c([O-])ccc(Cl)c1F)c1ccco1 ZINC000790989212 1024411311 /nfs/dbraw/zinc/41/13/11/1024411311.db2.gz HPEZFOXBDZPPNV-GFCCVEGCSA-N -1 3 313.756 3.645 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@H]1c2ccccc2CC[C@@H]1F ZINC000883381969 1024413971 /nfs/dbraw/zinc/41/39/71/1024413971.db2.gz XFTPOXBXBKMRIZ-HOCLYGCPSA-N -1 3 307.315 3.786 20 10 DHCDHM Cc1nc(C)c(CNCc2c([O-])ccc(Cl)c2F)s1 ZINC000790974364 1024420162 /nfs/dbraw/zinc/42/01/62/1024420162.db2.gz UDFBJENLABBRDT-UHFFFAOYSA-N -1 3 300.786 3.548 20 10 DHCDHM Cc1ccc2c(c1)[C@@H](NCc1c([O-])ccc(Cl)c1F)CO2 ZINC000790977989 1024422431 /nfs/dbraw/zinc/42/24/31/1024422431.db2.gz WODALRLIDMWLMZ-ZDUSSCGKSA-N -1 3 307.752 3.716 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2ccsc2)C1 ZINC000271164665 1024463031 /nfs/dbraw/zinc/46/30/31/1024463031.db2.gz AUIIJCGSCGIBNT-HNNXBMFYSA-N -1 3 309.818 3.681 20 10 DHCDHM Cc1cccc([C@H]2CCCN2Cc2cc(F)cc(F)c2[O-])n1 ZINC000894031130 1025657661 /nfs/dbraw/zinc/65/76/61/1025657661.db2.gz PHMMIVIOPZVCQA-MRXNPFEDSA-N -1 3 304.340 3.711 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1c([O-])cccc1F ZINC000886561876 1025708842 /nfs/dbraw/zinc/70/88/42/1025708842.db2.gz LPDUWBCMSJDSTI-WDEREUQCSA-N -1 3 304.321 3.851 20 10 DHCDHM C[C@H](Nc1cccc(C(=O)NC2CC2)c1)c1c([O-])cccc1F ZINC000886582670 1025718925 /nfs/dbraw/zinc/71/89/25/1025718925.db2.gz FXSDGGWPHKQYKI-NSHDSACASA-N -1 3 314.360 3.597 20 10 DHCDHM Cc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1C(=O)N(C)C ZINC000886586168 1025723339 /nfs/dbraw/zinc/72/33/39/1025723339.db2.gz MDJSNWLNDMWTRV-LBPRGKRZSA-N -1 3 316.376 3.715 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)N(C)CCO2)c1c([O-])cccc1F ZINC000886586524 1025724290 /nfs/dbraw/zinc/72/42/90/1025724290.db2.gz TUXZSCOQLABTNO-NSHDSACASA-N -1 3 302.349 3.533 20 10 DHCDHM CC[C@H](C)c1nnc([C@H](C)N[C@@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886598644 1025729649 /nfs/dbraw/zinc/72/96/49/1025729649.db2.gz GRTMCZLZYBDFMS-DCAQKATOSA-N -1 3 306.385 3.575 20 10 DHCDHM COC[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1cccc(OC)c1 ZINC000886636775 1025750059 /nfs/dbraw/zinc/75/00/59/1025750059.db2.gz UYPXBYJMKZEFFO-BLLLJJGKSA-N -1 3 319.376 3.578 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@@H]1NCc1c([O-])ccc(Cl)c1F ZINC000808443086 1026286979 /nfs/dbraw/zinc/28/69/79/1026286979.db2.gz AILQHXKTNPQAKY-JDNHERCYSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc(N(C)C)cc1 ZINC000811186692 1026950605 /nfs/dbraw/zinc/95/06/05/1026950605.db2.gz USKQBTKINCVWRJ-NSHDSACASA-N -1 3 318.804 3.603 20 10 DHCDHM Cc1ncc(CN(C)Cc2cc(Cl)c(F)cc2[O-])s1 ZINC000295444785 1027279615 /nfs/dbraw/zinc/27/96/15/1027279615.db2.gz UTYJRZGMGRKHGZ-UHFFFAOYSA-N -1 3 300.786 3.582 20 10 DHCDHM COc1ccc(F)cc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000779055588 1028086569 /nfs/dbraw/zinc/08/65/69/1028086569.db2.gz LCKZWXOIWOMOCX-SECBINFHSA-N -1 3 311.303 3.669 20 10 DHCDHM Cc1ccn(C2CCN(Cc3c([O-])ccc(Cl)c3F)CC2)n1 ZINC000369291704 1028467364 /nfs/dbraw/zinc/46/73/64/1028467364.db2.gz AOWIWYFZYPXALV-UHFFFAOYSA-N -1 3 323.799 3.527 20 10 DHCDHM C[C@H]1Oc2c(cccc2F)[C@@H]1NCc1cccc(Cl)c1[O-] ZINC000369379983 1028480168 /nfs/dbraw/zinc/48/01/68/1028480168.db2.gz QHPZIDVTLDHLPC-YMTOWFKASA-N -1 3 307.752 3.797 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N(Cc1ccco1)Cc1ccccc1 ZINC000188140239 1028495404 /nfs/dbraw/zinc/49/54/04/1028495404.db2.gz KMWQQYJEYKGBKN-UHFFFAOYSA-N -1 3 323.348 3.533 20 10 DHCDHM COc1ccc(N[C@@H](C)c2cccc(C(F)(F)F)c2[O-])nc1 ZINC000815606923 1028581989 /nfs/dbraw/zinc/58/19/89/1028581989.db2.gz KMURWCQHQIATPW-VIFPVBQESA-N -1 3 312.291 3.988 20 10 DHCDHM CN(CCC(F)(F)F)Cc1c([O-])cccc1Br ZINC000707165784 1028888508 /nfs/dbraw/zinc/88/85/08/1028888508.db2.gz KQDHHQLQERYQNP-UHFFFAOYSA-N -1 3 312.129 3.539 20 10 DHCDHM Cc1cc([C@@H]2CCCN2Cc2cc(Cl)c(F)cc2[O-])on1 ZINC000816492878 1028895932 /nfs/dbraw/zinc/89/59/32/1028895932.db2.gz HQGQNTUJRGMLOW-ZDUSSCGKSA-N -1 3 310.756 3.818 20 10 DHCDHM C[C@H](N[C@@H]1C[C@]1(F)c1ccccc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000818355443 1029382489 /nfs/dbraw/zinc/38/24/89/1029382489.db2.gz FXRNOIJHXBNQPS-JECHBYEQSA-N -1 3 316.332 3.588 20 10 DHCDHM C[C@H](N[C@@H]1C[C@@]1(F)c1ccccc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000818355445 1029383721 /nfs/dbraw/zinc/38/37/21/1029383721.db2.gz FXRNOIJHXBNQPS-YMRXKLBXSA-N -1 3 316.332 3.588 20 10 DHCDHM C[C@@H](Nc1ccc(COCCO)cc1)c1ccc(Cl)cc1[O-] ZINC000818361294 1029385357 /nfs/dbraw/zinc/38/53/57/1029385357.db2.gz IITQIVLGHZFBJC-GFCCVEGCSA-N -1 3 321.804 3.728 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1Cc2ccccc2-c2ccccc21 ZINC001144211674 1031328831 /nfs/dbraw/zinc/32/88/31/1031328831.db2.gz CZBBUCUPRFFQJA-UHFFFAOYSA-N -1 3 317.344 3.925 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCC12CCCC2 ZINC001144293744 1031432388 /nfs/dbraw/zinc/43/23/88/1031432388.db2.gz SISAAEMOAKTDEF-UHFFFAOYSA-N -1 3 314.198 3.812 20 10 DHCDHM Cc1csc(C(C)(C)NCc2cc(Cl)c(F)cc2[O-])n1 ZINC000293511456 1031494687 /nfs/dbraw/zinc/49/46/87/1031494687.db2.gz CFHSPHWSOLWIQH-UHFFFAOYSA-N -1 3 314.813 3.975 20 10 DHCDHM Cc1cnc([C@H](C)NCc2cc(Cl)c(F)cc2[O-])s1 ZINC000293647659 1031556163 /nfs/dbraw/zinc/55/61/63/1031556163.db2.gz ONFVQSAKTYLJLZ-QMMMGPOBSA-N -1 3 300.786 3.800 20 10 DHCDHM Cc1nnsc1CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000293846088 1031654850 /nfs/dbraw/zinc/65/48/50/1031654850.db2.gz XCBXDPUFMVBCDL-LURJTMIESA-N -1 3 318.229 3.710 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@]2(CC2(F)F)C1 ZINC000846105811 1031878220 /nfs/dbraw/zinc/87/82/20/1031878220.db2.gz YPYMCFKEHVCBTA-CYBMUJFWSA-N -1 3 305.727 3.806 20 10 DHCDHM Cc1ccc([C@@H]2CCCN2Cc2cc(F)c(F)cc2[O-])cn1 ZINC001142527415 1031910732 /nfs/dbraw/zinc/91/07/32/1031910732.db2.gz UDLFAGURVUVYOH-INIZCTEOSA-N -1 3 304.340 3.711 20 10 DHCDHM CCc1noc(CC)c1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000187753808 1034728077 /nfs/dbraw/zinc/72/80/77/1034728077.db2.gz MGNSPNWOWPNAOZ-SECBINFHSA-N -1 3 310.344 3.634 20 10 DHCDHM Cc1ccn2cc(CNCc3c([O-])cc(C)cc3Cl)nc2c1 ZINC001177733234 1035390443 /nfs/dbraw/zinc/39/04/43/1035390443.db2.gz IPCDCUDFBADWTA-UHFFFAOYSA-N -1 3 315.804 3.600 20 10 DHCDHM Cc1oc(C(C)(C)C)cc1C(=O)NCc1c([O-])cccc1F ZINC001178412634 1035428838 /nfs/dbraw/zinc/42/88/38/1035428838.db2.gz CGFYPYKTOSPLSP-UHFFFAOYSA-N -1 3 305.349 3.660 20 10 DHCDHM COc1c(Cl)cccc1CNCc1cc(F)cc(F)c1[O-] ZINC001179690486 1035489700 /nfs/dbraw/zinc/48/97/00/1035489700.db2.gz HXCXPUGIPYAKSL-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(CC(F)F)CC2CCC2)c1[O-] ZINC000761720860 1036004289 /nfs/dbraw/zinc/00/42/89/1036004289.db2.gz KTBXPBMJVZYUSV-UHFFFAOYSA-N -1 3 315.335 3.601 20 10 DHCDHM CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccccc1[O-] ZINC000914506974 1036035476 /nfs/dbraw/zinc/03/54/76/1036035476.db2.gz WLEIBRUENWWJNO-UHFFFAOYSA-N -1 3 312.413 3.509 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(C)cc1O ZINC001195154278 1036160329 /nfs/dbraw/zinc/16/03/29/1036160329.db2.gz WTKWRYVLSMBCQJ-UHFFFAOYSA-N -1 3 319.426 3.933 20 10 DHCDHM CC(C)OC1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775664153 1036287580 /nfs/dbraw/zinc/28/75/80/1036287580.db2.gz UATLMKUDRCIGOC-UHFFFAOYSA-N -1 3 301.789 3.574 20 10 DHCDHM COCCOc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000083607966 192375711 /nfs/dbraw/zinc/37/57/11/192375711.db2.gz HOFQWQAHQNEJTC-UHFFFAOYSA-N -1 3 307.777 3.683 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)c2ccccn2)c1[O-] ZINC000091703526 193093680 /nfs/dbraw/zinc/09/36/80/193093680.db2.gz RESCICKBBYFGNQ-NSHDSACASA-N -1 3 318.804 3.836 20 10 DHCDHM COc1ccc(CN(C)Cc2ccccc2[O-])c(Cl)c1OC ZINC000091974687 193134913 /nfs/dbraw/zinc/13/49/13/193134913.db2.gz DKRKVKUMBTXCLD-UHFFFAOYSA-N -1 3 321.804 3.695 20 10 DHCDHM CC[C@H](NCc1csc([C@@H](C)OC)n1)c1ccc(F)cc1[O-] ZINC000285937445 131210958 /nfs/dbraw/zinc/21/09/58/131210958.db2.gz FNTSCQJOWNEMDD-YGRLFVJLSA-N -1 3 324.421 3.936 20 10 DHCDHM CC1(C)C[C@H](O)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000295243059 335134481 /nfs/dbraw/zinc/13/44/81/335134481.db2.gz PKBZZRDSQAVCNF-GFCCVEGCSA-N -1 3 318.244 3.682 20 10 DHCDHM Cc1nn(C)c(C)c1N[C@@H](C)c1cc(Br)ccc1[O-] ZINC000273472572 334047856 /nfs/dbraw/zinc/04/78/56/334047856.db2.gz SDPFLYWORDTANL-QMMMGPOBSA-N -1 3 324.222 3.678 20 10 DHCDHM CC(C)[C@@H](NCc1ccccc1[O-])c1nc(-c2ccccc2)no1 ZINC000368851109 336853996 /nfs/dbraw/zinc/85/39/96/336853996.db2.gz OLXAOLWNIDWSIE-QGZVFWFLSA-N -1 3 323.396 3.929 20 10 DHCDHM Cc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c([O-])c1O ZINC000371649882 336909974 /nfs/dbraw/zinc/90/99/74/336909974.db2.gz IOHHAQHJCYKULF-OFAQMXQXSA-N -1 3 323.392 3.724 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]1c1ccncc1 ZINC000377692530 337058426 /nfs/dbraw/zinc/05/84/26/337058426.db2.gz JDIPYTDWXIGRLF-CQSZACIVSA-N -1 3 306.768 3.917 20 10 DHCDHM C[C@@H]1Oc2cc(F)ccc2[C@@H]1NCc1cccc(Cl)c1[O-] ZINC000377835606 337062203 /nfs/dbraw/zinc/06/22/03/337062203.db2.gz VIRKNJQBPGWCDC-BJOHPYRUSA-N -1 3 307.752 3.797 20 10 DHCDHM CO[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000378636942 337077393 /nfs/dbraw/zinc/07/73/93/337077393.db2.gz YKMXGDQMQKAIEI-LBPRGKRZSA-N -1 3 304.217 3.700 20 10 DHCDHM CC[C@H](N[C@@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1[O-] ZINC000183339131 337191286 /nfs/dbraw/zinc/19/12/86/337191286.db2.gz DLODATFYCJUOHX-YOEHRIQHSA-N -1 3 322.412 3.775 20 10 DHCDHM C[C@@H](NCc1ncc(-c2ccccc2)cn1)c1cc(F)ccc1[O-] ZINC000186052901 337253218 /nfs/dbraw/zinc/25/32/18/337253218.db2.gz SJQAMOIUCAUPTP-CYBMUJFWSA-N -1 3 323.371 3.839 20 10 DHCDHM C[C@H](Nc1ccc2c(c1)CCCC(=O)N2)c1ccc(F)cc1[O-] ZINC000186445029 337256119 /nfs/dbraw/zinc/25/61/19/337256119.db2.gz KNNHACATTUOLLH-NSHDSACASA-N -1 3 314.360 3.979 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)CCCC(=O)N2)c1ccc(F)cc1[O-] ZINC000186445046 337256286 /nfs/dbraw/zinc/25/62/86/337256286.db2.gz KNNHACATTUOLLH-LLVKDONJSA-N -1 3 314.360 3.979 20 10 DHCDHM C[C@H](N[C@@H]1COc2cc(F)cc(F)c21)c1ccc(F)cc1[O-] ZINC000368211157 525585828 /nfs/dbraw/zinc/58/58/28/525585828.db2.gz BYJDMBDNQFSELL-ISVAXAHUSA-N -1 3 309.287 3.594 20 10 DHCDHM C[C@@H](N[C@@H]1CCOc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000191185774 525648057 /nfs/dbraw/zinc/64/80/57/525648057.db2.gz IUJYNFUFRIEVDD-QMTHXVAHSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](N[C@@H]1COc2cc(F)cc(F)c21)c1ccc(F)cc1[O-] ZINC000368211156 525652249 /nfs/dbraw/zinc/65/22/49/525652249.db2.gz BYJDMBDNQFSELL-AMIZOPFISA-N -1 3 309.287 3.594 20 10 DHCDHM CC[C@@H](NCc1nccn1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000287615176 535806566 /nfs/dbraw/zinc/80/65/66/535806566.db2.gz JMHFIKPZSFKDTA-GFCCVEGCSA-N -1 3 314.216 3.673 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])Cc1ccc(F)cc1C(=O)[O-] ZINC000737020941 600099170 /nfs/dbraw/zinc/09/91/70/600099170.db2.gz OBWNTBODGMNTFK-UHFFFAOYSA-N -1 3 317.360 3.642 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])Cc1ccc(F)cc1C(=O)[O-] ZINC000737020941 600099174 /nfs/dbraw/zinc/09/91/74/600099174.db2.gz OBWNTBODGMNTFK-UHFFFAOYSA-N -1 3 317.360 3.642 20 10 DHCDHM O=C([O-])c1ccoc1C[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000740249236 600149032 /nfs/dbraw/zinc/14/90/32/600149032.db2.gz SGNXHALKYQOXOM-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM O=C([O-])c1ccoc1C[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000740249236 600149036 /nfs/dbraw/zinc/14/90/36/600149036.db2.gz SGNXHALKYQOXOM-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM CC(C)[N@H+](CCC(=O)[O-])Cc1cc(-c2ccccc2)ccc1[O-] ZINC000833496903 604643954 /nfs/dbraw/zinc/64/39/54/604643954.db2.gz MDYNPKJXYJOPOI-UHFFFAOYSA-N -1 3 313.397 3.744 20 10 DHCDHM CC(C)[N@@H+](CCC(=O)[O-])Cc1cc(-c2ccccc2)ccc1[O-] ZINC000833496903 604643957 /nfs/dbraw/zinc/64/39/57/604643957.db2.gz MDYNPKJXYJOPOI-UHFFFAOYSA-N -1 3 313.397 3.744 20 10 DHCDHM Cc1ccc(C(=O)Nc2cc(C(F)F)ccc2F)c([O-])c1O ZINC001144940468 1032071551 /nfs/dbraw/zinc/07/15/51/1032071551.db2.gz SPUPRCLEIAGNKR-UHFFFAOYSA-N -1 3 311.259 3.735 20 10 DHCDHM CC1(C)CCN(Cc2cc(Br)cc(F)c2[O-])CC1 ZINC000715714137 1018949710 /nfs/dbraw/zinc/94/97/10/1018949710.db2.gz VUBOEOVTSRMYRV-UHFFFAOYSA-N -1 3 316.214 3.916 20 10 DHCDHM CC(C)(CCC(=O)[O-])[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC001590665444 990367480 /nfs/dbraw/zinc/36/74/80/990367480.db2.gz OWUTWKNPXATNAP-UHFFFAOYSA-N -1 3 313.397 3.792 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593233763 994394344 /nfs/dbraw/zinc/39/43/44/994394344.db2.gz UGBFQSLSPYIGEP-MGPLVRAMSA-N -1 3 315.344 3.568 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001148213892 1032372697 /nfs/dbraw/zinc/37/26/97/1032372697.db2.gz MPUQZOQHPIADCB-MRXNPFEDSA-N -1 3 322.364 3.556 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccccc2NC(C)(C)C)c([O-])c1O ZINC000760523714 1032603735 /nfs/dbraw/zinc/60/37/35/1032603735.db2.gz HMUOMJRKQHHWHA-UHFFFAOYSA-N -1 3 314.385 3.869 20 10 DHCDHM Cc1cccc([C@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1C ZINC000185724659 1017131130 /nfs/dbraw/zinc/13/11/30/1017131130.db2.gz ATCFUDMPXJEMBW-MRXNPFEDSA-N -1 3 311.381 3.692 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000928712615 1017699792 /nfs/dbraw/zinc/69/97/92/1017699792.db2.gz URXKTVYZDRQCLL-NXEZZACHSA-N -1 3 319.298 3.516 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000928712620 1017699882 /nfs/dbraw/zinc/69/98/82/1017699882.db2.gz URXKTVYZDRQCLL-VHSXEESVSA-N -1 3 319.298 3.516 20 10 DHCDHM [O-]c1cccc(Br)c1CNC1(C(F)F)CCCC1 ZINC000858165246 1032791067 /nfs/dbraw/zinc/79/10/67/1032791067.db2.gz PXKAIJBSWWRQFO-UHFFFAOYSA-N -1 3 320.177 3.822 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Br)cc(F)c2[O-])[C@@H](C)C1 ZINC000715714127 1018950504 /nfs/dbraw/zinc/95/05/04/1018950504.db2.gz VQUKDHIZYCEVRX-ZJUUUORDSA-N -1 3 316.214 3.914 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN[C@@H]1c2ccccc2OC[C@@H]1F ZINC000922525275 1020113535 /nfs/dbraw/zinc/11/35/35/1020113535.db2.gz KWNNJLLNSDVEDS-XJKSGUPXSA-N -1 3 307.752 3.607 20 10 DHCDHM C[C@H](Nc1cncc(Br)c1)c1ccc(F)cc1[O-] ZINC000186360443 1020262610 /nfs/dbraw/zinc/26/26/10/1020262610.db2.gz VNOCHQNOQBCRMK-QMMMGPOBSA-N -1 3 311.154 3.862 20 10 DHCDHM COCCOCc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000378897952 1020523132 /nfs/dbraw/zinc/52/31/32/1020523132.db2.gz AYSSQICHRSNPQS-UHFFFAOYSA-N -1 3 321.804 3.821 20 10 DHCDHM CCCN1C(=O)C2(CCCCC2)N[C@H]1c1cc(Cl)ccc1[O-] ZINC000742441999 1021121487 /nfs/dbraw/zinc/12/14/87/1021121487.db2.gz BNDKDHBTQIUUIC-OAHLLOKOSA-N -1 3 322.836 3.589 20 10 DHCDHM COc1ccc(NCc2cc(Cl)c3cccnc3c2[O-])nc1 ZINC001168524539 1021772164 /nfs/dbraw/zinc/77/21/64/1021772164.db2.gz SQJBBYDTSOBWES-UHFFFAOYSA-N -1 3 315.760 3.610 20 10 DHCDHM O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)c1cccc(O)c1[O-] ZINC000776617138 1022156876 /nfs/dbraw/zinc/15/68/76/1022156876.db2.gz SOIWCYOBLGHRBA-HNNXBMFYSA-N -1 3 317.772 3.632 20 10 DHCDHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(O)c(C)c1 ZINC000776748633 1022498044 /nfs/dbraw/zinc/49/80/44/1022498044.db2.gz VHTGGMJDDZULQY-UHFFFAOYSA-N -1 3 319.426 3.626 20 10 DHCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])CC[C@H](C(F)(F)F)O1 ZINC000877824981 1033475762 /nfs/dbraw/zinc/47/57/62/1033475762.db2.gz WAMJWXRBTODBDI-BXKDBHETSA-N -1 3 323.742 3.587 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](C2CCCCC2)C1 ZINC000856305229 1022791552 /nfs/dbraw/zinc/79/15/52/1022791552.db2.gz MNEIKXNIWQZGLP-CQSZACIVSA-N -1 3 303.402 3.530 20 10 DHCDHM CCc1nc([C@H](C)NCc2cc(F)cc(C(C)=O)c2[O-])cs1 ZINC000184718454 1023084274 /nfs/dbraw/zinc/08/42/74/1023084274.db2.gz ZPVMRYITWJGOCJ-VIFPVBQESA-N -1 3 322.405 3.604 20 10 DHCDHM Cc1ccc2c(c1)nc(CNCc1c([O-])cccc1Cl)n2C ZINC000769554928 1023179462 /nfs/dbraw/zinc/17/94/62/1023179462.db2.gz GCPJPKWWCAWHBZ-UHFFFAOYSA-N -1 3 315.804 3.531 20 10 DHCDHM C[S@](=O)c1ccc(NCc2c([O-])cccc2Cl)cc1F ZINC000770427683 1023310196 /nfs/dbraw/zinc/31/01/96/1023310196.db2.gz CIBSRROFPFDVOV-FQEVSTJZSA-N -1 3 313.781 3.534 20 10 DHCDHM C[S@@](=O)c1ccc(NCc2c([O-])cccc2Cl)cc1F ZINC000770427688 1023310657 /nfs/dbraw/zinc/31/06/57/1023310657.db2.gz CIBSRROFPFDVOV-HXUWFJFHSA-N -1 3 313.781 3.534 20 10 DHCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1cc2ccccc2s1 ZINC000785835394 1023623944 /nfs/dbraw/zinc/62/39/44/1023623944.db2.gz SDZKGCJOAQHAKW-JTQLQIEISA-N -1 3 313.378 3.804 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H](OCC2CC2)C1 ZINC000792179069 1024643319 /nfs/dbraw/zinc/64/33/19/1024643319.db2.gz FOCXEJOFLZRHPZ-LBPRGKRZSA-N -1 3 313.800 3.576 20 10 DHCDHM C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000793232602 1024948280 /nfs/dbraw/zinc/94/82/80/1024948280.db2.gz ZIPYVUYQYIQKNB-GMSGAONNSA-N -1 3 311.706 3.957 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCS[C@H](C)[C@H]2C)c1[O-] ZINC000135821161 1025286012 /nfs/dbraw/zinc/28/60/12/1025286012.db2.gz IXVWDJHMONQPJY-MWLCHTKSSA-N -1 3 313.850 3.574 20 10 DHCDHM C[C@H]1CC[C@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000804526017 1025339098 /nfs/dbraw/zinc/33/90/98/1025339098.db2.gz IWFOUMFVIVEQGO-XJKSGUPXSA-N -1 3 311.381 3.711 20 10 DHCDHM C[C@H]1C[C@@H](c2cccnc2)N(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877341940 1033287073 /nfs/dbraw/zinc/28/70/73/1033287073.db2.gz HLWRKUSIBLDTBX-NHYWBVRUSA-N -1 3 304.340 3.649 20 10 DHCDHM CC(C)(NCc1cc([N+](=O)[O-])ccc1[O-])c1ccc(F)cc1F ZINC000886349849 1025599430 /nfs/dbraw/zinc/59/94/30/1025599430.db2.gz BHLYPRLPQMVOBX-UHFFFAOYSA-N -1 3 322.311 3.604 20 10 DHCDHM COc1ccc2c(c1)OCC[C@H]2N[C@H](C)c1c([O-])cccc1F ZINC000886533142 1025680878 /nfs/dbraw/zinc/68/08/78/1025680878.db2.gz VTKXNEXZWSAXFD-IAQYHMDHSA-N -1 3 317.360 3.714 20 10 DHCDHM COc1cccc2c1OCC[C@@H]2N[C@H](C)c1c([O-])cccc1F ZINC000886547972 1025694776 /nfs/dbraw/zinc/69/47/76/1025694776.db2.gz VLIZJOFZUKLGRF-RISCZKNCSA-N -1 3 317.360 3.714 20 10 DHCDHM COc1ccccc1C1(N[C@@H](C)c2c([O-])cccc2F)CC1 ZINC000886630008 1025751573 /nfs/dbraw/zinc/75/15/73/1025751573.db2.gz SJUGVGGKIPZYSO-LBPRGKRZSA-N -1 3 301.361 3.880 20 10 DHCDHM C[C@@H](NCc1cnccc1C(F)(F)F)c1c([O-])cccc1F ZINC000886639930 1025753416 /nfs/dbraw/zinc/75/34/16/1025753416.db2.gz NWJJACFDRZDIAA-SECBINFHSA-N -1 3 314.282 3.796 20 10 DHCDHM C[C@H](Nc1cnn(CC(F)F)c1)c1ccc(Cl)cc1[O-] ZINC000841750543 1026082150 /nfs/dbraw/zinc/08/21/50/1026082150.db2.gz RWNBDHMVRGKKPH-QMMMGPOBSA-N -1 3 301.724 3.680 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CC(c2ccccc2F)C1 ZINC000812790672 1027407115 /nfs/dbraw/zinc/40/71/15/1027407115.db2.gz CTIHUGXCNHCCPH-UHFFFAOYSA-N -1 3 309.743 3.923 20 10 DHCDHM CC[C@@H](N[C@@H]1COc2cccc(F)c21)c1ccc(F)cc1[O-] ZINC000367620535 1028216004 /nfs/dbraw/zinc/21/60/04/1028216004.db2.gz YFCUKPDANWSEQX-ZIAGYGMSSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](NCc1cscn1)c1cccc(C(F)(F)F)c1[O-] ZINC000815571348 1028564331 /nfs/dbraw/zinc/56/43/31/1028564331.db2.gz BDACQBRIMHUQOQ-MRVPVSSYSA-N -1 3 302.321 3.718 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H](OCC2CC2)C1 ZINC000816574908 1028952772 /nfs/dbraw/zinc/95/27/72/1028952772.db2.gz WJMNMDUQIZLULA-CYBMUJFWSA-N -1 3 313.800 3.576 20 10 DHCDHM CCc1nocc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000816612699 1028965585 /nfs/dbraw/zinc/96/55/85/1028965585.db2.gz WJPNJFYAMLQZRE-UHFFFAOYSA-N -1 3 301.173 3.539 20 10 DHCDHM [O-]c1c(CNCc2nccc(C(F)F)n2)ccc2ccccc21 ZINC000816612185 1028966044 /nfs/dbraw/zinc/96/60/44/1028966044.db2.gz IPDWQXZMLFCGSI-UHFFFAOYSA-N -1 3 315.323 3.563 20 10 DHCDHM C[C@@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1cc2ccccc2o1 ZINC000190625942 1029089409 /nfs/dbraw/zinc/08/94/09/1029089409.db2.gz RFFWIGSVRKBLBT-LLVKDONJSA-N -1 3 312.325 3.897 20 10 DHCDHM C[C@H](NCc1nc2c(s1)CCCC2)c1cc(F)cc(F)c1[O-] ZINC000926919001 1030991850 /nfs/dbraw/zinc/99/18/50/1030991850.db2.gz LPPBEOSIGWHHDU-VIFPVBQESA-N -1 3 324.396 3.857 20 10 DHCDHM Cc1noc(-c2ccccc2)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000123831039 1031352282 /nfs/dbraw/zinc/35/22/82/1031352282.db2.gz BCUGYDVKIGNLHC-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM CN(C)c1ccc(CNCc2cccc([O-])c2Cl)cc1F ZINC000293487127 1031487439 /nfs/dbraw/zinc/48/74/39/1031487439.db2.gz GHBURLKDKWYUGI-UHFFFAOYSA-N -1 3 308.784 3.541 20 10 DHCDHM CC[C@H](NCc1ccc(Br)cc1[O-])C(F)(F)F ZINC000825657576 1031705117 /nfs/dbraw/zinc/70/51/17/1031705117.db2.gz GRWWEORGMZRUCE-JTQLQIEISA-N -1 3 312.129 3.585 20 10 DHCDHM COc1ccccc1[C@H](C)N(C)Cc1cc(F)c(F)cc1[O-] ZINC001142527512 1031910828 /nfs/dbraw/zinc/91/08/28/1031910828.db2.gz XKWMBDZIFALVLG-NSHDSACASA-N -1 3 307.340 3.872 20 10 DHCDHM [O-]c1cc(F)c(F)cc1CN1CC=C(c2ccccc2)CC1 ZINC001142527420 1031911246 /nfs/dbraw/zinc/91/12/46/1031911246.db2.gz UEADETLECBAQSF-UHFFFAOYSA-N -1 3 301.336 3.960 20 10 DHCDHM CCn1nc(C)c(CN(C)Cc2c([O-])cccc2Cl)c1C ZINC000877664605 1033401654 /nfs/dbraw/zinc/40/16/54/1033401654.db2.gz UKOMBOVBILZHPQ-UHFFFAOYSA-N -1 3 307.825 3.511 20 10 DHCDHM CC(=O)Nc1cc(NCc2c([O-])cccc2Cl)ccc1F ZINC000127305093 1033810671 /nfs/dbraw/zinc/81/06/71/1033810671.db2.gz RGEXPKRQONLVCZ-UHFFFAOYSA-N -1 3 308.740 3.755 20 10 DHCDHM CN=[S@](C)(=O)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000864014003 1034253529 /nfs/dbraw/zinc/25/35/29/1034253529.db2.gz IMARJEAERZDNDF-OAQYLSRUSA-N -1 3 324.833 3.744 20 10 DHCDHM C[C@H](NCc1cc(COC(C)(C)C)on1)c1ccc(F)cc1[O-] ZINC000186831736 1034662648 /nfs/dbraw/zinc/66/26/48/1034662648.db2.gz RDTUVYKMPOIGFW-NSHDSACASA-N -1 3 322.380 3.685 20 10 DHCDHM [O-]c1cc(F)c(F)cc1CN1CCC(OC2CCCC2)CC1 ZINC001180086434 1035590398 /nfs/dbraw/zinc/59/03/98/1035590398.db2.gz IKCHXUQFMOGMFZ-UHFFFAOYSA-N -1 3 311.372 3.594 20 10 DHCDHM Cn1cnc2cc(NCc3cc(Cl)c(F)cc3[O-])ccc21 ZINC000816563823 1035809921 /nfs/dbraw/zinc/80/99/21/1035809921.db2.gz KUXURSJVXNBMKX-UHFFFAOYSA-N -1 3 305.740 3.684 20 10 DHCDHM CN(Cc1c([O-])ccc(Cl)c1F)C1CC(OC(C)(C)C)C1 ZINC001182443478 1036302513 /nfs/dbraw/zinc/30/25/13/1036302513.db2.gz JUSGXARWCHZIKX-UHFFFAOYSA-N -1 3 315.816 3.963 20 10 DHCDHM C[C@@H](NCc1ccc2c(n1)CCCC2)c1cc(F)cc(F)c1[O-] ZINC000774441501 1036333281 /nfs/dbraw/zinc/33/32/81/1036333281.db2.gz JRDHVWHMMNOAFH-LLVKDONJSA-N -1 3 318.367 3.795 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC[C@](F)(c2ccccc2)C1 ZINC001183410934 1036582521 /nfs/dbraw/zinc/58/25/21/1036582521.db2.gz XSCVFCCKFDIWME-GOSISDBHSA-N -1 3 303.352 3.992 20 10 DHCDHM COc1c([O-])c(CNc2cccc(SC)c2)ccc1[N+](=O)[O-] ZINC000774913139 1037209235 /nfs/dbraw/zinc/20/92/35/1037209235.db2.gz GEESESWJMAUSGG-UHFFFAOYSA-N -1 3 320.370 3.643 20 10 DHCDHM Cc1csc(C(C)(C)NCc2cc(Cl)cc(F)c2[O-])n1 ZINC000776174865 1037678914 /nfs/dbraw/zinc/67/89/14/1037678914.db2.gz CHNYVSIJBSYMPF-UHFFFAOYSA-N -1 3 314.813 3.975 20 10 DHCDHM CCc1ccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)cc1 ZINC000775291530 1038195257 /nfs/dbraw/zinc/19/52/57/1038195257.db2.gz LPHMYODXTFAQPB-UHFFFAOYSA-N -1 3 319.426 3.681 20 10 DHCDHM Cc1cc(O)cc(C)c1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190506089 1038330675 /nfs/dbraw/zinc/33/06/75/1038330675.db2.gz GXGTYPYNSPEAHM-UHFFFAOYSA-N -1 3 317.410 3.687 20 10 DHCDHM COc1ccc(OC(F)F)c(CN(C)Cc2ccccc2[O-])c1 ZINC000091956795 193132739 /nfs/dbraw/zinc/13/27/39/193132739.db2.gz SAWUMNZPGXEBCN-UHFFFAOYSA-N -1 3 323.339 3.634 20 10 DHCDHM C[C@@H](N[C@H](CO)c1ccc(F)cc1)c1cc(Cl)ccc1[O-] ZINC000273491769 130128003 /nfs/dbraw/zinc/12/80/03/130128003.db2.gz OJGUBLZLUGGBBD-MEBBXXQBSA-N -1 3 309.768 3.569 20 10 DHCDHM COc1ccc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273576932 130140884 /nfs/dbraw/zinc/14/08/84/130140884.db2.gz MAPJWCDHAFPRLH-NWDGAFQWSA-N -1 3 316.357 3.721 20 10 DHCDHM C[C@H](NCc1ccccc1[O-])c1nc(C(F)(F)F)cs1 ZINC000274663927 130253443 /nfs/dbraw/zinc/25/34/43/130253443.db2.gz WULMVLXQLKWQJK-QMMMGPOBSA-N -1 3 302.321 3.718 20 10 DHCDHM CCSc1cc(CNCc2c([O-])cccc2Cl)ccn1 ZINC000275064870 130289164 /nfs/dbraw/zinc/28/91/64/130289164.db2.gz RQGSPHLDXGMTLI-UHFFFAOYSA-N -1 3 308.834 3.842 20 10 DHCDHM CCOc1ccc(N[C@H](CC)c2ccc(F)cc2[O-])cc1CO ZINC000285996774 131214272 /nfs/dbraw/zinc/21/42/72/131214272.db2.gz HHGATHZFWAVBTG-MRXNPFEDSA-N -1 3 319.376 3.986 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000286148504 131222634 /nfs/dbraw/zinc/22/26/34/131222634.db2.gz NYVYVGCHOXPPAW-USXIJHARSA-N -1 3 323.392 3.506 20 10 DHCDHM CC[C@H](Nc1cc(CCOC)ccn1)c1ccc(F)cc1[O-] ZINC000287357661 131276633 /nfs/dbraw/zinc/27/66/33/131276633.db2.gz HBUVSWPBIIFILI-HNNXBMFYSA-N -1 3 304.365 3.678 20 10 DHCDHM CCCOc1ccc(CN[C@H](C2CC2)C(F)(F)F)c([O-])c1 ZINC000288519261 131329318 /nfs/dbraw/zinc/32/93/18/131329318.db2.gz UMWNRSZFKHWHHU-CQSZACIVSA-N -1 3 303.324 3.612 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC(O)(c2ccccc2)CC1 ZINC000185638460 333211359 /nfs/dbraw/zinc/21/13/59/333211359.db2.gz FXSJLUMFLDKGRU-UHFFFAOYSA-N -1 3 317.816 3.529 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@H](C)c2cc(F)ccc2[O-])cs1 ZINC000273460895 334047232 /nfs/dbraw/zinc/04/72/32/334047232.db2.gz CQDIWLMCQHGBMN-NXEZZACHSA-N -1 3 310.394 3.546 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC(c2ncccc2Cl)CC1 ZINC000372965323 336943727 /nfs/dbraw/zinc/94/37/27/336943727.db2.gz CBVICAZDESBGRR-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM C[C@@H]1Oc2cc(F)ccc2[C@H]1NCc1cccc(Cl)c1[O-] ZINC000377835609 337062052 /nfs/dbraw/zinc/06/20/52/337062052.db2.gz VIRKNJQBPGWCDC-VFZGTOFNSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@H](NCc1cc(F)ccc1[O-])c1nccn1-c1ccccc1 ZINC000377869625 337063097 /nfs/dbraw/zinc/06/30/97/337063097.db2.gz PYPQBBGZXFFSEP-ZDUSSCGKSA-N -1 3 311.360 3.568 20 10 DHCDHM COc1cc(Cl)cc(CN2CCCC[C@H]2c2ncc[nH]2)c1[O-] ZINC000184685577 337199848 /nfs/dbraw/zinc/19/98/48/337199848.db2.gz AJGVPADTXXYBRB-ZDUSSCGKSA-N -1 3 321.808 3.505 20 10 DHCDHM CC(C)Oc1ccc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])cn1 ZINC000191206364 519779697 /nfs/dbraw/zinc/77/96/97/519779697.db2.gz DTGZXXJLQFDKMZ-NSHDSACASA-N -1 3 322.355 3.703 20 10 DHCDHM CCCOc1ncccc1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000191222078 520501685 /nfs/dbraw/zinc/50/16/85/520501685.db2.gz FUSAVLSISVMHSB-NSHDSACASA-N -1 3 322.355 3.705 20 10 DHCDHM CC[C@H](N[C@@H]1CCCn2nc(C(C)C)nc21)c1ccccc1[O-] ZINC000156317428 522716200 /nfs/dbraw/zinc/71/62/00/522716200.db2.gz KNMVURVDZIIFLV-LSDHHAIUSA-N -1 3 314.433 3.683 20 10 DHCDHM O=C(c1ccccc1)C1CCN(Cc2cc(F)ccc2[O-])CC1 ZINC000179900028 526789252 /nfs/dbraw/zinc/78/92/52/526789252.db2.gz SBJZHIKWMHZQEM-UHFFFAOYSA-N -1 3 313.372 3.626 20 10 DHCDHM COCc1ccc([C@H]2CCCN2Cc2cc(F)cc(F)c2[O-])o1 ZINC000894474725 1013383408 /nfs/dbraw/zinc/38/34/08/1013383408.db2.gz DZZCZIVRVZJTNF-OAHLLOKOSA-N -1 3 323.339 3.747 20 10 DHCDHM CN(Cc1ccc(F)cc1)Cc1c([O-])cccc1Br ZINC001140098506 1013430406 /nfs/dbraw/zinc/43/04/06/1013430406.db2.gz CGXLNNOPRHJDLF-UHFFFAOYSA-N -1 3 324.193 3.926 20 10 DHCDHM CC(=O)Nc1cc(NCc2c([O-])cccc2Cl)ccc1C ZINC000083607962 1013986615 /nfs/dbraw/zinc/98/66/15/1013986615.db2.gz XBGZPQCEYZLQIZ-UHFFFAOYSA-N -1 3 304.777 3.925 20 10 DHCDHM C[C@H](CC[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])c1ccccc1 ZINC001592519982 978366135 /nfs/dbraw/zinc/36/61/35/978366135.db2.gz LFVFAXAAQDKTJJ-KGLIPLIRSA-N -1 3 313.397 3.935 20 10 DHCDHM C[C@@H](CCc1ccccc1)[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-] ZINC001592541260 978428291 /nfs/dbraw/zinc/42/82/91/978428291.db2.gz WJBFEDXQMHITQP-KBPBESRZSA-N -1 3 313.397 3.762 20 10 DHCDHM C[C@H](C[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])Cc1cccs1 ZINC001592705712 979172025 /nfs/dbraw/zinc/17/20/25/979172025.db2.gz HNRJHZYVXWEIIX-RYUDHWBXSA-N -1 3 319.426 3.681 20 10 DHCDHM CC[C@@H](c1ccccc1)[N@H+](CC(=O)[O-])Cc1ccc(C)cc1[O-] ZINC001595363234 980779669 /nfs/dbraw/zinc/77/96/69/980779669.db2.gz YXCGHPNILOIBHL-KRWDZBQOSA-N -1 3 313.397 3.739 20 10 DHCDHM CC[C@@H](c1ccccc1)[N@@H+](CC(=O)[O-])Cc1ccc(C)cc1[O-] ZINC001595363234 980779672 /nfs/dbraw/zinc/77/96/72/980779672.db2.gz YXCGHPNILOIBHL-KRWDZBQOSA-N -1 3 313.397 3.739 20 10 DHCDHM [O-]c1cccc(Br)c1CN1Cc2ccccc2C1 ZINC000707172146 1015172794 /nfs/dbraw/zinc/17/27/94/1015172794.db2.gz UGWKCDYTFMPCSD-UHFFFAOYSA-N -1 3 304.187 3.671 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCSC2(CCC2)C1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593232604 994385757 /nfs/dbraw/zinc/38/57/57/994385757.db2.gz OAFWPXFTFVZRIQ-WCQYABFASA-N -1 3 321.442 3.559 20 10 DHCDHM [O-]c1c(CNc2cc(Cl)cnn2)cc(Cl)c2cccnc12 ZINC001168527831 1016767959 /nfs/dbraw/zinc/76/79/59/1016767959.db2.gz MNRWNLMSSGHPNR-UHFFFAOYSA-N -1 3 321.167 3.649 20 10 DHCDHM Nc1ccccc1N(C(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC001148219210 1032374588 /nfs/dbraw/zinc/37/45/88/1032374588.db2.gz WUZCTTYTNISXJK-UHFFFAOYSA-N -1 3 320.348 3.659 20 10 DHCDHM Cc1ccsc1CCCC(=O)NCc1c([O-])cccc1F ZINC000928704807 1017575717 /nfs/dbraw/zinc/57/57/17/1017575717.db2.gz DGMKNMXYTXYZOD-UHFFFAOYSA-N -1 3 307.390 3.540 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1CC1CCCCC1 ZINC000187046281 1018937805 /nfs/dbraw/zinc/93/78/05/1018937805.db2.gz BMXGEBUMEIQZDJ-CQSZACIVSA-N -1 3 303.402 3.673 20 10 DHCDHM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)cc1C ZINC000187062236 1018980245 /nfs/dbraw/zinc/98/02/45/1018980245.db2.gz XCFOWEVSWJFAKQ-UHFFFAOYSA-N -1 3 319.426 3.735 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@@H]1c2ccccc2OC[C@@H]1F ZINC000922519527 1020109181 /nfs/dbraw/zinc/10/91/81/1020109181.db2.gz CMQZUNVXAJLQOQ-XJKSGUPXSA-N -1 3 307.752 3.607 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000179427504 1020350306 /nfs/dbraw/zinc/35/03/06/1020350306.db2.gz VDBAZLKFRIRSDX-QGZVFWFLSA-N -1 3 321.779 3.758 20 10 DHCDHM C[C@@H](N[C@H]1COc2cccc(F)c21)c1cc(Cl)ccc1[O-] ZINC000368411272 1020695274 /nfs/dbraw/zinc/69/52/74/1020695274.db2.gz NMAVBTNOBQKMCG-RNCFNFMXSA-N -1 3 307.752 3.969 20 10 DHCDHM COC1(C)CCN(Cc2cc(Cl)c(Cl)cc2[O-])CC1 ZINC001236792590 1021272014 /nfs/dbraw/zinc/27/20/14/1021272014.db2.gz FOGHAZHPPSVIBC-UHFFFAOYSA-N -1 3 304.217 3.700 20 10 DHCDHM COc1cc([O-])c(CN2CCc3ccsc3C2)c(Cl)c1 ZINC001236800853 1021291937 /nfs/dbraw/zinc/29/19/37/1021291937.db2.gz XXURTPXPYZIIHH-UHFFFAOYSA-N -1 3 309.818 3.674 20 10 DHCDHM [O-]c1ccc(F)c(Cl)c1CN1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001237123492 1021703724 /nfs/dbraw/zinc/70/37/24/1021703724.db2.gz IXJUEMASQCRDRH-DTORHVGOSA-N -1 3 305.727 3.662 20 10 DHCDHM CC[C@H](NCc1cc[nH]n1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775501809 1022624514 /nfs/dbraw/zinc/62/45/14/1022624514.db2.gz LKSFKCYEOFKLTH-NSHDSACASA-N -1 3 300.189 3.663 20 10 DHCDHM Cc1occc1CN(C)Cc1cccc(Br)c1[O-] ZINC000092438678 1022843132 /nfs/dbraw/zinc/84/31/32/1022843132.db2.gz COKPRSDSJXDAEU-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM Cc1ccccc1[C@@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000769444639 1023154208 /nfs/dbraw/zinc/15/42/08/1023154208.db2.gz AJTWUTKEBLYUJN-SFHVURJKSA-N -1 3 317.816 3.928 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCOC[C@@H]1c1ccccc1 ZINC000769504331 1023168432 /nfs/dbraw/zinc/16/84/32/1023168432.db2.gz UHUHTUMGZMQBFK-MRXNPFEDSA-N -1 3 303.789 3.619 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@@H](CO)c1ccsc1 ZINC000769936314 1023250867 /nfs/dbraw/zinc/25/08/67/1023250867.db2.gz XHKCBBMKBPCBBN-LBPRGKRZSA-N -1 3 318.225 3.584 20 10 DHCDHM [O-]c1ccc(F)cc1CN1Cc2cccc(Br)c2C1 ZINC000770664938 1023336323 /nfs/dbraw/zinc/33/63/23/1023336323.db2.gz XPQKAKJUVVXLRZ-UHFFFAOYSA-N -1 3 322.177 3.810 20 10 DHCDHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1cccc(O)c1[O-] ZINC000790649277 1024349793 /nfs/dbraw/zinc/34/97/93/1024349793.db2.gz CGBKCYJJHLFHLT-UHFFFAOYSA-N -1 3 313.397 3.786 20 10 DHCDHM COCCN(Cc1ccccc1)Cc1c([O-])ccc(Cl)c1F ZINC000792156627 1024636788 /nfs/dbraw/zinc/63/67/88/1024636788.db2.gz HTZMLACAWKWACR-UHFFFAOYSA-N -1 3 323.795 3.833 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]1c1ccccn1 ZINC000792162528 1024638741 /nfs/dbraw/zinc/63/87/41/1024638741.db2.gz KIKVUPLIDAZNCD-AWEZNQCLSA-N -1 3 306.768 3.917 20 10 DHCDHM [O-]c1cccc(Br)c1CN1CC(CC(F)(F)F)C1 ZINC000862389160 1024789932 /nfs/dbraw/zinc/78/99/32/1024789932.db2.gz GTLSUJHORUQSCJ-UHFFFAOYSA-N -1 3 324.140 3.539 20 10 DHCDHM C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000793232604 1024949243 /nfs/dbraw/zinc/94/92/43/1024949243.db2.gz ZIPYVUYQYIQKNB-XCBNKYQSSA-N -1 3 311.706 3.957 20 10 DHCDHM Cc1cc([O-])c(CNCc2noc3c2CCCC3)cc1Cl ZINC000825940391 1033266064 /nfs/dbraw/zinc/26/60/64/1033266064.db2.gz VUUAJKACBFUUBM-UHFFFAOYSA-N -1 3 306.793 3.511 20 10 DHCDHM COc1ccc2c(c1)OCC[C@H]2N[C@@H](C)c1c([O-])cccc1F ZINC000886533144 1025682060 /nfs/dbraw/zinc/68/20/60/1025682060.db2.gz VTKXNEXZWSAXFD-XHDPSFHLSA-N -1 3 317.360 3.714 20 10 DHCDHM C[C@@H](NC1(c2ccc3c(c2)OCO3)CC1)c1c([O-])cccc1F ZINC000886576789 1025716597 /nfs/dbraw/zinc/71/65/97/1025716597.db2.gz PDSCTESJVACNHO-LLVKDONJSA-N -1 3 315.344 3.600 20 10 DHCDHM Cc1ccc(C(=O)N(C)C)cc1N[C@@H](C)c1c([O-])cccc1F ZINC000886584688 1025720276 /nfs/dbraw/zinc/72/02/76/1025720276.db2.gz UCONDOCCCCHEOO-LBPRGKRZSA-N -1 3 316.376 3.715 20 10 DHCDHM C[C@H](NCc1ccc2c(n1)CCCC2)c1c([O-])cccc1F ZINC000886601272 1025731504 /nfs/dbraw/zinc/73/15/04/1025731504.db2.gz NYEIITZEZNCWDL-LBPRGKRZSA-N -1 3 300.377 3.656 20 10 DHCDHM C[C@@H](Nc1cccc([C@H]2CCC(=O)N2)c1)c1c([O-])cccc1F ZINC000886626576 1025747012 /nfs/dbraw/zinc/74/70/12/1025747012.db2.gz GHFXAWQQZUHFOG-IAQYHMDHSA-N -1 3 314.360 3.656 20 10 DHCDHM COc1ccc([C@H](C)N[C@H](C)c2c([O-])cccc2F)c(OC)c1 ZINC000886641480 1025755284 /nfs/dbraw/zinc/75/52/84/1025755284.db2.gz KSHNSDRKXRADNU-NWDGAFQWSA-N -1 3 319.376 3.960 20 10 DHCDHM COc1ccc(CNCc2cc(Cl)cc(F)c2[O-])c(F)c1 ZINC001308328579 1025848196 /nfs/dbraw/zinc/84/81/96/1025848196.db2.gz JOQKZEXXUYUPAI-UHFFFAOYSA-N -1 3 313.731 3.622 20 10 DHCDHM [O-]c1ccc(F)cc1C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000809776062 1026609371 /nfs/dbraw/zinc/60/93/71/1026609371.db2.gz RTVWKQYKDLKEPB-UHFFFAOYSA-N -1 3 316.159 3.834 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCC(F)(F)[C@H](C)C2)c1[O-] ZINC000810045302 1026668129 /nfs/dbraw/zinc/66/81/29/1026668129.db2.gz KCHCPRXWNCPCHS-SECBINFHSA-N -1 3 317.763 3.725 20 10 DHCDHM CCO[C@H](C)c1nc(CN(C)Cc2cc(F)ccc2[O-])cs1 ZINC000779022895 1027890852 /nfs/dbraw/zinc/89/08/52/1027890852.db2.gz KSMMQXGVFKCKCN-LLVKDONJSA-N -1 3 324.421 3.717 20 10 DHCDHM CCC1CCC(N(C(=O)c2cccc(O)c2[O-])C2CC2)CC1 ZINC000188278507 1028503105 /nfs/dbraw/zinc/50/31/05/1028503105.db2.gz OYDIUVPSLWVSRC-UHFFFAOYSA-N -1 3 303.402 3.671 20 10 DHCDHM O=C(Nc1cccc(Oc2ccncc2)c1)c1cccc(O)c1[O-] ZINC000188477593 1028514460 /nfs/dbraw/zinc/51/44/60/1028514460.db2.gz DGQSBDZWPSBCKI-UHFFFAOYSA-N -1 3 322.320 3.537 20 10 DHCDHM COCCN(Cc1ccc2ccccc2c1[O-])CC(F)(F)F ZINC000816498140 1028901687 /nfs/dbraw/zinc/90/16/87/1028901687.db2.gz IDYMOEITKFZLSS-UHFFFAOYSA-N -1 3 313.319 3.556 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC(c2ccccn2)CC1 ZINC000816496514 1028902484 /nfs/dbraw/zinc/90/24/84/1028902484.db2.gz MUYPDAUDFDXKJH-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM COc1cccc2c1CCN(Cc1cc(Cl)c(F)cc1[O-])C2 ZINC000816567386 1028948944 /nfs/dbraw/zinc/94/89/44/1028948944.db2.gz ZLCMIEVAEJBAAS-UHFFFAOYSA-N -1 3 321.779 3.752 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H]1c1cccnc1 ZINC000816610630 1028964550 /nfs/dbraw/zinc/96/45/50/1028964550.db2.gz RTFVKAZVYLLDPK-OAHLLOKOSA-N -1 3 306.768 3.917 20 10 DHCDHM C[C@H]1CCCN(Cc2cc(Br)c(F)cc2[O-])C1 ZINC001144299106 1031439131 /nfs/dbraw/zinc/43/91/31/1031439131.db2.gz PKWBEFNLMVUDJD-VIFPVBQESA-N -1 3 302.187 3.526 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCC[C@@H](F)CC1 ZINC001144299030 1031439486 /nfs/dbraw/zinc/43/94/86/1031439486.db2.gz PESFBTHBWMEFFJ-SNVBAGLBSA-N -1 3 320.177 3.618 20 10 DHCDHM Cc1cnc([C@@H](C)NCc2cc(Cl)c(F)cc2[O-])s1 ZINC000293647653 1031556229 /nfs/dbraw/zinc/55/62/29/1031556229.db2.gz ONFVQSAKTYLJLZ-MRVPVSSYSA-N -1 3 300.786 3.800 20 10 DHCDHM [O-]c1cc(F)c(F)cc1CN1CCCC[C@H]1c1cccnc1 ZINC001142520264 1031843958 /nfs/dbraw/zinc/84/39/58/1031843958.db2.gz DXCZGZBPNMLDBC-INIZCTEOSA-N -1 3 304.340 3.793 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@]2(CC2(F)F)C1 ZINC000846103876 1031875744 /nfs/dbraw/zinc/87/57/44/1031875744.db2.gz AXXLRZHTWLXMFY-CYBMUJFWSA-N -1 3 305.727 3.806 20 10 DHCDHM Cc1cc([O-])c(CN[C@@H](C)c2nc(C(C)(C)C)no2)cc1Cl ZINC000825681477 1031876654 /nfs/dbraw/zinc/87/66/54/1031876654.db2.gz SMFKLKBPIJPZNK-JTQLQIEISA-N -1 3 323.824 3.885 20 10 DHCDHM CCCc1nc(C)c(NC(=O)NCc2c([O-])cccc2F)s1 ZINC000930941852 1031990017 /nfs/dbraw/zinc/99/00/17/1031990017.db2.gz OPXJOWIKAQSKPJ-UHFFFAOYSA-N -1 3 323.393 3.570 20 10 DHCDHM C[C@@H](c1ccncc1)N(C)Cc1c([O-])cccc1Br ZINC000862323071 1033815971 /nfs/dbraw/zinc/81/59/71/1033815971.db2.gz RTHGGEBBOPLIOW-NSHDSACASA-N -1 3 321.218 3.743 20 10 DHCDHM CC[C@H](C)[C@H](C(=O)NCc1c([O-])cccc1F)c1ccccc1 ZINC001178412689 1035429167 /nfs/dbraw/zinc/42/91/67/1035429167.db2.gz FCZPKXSBLVWKLI-UGSOOPFHSA-N -1 3 315.388 3.977 20 10 DHCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC001179579532 1035483343 /nfs/dbraw/zinc/48/33/43/1035483343.db2.gz SBSRJEVHBLCAJB-VIFPVBQESA-N -1 3 324.739 3.944 20 10 DHCDHM CC(C)[C@@H](C)C(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001181502216 1035926323 /nfs/dbraw/zinc/92/63/23/1035926323.db2.gz QGSVGUOKBACLPH-SNVBAGLBSA-N -1 3 306.793 3.502 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@@H](Oc2ccccc2)C1 ZINC001182977474 1036499435 /nfs/dbraw/zinc/49/94/35/1036499435.db2.gz FCUFLFGPVVBELS-OAHLLOKOSA-N -1 3 321.779 3.838 20 10 DHCDHM [O-]c1cccc(F)c1CNCc1ccc(OC(F)F)cc1F ZINC001183919625 1036712460 /nfs/dbraw/zinc/71/24/60/1036712460.db2.gz NGUBZLAOTSVPIC-UHFFFAOYSA-N -1 3 315.266 3.562 20 10 DHCDHM O=C1CCC[C@@H]2CN(Cc3cc(Cl)cc(Cl)c3[O-])C[C@H]12 ZINC001203586475 1036824935 /nfs/dbraw/zinc/82/49/35/1036824935.db2.gz OHODLPHRDQWCGA-SKDRFNHKSA-N -1 3 314.212 3.500 20 10 DHCDHM CCN(Cc1ccc([N+](=O)[O-])c(OC)c1[O-])c1ccccc1C ZINC000775106796 1037598545 /nfs/dbraw/zinc/59/85/45/1037598545.db2.gz KDRWHNZCTIOFFJ-UHFFFAOYSA-N -1 3 316.357 3.644 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@@H](C)N[C@@H]2CCCc3occc32)c1 ZINC000273437054 130122854 /nfs/dbraw/zinc/12/28/54/130122854.db2.gz XDTOITOLTNSCCF-IAQYHMDHSA-N -1 3 315.369 3.500 20 10 DHCDHM CC[C@H](NCc1ccn(Cc2ccccc2)n1)c1ccccc1[O-] ZINC000284363275 131074161 /nfs/dbraw/zinc/07/41/61/131074161.db2.gz NEJLIVLZVFKHHO-IBGZPJMESA-N -1 3 321.424 3.878 20 10 DHCDHM CC[C@H](NCc1cn2ccc(C)cc2n1)c1ccc(F)cc1[O-] ZINC000286232802 131225918 /nfs/dbraw/zinc/22/59/18/131225918.db2.gz SXORGHOSISTGFK-INIZCTEOSA-N -1 3 313.376 3.728 20 10 DHCDHM C[C@@H](N[C@@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1[O-] ZINC000287035341 131260846 /nfs/dbraw/zinc/26/08/46/131260846.db2.gz MBIHSRRBJXKUTF-BZNIZROVSA-N -1 3 323.795 3.959 20 10 DHCDHM C[C@H](N[C@H](CCO)c1ccc(Cl)cc1)c1ccc(F)cc1[O-] ZINC000287035345 131260975 /nfs/dbraw/zinc/26/09/75/131260975.db2.gz MBIHSRRBJXKUTF-MEDUHNTESA-N -1 3 323.795 3.959 20 10 DHCDHM CC[C@@H](N[C@@H](CCO)c1ccco1)c1cccc(Cl)c1[O-] ZINC000287842977 131302958 /nfs/dbraw/zinc/30/29/58/131302958.db2.gz WJFHMCXXERXMPR-KGLIPLIRSA-N -1 3 309.793 3.803 20 10 DHCDHM COC[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ccc(C)o1 ZINC000185630144 333210872 /nfs/dbraw/zinc/21/08/72/333210872.db2.gz DOFMKLNRCAKQAI-FZMZJTMJSA-N -1 3 309.793 3.985 20 10 DHCDHM O=[N+]([O-])c1ccc([O-])c(CNCc2cc(C3CC3)ccc2F)c1 ZINC000295177808 335130758 /nfs/dbraw/zinc/13/07/58/335130758.db2.gz VEUSDQQPSVAICY-UHFFFAOYSA-N -1 3 316.332 3.607 20 10 DHCDHM CC[C@@H](c1ccccc1[O-])N1CCn2c(C(C)C)nnc2[C@H]1C ZINC000377633582 337057020 /nfs/dbraw/zinc/05/70/20/337057020.db2.gz VMNGDBRFWFBBGM-HIFRSBDPSA-N -1 3 314.433 3.635 20 10 DHCDHM Cc1nc([C@H]2CCCCN2Cc2cc(Cl)cc(C)c2[O-])no1 ZINC000378445329 337072979 /nfs/dbraw/zinc/07/29/79/337072979.db2.gz SWXHVDIMBNOJSL-CQSZACIVSA-N -1 3 321.808 3.773 20 10 DHCDHM CC(=O)OCCCc1cccc(NCc2cc(F)ccc2[O-])c1 ZINC000188531589 519755993 /nfs/dbraw/zinc/75/59/93/519755993.db2.gz GKDQFNHRVWGQKP-UHFFFAOYSA-N -1 3 317.360 3.639 20 10 DHCDHM CC[C@@H](N[C@H]1CCCn2nc(C(C)C)nc21)c1ccccc1[O-] ZINC000156317769 522947857 /nfs/dbraw/zinc/94/78/57/522947857.db2.gz KNMVURVDZIIFLV-CABCVRRESA-N -1 3 314.433 3.683 20 10 DHCDHM CCn1ncc2c1CCC[C@H]2N[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000364797309 523696889 /nfs/dbraw/zinc/69/68/89/523696889.db2.gz GUTMWPIDYKCBJU-QMTHXVAHSA-N -1 3 321.371 3.615 20 10 DHCDHM C[C@H](N[C@H]1CCOc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000191185790 525626226 /nfs/dbraw/zinc/62/62/26/525626226.db2.gz IUJYNFUFRIEVDD-HZMBPMFUSA-N -1 3 305.324 3.845 20 10 DHCDHM [O-]c1c(F)cccc1CN1CCC[C@H](O)c2cc(F)ccc21 ZINC000365144602 526329167 /nfs/dbraw/zinc/32/91/67/526329167.db2.gz ZWNRFOOVIWTHAS-INIZCTEOSA-N -1 3 305.324 3.504 20 10 DHCDHM CN(Cc1cccc(F)c1)Cc1c([O-])cccc1Br ZINC001140098917 1013433426 /nfs/dbraw/zinc/43/34/26/1013433426.db2.gz SLIDEDCGUNVKPS-UHFFFAOYSA-N -1 3 324.193 3.926 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CN[C@H]1CCc2cccnc21 ZINC000894781136 1013489845 /nfs/dbraw/zinc/48/98/45/1013489845.db2.gz OEHWWBSHEKXOHV-ZDUSSCGKSA-N -1 3 309.196 3.871 20 10 DHCDHM C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)c1cc(C(=O)[O-])ccc1[O-] ZINC001592705709 979171571 /nfs/dbraw/zinc/17/15/71/979171571.db2.gz HNRJHZYVXWEIIX-NWDGAFQWSA-N -1 3 319.426 3.681 20 10 DHCDHM CCC[N@H+](Cc1ccccc1[O-])[C@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC001595890829 982922141 /nfs/dbraw/zinc/92/21/41/982922141.db2.gz GCOKVSLFUFAXFH-CYBMUJFWSA-N -1 3 317.385 3.965 20 10 DHCDHM CCC[N@@H+](Cc1ccccc1[O-])[C@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC001595890829 982922146 /nfs/dbraw/zinc/92/21/46/982922146.db2.gz GCOKVSLFUFAXFH-CYBMUJFWSA-N -1 3 317.385 3.965 20 10 DHCDHM C[C@@H](N[C@H](C)c1ccc(F)cc1F)c1cc(C(=O)[O-])ccc1O ZINC001593354315 994988632 /nfs/dbraw/zinc/98/86/32/994988632.db2.gz MISURDIBVIRIOU-NXEZZACHSA-N -1 3 321.323 3.780 20 10 DHCDHM COCCOCc1cccc(N[C@H](C)c2ccc(F)cc2[O-])c1 ZINC000320584933 1017188193 /nfs/dbraw/zinc/18/81/93/1017188193.db2.gz UEJZNUXZEXTNJE-CYBMUJFWSA-N -1 3 319.376 3.867 20 10 DHCDHM C[C@H]1CCN(Cc2cc(Cl)cc(Br)c2[O-])C1 ZINC000708133894 1017668725 /nfs/dbraw/zinc/66/87/25/1017668725.db2.gz NYAQEDBLBRIVDZ-QMMMGPOBSA-N -1 3 304.615 3.650 20 10 DHCDHM CC(C)N(Cc1ccc(Br)cc1[O-])CC(F)F ZINC000701192812 1018008595 /nfs/dbraw/zinc/00/85/95/1018008595.db2.gz MFXCPVPRIURNLL-UHFFFAOYSA-N -1 3 308.166 3.630 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCCC(F)(F)CC1 ZINC000702770683 1018238850 /nfs/dbraw/zinc/23/88/50/1018238850.db2.gz PYTJGAAEPOFNPP-UHFFFAOYSA-N -1 3 320.177 3.776 20 10 DHCDHM C[C@H]1CCCCN1Cc1cc(Br)cc(F)c1[O-] ZINC000715702490 1018941439 /nfs/dbraw/zinc/94/14/39/1018941439.db2.gz LCXBQZLESRFAST-VIFPVBQESA-N -1 3 302.187 3.668 20 10 DHCDHM [O-]c1c(F)cc(Br)cc1CN1CCCCCC1 ZINC000715705087 1018945428 /nfs/dbraw/zinc/94/54/28/1018945428.db2.gz YTTRWERXZQXUEE-UHFFFAOYSA-N -1 3 302.187 3.670 20 10 DHCDHM Cc1cc([O-])c(CN2CCCC[C@@H]2c2ccnn2C)cc1Cl ZINC000825768512 1032797981 /nfs/dbraw/zinc/79/79/81/1032797981.db2.gz PIFUQVDTNTZRFB-MRXNPFEDSA-N -1 3 319.836 3.815 20 10 DHCDHM CCCNC(=O)c1cccc(N[C@H](C)c2ccc(F)cc2[O-])c1 ZINC000170789094 1019435793 /nfs/dbraw/zinc/43/57/93/1019435793.db2.gz VUAVQPYMXPHPHO-GFCCVEGCSA-N -1 3 316.376 3.844 20 10 DHCDHM CCN(c1ccc(NC(=O)c2cccc(O)c2[O-])cc1)C(C)C ZINC000776328596 1021286936 /nfs/dbraw/zinc/28/69/36/1021286936.db2.gz VXTCWMQZIOJWRL-UHFFFAOYSA-N -1 3 314.385 3.585 20 10 DHCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)cc1 ZINC000776328185 1021287098 /nfs/dbraw/zinc/28/70/98/1021287098.db2.gz ZPXUWWJDLATJIY-CYBMUJFWSA-N -1 3 305.761 3.632 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(COC(C)C)c2)c([O-])c1O ZINC000182232276 1021558771 /nfs/dbraw/zinc/55/87/71/1021558771.db2.gz NRFMIWDYKHMMQF-UHFFFAOYSA-N -1 3 315.369 3.584 20 10 DHCDHM CC[C@H](NCc1nccc(OC)c1F)c1cccc(Cl)c1[O-] ZINC000850536689 1021589214 /nfs/dbraw/zinc/58/92/14/1021589214.db2.gz MIJRELGMLWETAG-LBPRGKRZSA-N -1 3 324.783 3.829 20 10 DHCDHM CC[C@@H](NCc1nccc(OC)c1F)c1cccc(Cl)c1[O-] ZINC000850536688 1021590626 /nfs/dbraw/zinc/59/06/26/1021590626.db2.gz MIJRELGMLWETAG-GFCCVEGCSA-N -1 3 324.783 3.829 20 10 DHCDHM COC[C@H]1CCCCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237078114 1021627542 /nfs/dbraw/zinc/62/75/42/1021627542.db2.gz OFZFRCAMFOPQQW-SNVBAGLBSA-N -1 3 304.217 3.700 20 10 DHCDHM CO[C@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)[C@H](C)C1 ZINC001237087325 1021672518 /nfs/dbraw/zinc/67/25/18/1021672518.db2.gz VCYDDNRFBHROLJ-ZJUUUORDSA-N -1 3 304.217 3.698 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2ccccc2F)C1 ZINC000130742407 1022231000 /nfs/dbraw/zinc/23/10/00/1022231000.db2.gz FNSDBPMSYRUOQI-QGZVFWFLSA-N -1 3 321.779 3.758 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@H](C(F)(F)F)CC2)c(Cl)c1 ZINC000877822147 1033473822 /nfs/dbraw/zinc/47/38/22/1033473822.db2.gz PCFIHBJBCMOWMW-ZDUSSCGKSA-N -1 3 323.742 3.507 20 10 DHCDHM Cc1ccc(CN(C(=O)c2cccc(O)c2[O-])C2CC2)cc1C ZINC000185716130 1022516686 /nfs/dbraw/zinc/51/66/86/1022516686.db2.gz SWAXHAVCPWVOFY-UHFFFAOYSA-N -1 3 311.381 3.519 20 10 DHCDHM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000855213263 1022599174 /nfs/dbraw/zinc/59/91/74/1022599174.db2.gz AYIMNBUHOAATIN-HNNXBMFYSA-N -1 3 311.381 3.692 20 10 DHCDHM [O-]c1c(CN2CCC[C@H]2c2ccc(O)cc2)ccc(F)c1F ZINC000876636256 1033112548 /nfs/dbraw/zinc/11/25/48/1033112548.db2.gz DAPXICNNCFMGBK-HNNXBMFYSA-N -1 3 305.324 3.713 20 10 DHCDHM Cc1nc(C)c([C@H](C)N(C)Cc2ccc(F)c(F)c2[O-])s1 ZINC000876716379 1033127726 /nfs/dbraw/zinc/12/77/26/1033127726.db2.gz ZEJWJANXOFVPLV-VIFPVBQESA-N -1 3 312.385 3.937 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)Nc2cc(F)ccc2C)c1 ZINC000756869865 1024238494 /nfs/dbraw/zinc/23/84/94/1024238494.db2.gz DRQWKSCUBQKCJX-NSHDSACASA-N -1 3 303.333 3.799 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1cccc(OC2CC2)c1F ZINC000883168138 1024266375 /nfs/dbraw/zinc/26/63/75/1024266375.db2.gz QPEDJDHGFVVPKP-UHFFFAOYSA-N -1 3 323.314 3.641 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@@H]1c2ccccc2CC[C@H]1F ZINC000883381967 1024413741 /nfs/dbraw/zinc/41/37/41/1024413741.db2.gz XFTPOXBXBKMRIZ-GDBMZVCRSA-N -1 3 307.315 3.786 20 10 DHCDHM CC[C@](C)(NCc1ccc(F)c(F)c1[O-])c1nc(C)cs1 ZINC000877045167 1033218217 /nfs/dbraw/zinc/21/82/17/1033218217.db2.gz QYPGRXYMBPILGV-HNNXBMFYSA-N -1 3 312.385 3.850 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@H]2C)c1[O-] ZINC000791577743 1024519639 /nfs/dbraw/zinc/51/96/39/1024519639.db2.gz DKBKYDIQWQBPSD-AMIZOPFISA-N -1 3 319.298 3.507 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1cc(C2CC2)ccc1F ZINC001202560868 1024559016 /nfs/dbraw/zinc/55/90/16/1024559016.db2.gz NPOADKHLTWOCHI-UHFFFAOYSA-N -1 3 307.315 3.977 20 10 DHCDHM C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000793232242 1024947577 /nfs/dbraw/zinc/94/75/77/1024947577.db2.gz VCQLPZHHYAVSQO-APPZFPTMSA-N -1 3 311.706 3.957 20 10 DHCDHM COc1ccc(OC)c([C@H](C)N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886491365 1025650391 /nfs/dbraw/zinc/65/03/91/1025650391.db2.gz ASLQXJUNNAGDOS-RYUDHWBXSA-N -1 3 319.376 3.960 20 10 DHCDHM CCCOc1ncccc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886512857 1025668782 /nfs/dbraw/zinc/66/87/82/1025668782.db2.gz OMCBKDBXCDRVCF-LBPRGKRZSA-N -1 3 304.365 3.566 20 10 DHCDHM C[C@@H](NCc1cccc2c1OCCCO2)c1c([O-])cccc1F ZINC000886553705 1025700651 /nfs/dbraw/zinc/70/06/51/1025700651.db2.gz UAXBJQOFPOGRSX-GFCCVEGCSA-N -1 3 317.360 3.543 20 10 DHCDHM C[C@H](Nc1cccc(N2CCCC2=O)c1)c1c([O-])cccc1F ZINC000886564140 1025709993 /nfs/dbraw/zinc/70/99/93/1025709993.db2.gz OEACOHWXMPDKSD-LBPRGKRZSA-N -1 3 314.360 3.831 20 10 DHCDHM COc1ccc(N[C@H](C)c2c([O-])cccc2F)c(OC)c1OC ZINC000886576519 1025716347 /nfs/dbraw/zinc/71/63/47/1025716347.db2.gz IETTUIZMHLJKOW-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM CCOc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1CO ZINC000886583932 1025719065 /nfs/dbraw/zinc/71/90/65/1025719065.db2.gz FZDBAYLXSSSYLN-NSHDSACASA-N -1 3 305.349 3.595 20 10 DHCDHM CC[C@@H](NCc1cn2ccccc2n1)c1cccc(Cl)c1[O-] ZINC000806127994 1025791495 /nfs/dbraw/zinc/79/14/95/1025791495.db2.gz LPMGGJDKRBZCOE-OAHLLOKOSA-N -1 3 315.804 3.934 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCCc2occc2C1 ZINC000809792540 1026629244 /nfs/dbraw/zinc/62/92/44/1026629244.db2.gz ADBHNSUMBMWCRI-UHFFFAOYSA-N -1 3 322.202 3.696 20 10 DHCDHM CN1CCCc2cc(CNCc3cccc([O-])c3Cl)ccc21 ZINC000815121493 1028367260 /nfs/dbraw/zinc/36/72/60/1028367260.db2.gz CEYSOTUDGCEBQO-UHFFFAOYSA-N -1 3 316.832 3.718 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(C)Cc2c(F)cccc2F)c1[O-] ZINC000815169649 1028412902 /nfs/dbraw/zinc/41/29/02/1028412902.db2.gz FGNVSLXADXPFEA-UHFFFAOYSA-N -1 3 323.314 3.644 20 10 DHCDHM C[C@@H](NCc1cccc(F)n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815598620 1028565151 /nfs/dbraw/zinc/56/51/51/1028565151.db2.gz YVSPGHXMJDJWBQ-SECBINFHSA-N -1 3 314.282 3.796 20 10 DHCDHM CC[C@H](NCc1cc(Cl)c(F)cc1[O-])c1nccs1 ZINC000816552411 1028923814 /nfs/dbraw/zinc/92/38/14/1028923814.db2.gz LMULGKDOAWPPSE-NSHDSACASA-N -1 3 300.786 3.882 20 10 DHCDHM [O-]c1cc(Br)ccc1CN1CCC[C@@H]1c1ccc[nH]1 ZINC000824474302 1030561240 /nfs/dbraw/zinc/56/12/40/1030561240.db2.gz MPGSXEOXAOMIFS-CQSZACIVSA-N -1 3 321.218 3.820 20 10 DHCDHM CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1C ZINC000824815794 1030647594 /nfs/dbraw/zinc/64/75/94/1030647594.db2.gz ZSIHSKWVLDDYAZ-ZANVPECISA-N -1 3 304.217 3.556 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@@H](c3ccsc3)C2)cc1Cl ZINC000824894827 1030661108 /nfs/dbraw/zinc/66/11/08/1030661108.db2.gz LFGXGJKCUKXOCM-MRXNPFEDSA-N -1 3 323.845 3.989 20 10 DHCDHM CC[C@@H](NCc1ncc(Cl)s1)c1ccc(F)cc1[O-] ZINC000872113325 1031506471 /nfs/dbraw/zinc/50/64/71/1031506471.db2.gz OHVVJOFMAMHJQM-SNVBAGLBSA-N -1 3 300.786 3.882 20 10 DHCDHM Cc1cc([O-])c([C@@H]2NC(C)(C)C(=O)N2CC(C)(C)C)cc1Cl ZINC000877856661 1033489732 /nfs/dbraw/zinc/48/97/32/1033489732.db2.gz GUQJJTZFMYKXGI-CQSZACIVSA-N -1 3 324.852 3.609 20 10 DHCDHM COc1cc(OC)c(OC)cc1NCc1c([O-])cccc1Cl ZINC000151942070 1033494512 /nfs/dbraw/zinc/49/45/12/1033494512.db2.gz GELAHRPKDQNIBR-UHFFFAOYSA-N -1 3 323.776 3.684 20 10 DHCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CCCC(F)(F)CC2)c1[O-] ZINC000862465981 1033862718 /nfs/dbraw/zinc/86/27/18/1033862718.db2.gz AONGBVPXGJUDKN-UHFFFAOYSA-N -1 3 320.723 3.575 20 10 DHCDHM C[C@H](c1cccnc1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000183727069 1034413480 /nfs/dbraw/zinc/41/34/80/1034413480.db2.gz KBZUQMHNPYXRQP-SNVBAGLBSA-N -1 3 321.764 3.542 20 10 DHCDHM COc1cc(F)c(N[C@H](C)c2ccc(F)cc2[O-])cc1OC ZINC000186362540 1034624346 /nfs/dbraw/zinc/62/43/46/1034624346.db2.gz JEMBPLDWUIDDCN-SECBINFHSA-N -1 3 309.312 3.861 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001178413868 1035429139 /nfs/dbraw/zinc/42/91/39/1035429139.db2.gz ZMLBVCUFAHJFFB-HUUCEWRRSA-N -1 3 313.372 3.731 20 10 DHCDHM Cc1nc2ccccc2c(C)c1C(=O)NCc1c([O-])cccc1F ZINC001178412995 1035429160 /nfs/dbraw/zinc/42/91/60/1035429160.db2.gz JWUOHHJNXSVIIG-UHFFFAOYSA-N -1 3 324.355 3.626 20 10 DHCDHM [O-]c1cc(Cl)ccc1CN1CCO[C@@H](c2ccccc2F)C1 ZINC001180048909 1035564789 /nfs/dbraw/zinc/56/47/89/1035564789.db2.gz YSLJDVVBTRWPKD-QGZVFWFLSA-N -1 3 321.779 3.758 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1cccc(-c2nnco2)c1 ZINC000149170937 1035986149 /nfs/dbraw/zinc/98/61/49/1035986149.db2.gz ZGSBTSGPRAOFOK-UHFFFAOYSA-N -1 3 301.733 3.708 20 10 DHCDHM Cc1c(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)ccc1O ZINC001195155977 1036162013 /nfs/dbraw/zinc/16/20/13/1036162013.db2.gz DDEBOEHDADMBCO-UHFFFAOYSA-N -1 3 319.426 3.933 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)N[C@H](c1cccs1)C1CC1 ZINC000913973447 1036954092 /nfs/dbraw/zinc/95/40/92/1036954092.db2.gz HFMQWELIYZMNED-HNNXBMFYSA-N -1 3 320.389 3.543 20 10 DHCDHM COc1c([O-])c(CNc2ccc(C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000775050311 1037491617 /nfs/dbraw/zinc/49/16/17/1037491617.db2.gz GJTCGRRFSOULTI-UHFFFAOYSA-N -1 3 314.341 3.799 20 10 DHCDHM CN1Cc2cc(NCc3c([O-])cccc3Cl)ccc2NC1=O ZINC000775321142 1038222980 /nfs/dbraw/zinc/22/29/80/1038222980.db2.gz PGFHFSSLZMTMEL-UHFFFAOYSA-N -1 3 317.776 3.635 20 10 DHCDHM C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273484302 130126345 /nfs/dbraw/zinc/12/63/45/130126345.db2.gz MVZNSSZFERVTHP-VHSXEESVSA-N -1 3 322.311 3.990 20 10 DHCDHM COCC[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccc(C)o1 ZINC000273478309 130126674 /nfs/dbraw/zinc/12/66/74/130126674.db2.gz TZDSSGKSFYJQQY-WFASDCNBSA-N -1 3 307.365 3.861 20 10 DHCDHM COc1ccc2c(c1)[C@@H](NCc1cccc(Cl)c1[O-])CCO2 ZINC000274401704 130232476 /nfs/dbraw/zinc/23/24/76/130232476.db2.gz KNIRALGKCOKZQV-HNNXBMFYSA-N -1 3 319.788 3.668 20 10 DHCDHM CC[C@H](NCc1ccc(OC)cc1OC)c1ccc(F)cc1[O-] ZINC000285904392 131208703 /nfs/dbraw/zinc/20/87/03/131208703.db2.gz CXRINKZJEZRKNM-INIZCTEOSA-N -1 3 319.376 3.789 20 10 DHCDHM CC[C@H](N[C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1[O-] ZINC000285986889 131214344 /nfs/dbraw/zinc/21/43/44/131214344.db2.gz HWWVAPKCJWFLPP-GJZGRUSLSA-N -1 3 307.365 3.861 20 10 DHCDHM C[C@@H](N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1[O-] ZINC000286892145 131253891 /nfs/dbraw/zinc/25/38/91/131253891.db2.gz DCSJTRCCGVPGKL-SJKOYZFVSA-N -1 3 320.383 3.624 20 10 DHCDHM CC[C@H](NCc1cc(F)ccc1OC)c1ccc(F)cc1[O-] ZINC000287357887 131276165 /nfs/dbraw/zinc/27/61/65/131276165.db2.gz HEJNPNZGRHLVGY-HNNXBMFYSA-N -1 3 307.340 3.920 20 10 DHCDHM C[C@H](Nc1cccc(N2CCCC2=O)c1)c1ccc(F)cc1[O-] ZINC000170788977 332636305 /nfs/dbraw/zinc/63/63/05/332636305.db2.gz AUSWFWMEKKTTCE-LBPRGKRZSA-N -1 3 314.360 3.831 20 10 DHCDHM COC[C@@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ccc(C)o1 ZINC000185630128 333210825 /nfs/dbraw/zinc/21/08/25/333210825.db2.gz DOFMKLNRCAKQAI-SMDDNHRTSA-N -1 3 309.793 3.985 20 10 DHCDHM C[C@H](N[C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc(F)c(F)c1[O-] ZINC000367578629 336825767 /nfs/dbraw/zinc/82/57/67/336825767.db2.gz WKDJOMKMQVGOHL-DRTKUVKGSA-N -1 3 323.314 3.982 20 10 DHCDHM C[C@H]1Oc2c(cccc2F)[C@H]1NCc1cccc(Cl)c1[O-] ZINC000369379981 336863712 /nfs/dbraw/zinc/86/37/12/336863712.db2.gz QHPZIDVTLDHLPC-OTYXRUKQSA-N -1 3 307.752 3.797 20 10 DHCDHM [O-]c1c(Cl)cccc1CN[C@H]1COc2c1cccc2Cl ZINC000375038570 337001869 /nfs/dbraw/zinc/00/18/69/337001869.db2.gz LLMBUFOACMSVFX-ZDUSSCGKSA-N -1 3 310.180 3.922 20 10 DHCDHM C[C@@H](NCc1ncc(-c2ccccc2)cn1)c1ccccc1[O-] ZINC000186061742 337253282 /nfs/dbraw/zinc/25/32/82/337253282.db2.gz MIIUNIFUBPZXSW-CQSZACIVSA-N -1 3 305.381 3.700 20 10 DHCDHM Cc1cccc2c1OCC[C@H]2NCc1cc(Cl)ccc1[O-] ZINC000188877888 337275860 /nfs/dbraw/zinc/27/58/60/337275860.db2.gz QLYJMFXCVLFUQM-OAHLLOKOSA-N -1 3 303.789 3.967 20 10 DHCDHM CCOc1ccccc1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000191213708 521505180 /nfs/dbraw/zinc/50/51/80/521505180.db2.gz XTNYZKLNERDZKW-LLVKDONJSA-N -1 3 307.340 3.920 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@H](C)c2cc(F)ccc2[O-])o1 ZINC000185548842 524031840 /nfs/dbraw/zinc/03/18/40/524031840.db2.gz WMCKMBWKRMROBE-IAQYHMDHSA-N -1 3 307.365 3.725 20 10 DHCDHM Cc1ccc(N[C@@H](C)c2cc(F)ccc2[O-])cc1C(=O)N(C)C ZINC000186478387 525310835 /nfs/dbraw/zinc/31/08/35/525310835.db2.gz MNSCUHQBDXLLHM-LBPRGKRZSA-N -1 3 316.376 3.715 20 10 DHCDHM C[C@H](N[C@H]1COc2cc(F)cc(F)c21)c1ccc(F)cc1[O-] ZINC000368211159 525634567 /nfs/dbraw/zinc/63/45/67/525634567.db2.gz BYJDMBDNQFSELL-SDBXPKJASA-N -1 3 309.287 3.594 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@@H]2COc3cc(F)cc(F)c32)c([O-])c1 ZINC000368212363 525744262 /nfs/dbraw/zinc/74/42/62/525744262.db2.gz NAIQTOMNGVFCIQ-QMTHXVAHSA-N -1 3 305.324 3.763 20 10 DHCDHM [O-]c1c(Cl)cccc1CN[C@@H]1CCOc2c(F)cccc21 ZINC000364842814 526328956 /nfs/dbraw/zinc/32/89/56/526328956.db2.gz BCQDJZIDMXMZAW-CQSZACIVSA-N -1 3 307.752 3.798 20 10 DHCDHM [O-]c1ccc(Br)cc1CN1CCC[C@@H]1c1ccc[nH]1 ZINC000127478518 526342467 /nfs/dbraw/zinc/34/24/67/526342467.db2.gz WYLKWZUBPGNXDQ-CQSZACIVSA-N -1 3 321.218 3.820 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@H](CCCO)c1ccccc1 ZINC000124380602 527543669 /nfs/dbraw/zinc/54/36/69/527543669.db2.gz GJOVJODSSLVEBN-MRXNPFEDSA-N -1 3 305.805 3.649 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@@H](CCCO)c1ccccc1 ZINC000124380826 527545486 /nfs/dbraw/zinc/54/54/86/527545486.db2.gz GJOVJODSSLVEBN-INIZCTEOSA-N -1 3 305.805 3.649 20 10 DHCDHM CC[C@@H](N[C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(F)cc1[O-] ZINC000287733697 535808636 /nfs/dbraw/zinc/80/86/36/535808636.db2.gz YNFCDVKNRCEXHA-MISXGVKJSA-N -1 3 320.412 3.965 20 10 DHCDHM O=C([O-])c1ccc2c(c1)C[N@@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC000740202793 600078512 /nfs/dbraw/zinc/07/85/12/600078512.db2.gz MGUFJRUOHAJSMO-UHFFFAOYSA-N -1 3 319.360 3.759 20 10 DHCDHM O=C([O-])c1ccc2c(c1)C[N@H+](Cc1c([O-])ccc3ccccc31)C2 ZINC000740202793 600078516 /nfs/dbraw/zinc/07/85/16/600078516.db2.gz MGUFJRUOHAJSMO-UHFFFAOYSA-N -1 3 319.360 3.759 20 10 DHCDHM [O-]c1cccc(Br)c1CN(Cc1ccco1)C1CC1 ZINC001140102950 1013437443 /nfs/dbraw/zinc/43/74/43/1013437443.db2.gz AAAVQNBBAAUDOT-UHFFFAOYSA-N -1 3 322.202 3.912 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCC(CC(F)(F)F)CC1 ZINC000894698243 1013460904 /nfs/dbraw/zinc/46/09/04/1013460904.db2.gz QUHVZLMNFNIDNG-UHFFFAOYSA-N -1 3 309.278 3.835 20 10 DHCDHM CCCC[N@H+](Cc1cc(C(=O)[O-])oc1C)Cc1ccccc1[O-] ZINC001595748091 982417600 /nfs/dbraw/zinc/41/76/00/982417600.db2.gz SCVDOOBNVWKVDZ-UHFFFAOYSA-N -1 3 317.385 3.794 20 10 DHCDHM CCCC[N@@H+](Cc1cc(C(=O)[O-])oc1C)Cc1ccccc1[O-] ZINC001595748091 982417602 /nfs/dbraw/zinc/41/76/02/982417602.db2.gz SCVDOOBNVWKVDZ-UHFFFAOYSA-N -1 3 317.385 3.794 20 10 DHCDHM C[C@H]([NH2+][C@@H]1CCC[C@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599902228 984857597 /nfs/dbraw/zinc/85/75/97/984857597.db2.gz RRYTWRDWOOXZGC-RRFJBIMHSA-N -1 3 305.418 3.857 20 10 DHCDHM CC[C@H](C)c1nnc([C@@H](C)NCc2cccc(Cl)c2[O-])[nH]1 ZINC000276833267 1015695720 /nfs/dbraw/zinc/69/57/20/1015695720.db2.gz BOVQARZGLAAJLR-VHSXEESVSA-N -1 3 308.813 3.528 20 10 DHCDHM C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593296276 994695137 /nfs/dbraw/zinc/69/51/37/994695137.db2.gz LEMMSKZQJNEHIM-LBPRGKRZSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@@H](NCc1ccc(Cl)cc1F)c1cc(C(=O)[O-])ccc1O ZINC001593297906 994708250 /nfs/dbraw/zinc/70/82/50/994708250.db2.gz BXQZKMRAKGRZGZ-SECBINFHSA-N -1 3 323.751 3.734 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCc2ccsc2C1 ZINC000127069672 1016575717 /nfs/dbraw/zinc/57/57/17/1016575717.db2.gz VRORGZVHIQGRMA-UHFFFAOYSA-N -1 3 324.243 3.775 20 10 DHCDHM O=C(NCc1cc(Cl)c2cccnc2c1[O-])C1=CCCCC1 ZINC001146725523 1032241831 /nfs/dbraw/zinc/24/18/31/1032241831.db2.gz QFEJZGHCQOQHIQ-UHFFFAOYSA-N -1 3 316.788 3.710 20 10 DHCDHM C[C@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-])c1ccn(C)n1 ZINC000840815273 1017078411 /nfs/dbraw/zinc/07/84/11/1017078411.db2.gz DHUMPUXLMKEEQY-IUCAKERBSA-N -1 3 314.216 3.844 20 10 DHCDHM Cc1c(NCc2c([O-])cccc2Cl)cnn1C1CCOCC1 ZINC000295105696 1032277295 /nfs/dbraw/zinc/27/72/95/1032277295.db2.gz KYHVHWCLYTYILH-UHFFFAOYSA-N -1 3 321.808 3.514 20 10 DHCDHM [O-]c1c(CN2CCC[C@H](CC(F)(F)F)C2)ccc(F)c1F ZINC000877594984 1033371114 /nfs/dbraw/zinc/37/11/14/1033371114.db2.gz ORCQGVNWLPBADE-SECBINFHSA-N -1 3 309.278 3.835 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](c2cccs2)C1 ZINC000092593991 1032504167 /nfs/dbraw/zinc/50/41/67/1032504167.db2.gz RMLFHXJHICRQNM-AWEZNQCLSA-N -1 3 309.818 3.681 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2ccoc2C)c1[O-] ZINC000050154256 1017120814 /nfs/dbraw/zinc/12/08/14/1017120814.db2.gz SQYDAJOGBZHXNZ-UHFFFAOYSA-N -1 3 307.777 3.782 20 10 DHCDHM Cc1nc(-c2cccc(NC(=O)c3cccc(O)c3[O-])c2)oc1C ZINC000186987664 1017754904 /nfs/dbraw/zinc/75/49/04/1017754904.db2.gz PITIDXATABMXSK-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM CC(C)(C)c1cnc(Sc2cc(Cl)nc(=O)[n-]2)s1 ZINC000858445965 1032900787 /nfs/dbraw/zinc/90/07/87/1032900787.db2.gz SDYCIMRVQNIXNK-UHFFFAOYSA-N -1 3 301.824 3.741 20 10 DHCDHM Cc1cc(Cl)nc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000282494336 1020615748 /nfs/dbraw/zinc/61/57/48/1020615748.db2.gz HWBLMFGTLXVFLZ-SNVBAGLBSA-N -1 3 321.764 3.508 20 10 DHCDHM C[C@H](N[C@@H]1COc2cccc(F)c21)c1cc(Cl)ccc1[O-] ZINC000368411274 1020694603 /nfs/dbraw/zinc/69/46/03/1020694603.db2.gz NMAVBTNOBQKMCG-TVQRCGJNSA-N -1 3 307.752 3.969 20 10 DHCDHM Cc1ccc(C(=O)Nc2ccc3oc(C4CC4)nc3c2)c([O-])c1O ZINC000177671249 1020749637 /nfs/dbraw/zinc/74/96/37/1020749637.db2.gz BJXBSQBNRZVZJB-UHFFFAOYSA-N -1 3 324.336 3.677 20 10 DHCDHM COCc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1OC ZINC000858568873 1032949430 /nfs/dbraw/zinc/94/94/30/1032949430.db2.gz ZHVPZSFEMVPEFS-LLVKDONJSA-N -1 3 305.349 3.859 20 10 DHCDHM O=C(Nc1ccc(OC2CCCC2)cc1)c1cccc(O)c1[O-] ZINC000776337382 1021293894 /nfs/dbraw/zinc/29/38/94/1021293894.db2.gz UWGWASGTPSJRAN-UHFFFAOYSA-N -1 3 313.353 3.672 20 10 DHCDHM C[C@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1[O-])c1nccn1C ZINC000850573181 1021616642 /nfs/dbraw/zinc/61/66/42/1021616642.db2.gz VUOCUMPIGZBKTC-IUCAKERBSA-N -1 3 314.216 3.844 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N(Cc1ccccc1)CC1CCC1 ZINC000187090655 1022630108 /nfs/dbraw/zinc/63/01/08/1022630108.db2.gz NGWDJERKSOSKBH-UHFFFAOYSA-N -1 3 311.381 3.540 20 10 DHCDHM CC1(C)CN(Cc2cc(F)c(Cl)cc2[O-])CC(C)(C)O1 ZINC001237941618 1023007017 /nfs/dbraw/zinc/00/70/17/1023007017.db2.gz ZHMSWZXOKUPIDQ-UHFFFAOYSA-N -1 3 301.789 3.574 20 10 DHCDHM COc1ccc(F)cc1[C@H](C)NCc1ccc(F)c(F)c1[O-] ZINC000876942121 1033190689 /nfs/dbraw/zinc/19/06/89/1033190689.db2.gz UTISUIMPZUDUHY-VIFPVBQESA-N -1 3 311.303 3.669 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNC1(c2nccs2)CCCC1 ZINC000883004727 1024206823 /nfs/dbraw/zinc/20/68/23/1024206823.db2.gz SVZZEDMUXWDIOZ-UHFFFAOYSA-N -1 3 310.369 3.686 20 10 DHCDHM COCCCCc1cccnc1NCc1cc(F)cc(F)c1[O-] ZINC000883126171 1024251265 /nfs/dbraw/zinc/25/12/65/1024251265.db2.gz HXXVDBXOTMZUCD-UHFFFAOYSA-N -1 3 322.355 3.647 20 10 DHCDHM Cc1nc(-c2ccc(NC(=O)c3cccc(O)c3[O-])cc2)oc1C ZINC000790556575 1024324482 /nfs/dbraw/zinc/32/44/82/1024324482.db2.gz GFXGHWVQUFJBND-UHFFFAOYSA-N -1 3 324.336 3.622 20 10 DHCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1csc2ccccc21 ZINC000790657452 1024355063 /nfs/dbraw/zinc/35/50/63/1024355063.db2.gz HBDIFUYZELWVKW-SNVBAGLBSA-N -1 3 313.378 3.804 20 10 DHCDHM COCC[C@H](NCc1c([O-])ccc(Cl)c1F)c1ccco1 ZINC000790989213 1024412252 /nfs/dbraw/zinc/41/22/52/1024412252.db2.gz HPEZFOXBDZPPNV-LBPRGKRZSA-N -1 3 313.756 3.645 20 10 DHCDHM Cc1cccc2[nH]c(CNCc3c([O-])ccc(Cl)c3F)nc21 ZINC000790982808 1024425828 /nfs/dbraw/zinc/42/58/28/1024425828.db2.gz YXSQMNATSLLAOI-UHFFFAOYSA-N -1 3 319.767 3.659 20 10 DHCDHM Cc1cccc2nc(CNCc3c([O-])ccc(Cl)c3F)[nH]c21 ZINC000790982808 1024425837 /nfs/dbraw/zinc/42/58/37/1024425837.db2.gz YXSQMNATSLLAOI-UHFFFAOYSA-N -1 3 319.767 3.659 20 10 DHCDHM CN(C)c1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000792028007 1024618566 /nfs/dbraw/zinc/61/85/66/1024618566.db2.gz ABJKHJXKVRRWDQ-UHFFFAOYSA-N -1 3 320.392 3.541 20 10 DHCDHM C[C@@H](NCc1cccc(OC(C)(C)C)n1)c1c([O-])cccc1F ZINC000886559673 1025708512 /nfs/dbraw/zinc/70/85/12/1025708512.db2.gz AZDSJBLMRSNKGT-GFCCVEGCSA-N -1 3 318.392 3.954 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)OCCCO2)c1c([O-])cccc1F ZINC000886563907 1025710538 /nfs/dbraw/zinc/71/05/38/1025710538.db2.gz IWYNUNBIDMCYLX-LLVKDONJSA-N -1 3 303.333 3.866 20 10 DHCDHM Cc1cc(Br)c([O-])c(CN[C@H]2CCCC2(F)F)c1 ZINC000808431841 1026300506 /nfs/dbraw/zinc/30/05/06/1026300506.db2.gz NJYPGHWNXKMOLY-NSHDSACASA-N -1 3 320.177 3.741 20 10 DHCDHM CCc1cc(NCc2ccc([N+](=O)[O-])c(OC)c2[O-])ccc1F ZINC000809691307 1026585437 /nfs/dbraw/zinc/58/54/37/1026585437.db2.gz FOLZZYYSMBHFDK-UHFFFAOYSA-N -1 3 320.320 3.623 20 10 DHCDHM Cc1csc(C2(NCc3cccc(Cl)c3[O-])CCC2)n1 ZINC000271905052 1027176775 /nfs/dbraw/zinc/17/67/75/1027176775.db2.gz WKCKACPCXUSGNY-UHFFFAOYSA-N -1 3 308.834 3.980 20 10 DHCDHM Cc1cc(N(C)C)ccc1CNCc1cccc([O-])c1Cl ZINC000815124665 1028369095 /nfs/dbraw/zinc/36/90/95/1028369095.db2.gz GYYYLBYWKCGWNA-UHFFFAOYSA-N -1 3 304.821 3.710 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CNCc1c(F)cc(F)cc1F ZINC000815152493 1028384697 /nfs/dbraw/zinc/38/46/97/1028384697.db2.gz VGKIVVNVIOTCHB-UHFFFAOYSA-N -1 3 319.685 3.892 20 10 DHCDHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(N(C)C)cc1 ZINC000815136267 1028396793 /nfs/dbraw/zinc/39/67/93/1028396793.db2.gz TWCKDYNQCICJRU-GFCCVEGCSA-N -1 3 304.821 3.962 20 10 DHCDHM O=C(Nc1ccc(SC(F)F)cc1)c1cccc(O)c1[O-] ZINC000188029274 1028490177 /nfs/dbraw/zinc/49/01/77/1028490177.db2.gz OVMYTJLTTCMMPN-UHFFFAOYSA-N -1 3 311.309 3.665 20 10 DHCDHM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1cc2ccccc2o1 ZINC000189089661 1028548421 /nfs/dbraw/zinc/54/84/21/1028548421.db2.gz RFFWIGSVRKBLBT-NSHDSACASA-N -1 3 312.325 3.897 20 10 DHCDHM C[C@@H](NCc1ncccc1F)c1cccc(C(F)(F)F)c1[O-] ZINC000815598215 1028562783 /nfs/dbraw/zinc/56/27/83/1028562783.db2.gz PEAYEFHXFYLCSU-SECBINFHSA-N -1 3 314.282 3.796 20 10 DHCDHM CN(Cc1nccn1C(F)F)Cc1ccc2ccccc2c1[O-] ZINC000816487227 1028894853 /nfs/dbraw/zinc/89/48/53/1028894853.db2.gz HAPYZURGCAHQOQ-UHFFFAOYSA-N -1 3 317.339 3.769 20 10 DHCDHM CC1(C)[C@@H](c2ccccc2)CCN1C(=O)c1cccc(O)c1[O-] ZINC000817704213 1029229858 /nfs/dbraw/zinc/22/98/58/1029229858.db2.gz WEOXWWXYHYINLP-OAHLLOKOSA-N -1 3 311.381 3.506 20 10 DHCDHM Cc1cc(O)c(C(C)C)cc1[N-]S(=O)(=O)c1ccccc1C ZINC000123884391 1031389410 /nfs/dbraw/zinc/38/94/10/1031389410.db2.gz MYHXFHWSANVZOM-UHFFFAOYSA-N -1 3 319.426 3.933 20 10 DHCDHM CC1CCN(Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144298495 1031436825 /nfs/dbraw/zinc/43/68/25/1031436825.db2.gz DTEKXRIQMUHICJ-UHFFFAOYSA-N -1 3 302.187 3.526 20 10 DHCDHM Cc1cc([O-])c(CN[C@H](C)c2nc(C(C)(C)C)no2)cc1Cl ZINC000825681479 1031846541 /nfs/dbraw/zinc/84/65/41/1031846541.db2.gz SMFKLKBPIJPZNK-SNVBAGLBSA-N -1 3 323.824 3.885 20 10 DHCDHM Cc1cc([O-])c(CNCc2nc(C(C)(C)C)co2)c(Cl)c1 ZINC000897941960 1031892037 /nfs/dbraw/zinc/89/20/37/1031892037.db2.gz IIBIEJFLOKXTEU-UHFFFAOYSA-N -1 3 308.809 3.929 20 10 DHCDHM C[C@@H]1C[C@H](C(F)(F)F)CCN1Cc1ccc(F)c(F)c1[O-] ZINC000877563008 1033358889 /nfs/dbraw/zinc/35/88/89/1033358889.db2.gz FAVAEYYTZAOKPC-PSASIEDQSA-N -1 3 309.278 3.833 20 10 DHCDHM CCn1nc(C)c(CN(C)Cc2cccc(Cl)c2[O-])c1C ZINC000877664518 1033402390 /nfs/dbraw/zinc/40/23/90/1033402390.db2.gz SMDDCYHUTSYODY-UHFFFAOYSA-N -1 3 307.825 3.511 20 10 DHCDHM Cc1cc([O-])c(CN2CCO[C@@H](C(F)(F)F)CC2)cc1Cl ZINC000877819884 1033470961 /nfs/dbraw/zinc/47/09/61/1033470961.db2.gz BHHDSIFRPCUPQO-CYBMUJFWSA-N -1 3 323.742 3.507 20 10 DHCDHM Cc1cc(CN[C@H](C)c2cc(Cl)c(Cl)cc2[O-])on1 ZINC000192830717 1034817677 /nfs/dbraw/zinc/81/76/77/1034817677.db2.gz MRESCJYAOBVXQB-MRVPVSSYSA-N -1 3 301.173 3.846 20 10 DHCDHM C[C@H](NCc1nccc2c1CCCC2)c1cc(F)cc(F)c1[O-] ZINC000903182615 1035287691 /nfs/dbraw/zinc/28/76/91/1035287691.db2.gz SSHDSQGVHOMKSS-NSHDSACASA-N -1 3 318.367 3.795 20 10 DHCDHM O=C(Nc1ccc2c(c1)C=CC1(CCC1)O2)c1cccc(O)c1[O-] ZINC001177623528 1035385434 /nfs/dbraw/zinc/38/54/34/1035385434.db2.gz YTXKWHQKZVKQBX-UHFFFAOYSA-N -1 3 323.348 3.678 20 10 DHCDHM Cc1ccc(C(=O)N2C[C@@H](C(C)C)c3ccccc32)c([O-])c1O ZINC000773777484 1035450395 /nfs/dbraw/zinc/45/03/95/1035450395.db2.gz STVHVFCTGPWIIP-HNNXBMFYSA-N -1 3 311.381 3.806 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN1CCOC2(C1)CCCCCC2 ZINC001180076552 1035587032 /nfs/dbraw/zinc/58/70/32/1035587032.db2.gz ILKPCVODQDNEQY-UHFFFAOYSA-N -1 3 311.372 3.596 20 10 DHCDHM Cc1ccc2c(c1)C(=O)N(C)[C@H](c1cc(Cl)ccc1[O-])N2 ZINC000153729713 1037181000 /nfs/dbraw/zinc/18/10/00/1037181000.db2.gz URGNPANUKIOGQN-OAHLLOKOSA-N -1 3 302.761 3.550 20 10 DHCDHM COc1c([O-])c(CN(C)c2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000775055982 1037513269 /nfs/dbraw/zinc/51/32/69/1037513269.db2.gz JENGHRYYEDMXIZ-UHFFFAOYSA-N -1 3 316.357 3.562 20 10 DHCDHM COc1c([O-])c(CN(C)c2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000775097798 1037591930 /nfs/dbraw/zinc/59/19/30/1037591930.db2.gz SZUAPBVJTNCUOO-UHFFFAOYSA-N -1 3 316.357 3.562 20 10 DHCDHM Cc1cnc(C)c(NCc2cc(Cl)c3cccnc3c2[O-])n1 ZINC001168521365 1037976970 /nfs/dbraw/zinc/97/69/70/1037976970.db2.gz ALRFVTUCKDTBDR-UHFFFAOYSA-N -1 3 314.776 3.613 20 10 DHCDHM CC[C@H](NCc1nccn1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000775499638 1038582704 /nfs/dbraw/zinc/58/27/04/1038582704.db2.gz SOGNNRWQEXSZSD-NSHDSACASA-N -1 3 314.216 3.673 20 10 DHCDHM C[C@H](Nc1ccc(N2CCCC2)nc1)c1ccc(F)cc1[O-] ZINC000170789164 1038965402 /nfs/dbraw/zinc/96/54/02/1038965402.db2.gz RCYUAGFYKOWFST-LBPRGKRZSA-N -1 3 301.365 3.700 20 10 DHCDHM C[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])c1ccc(F)cc1F ZINC000273414965 130118213 /nfs/dbraw/zinc/11/82/13/130118213.db2.gz QRWJQMLABQTOSK-UWVGGRQHSA-N -1 3 322.311 3.990 20 10 DHCDHM COc1cc(OC)c(N[C@@H](C)c2ccc(F)cc2[O-])cc1F ZINC000273429663 130120463 /nfs/dbraw/zinc/12/04/63/130120463.db2.gz KVOPZVJRSDUDPP-VIFPVBQESA-N -1 3 309.312 3.861 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccccc1[N+](=O)[O-] ZINC000273533384 130133722 /nfs/dbraw/zinc/13/37/22/130133722.db2.gz WVRSSGFZYVQJJB-MNOVXSKESA-N -1 3 304.321 3.851 20 10 DHCDHM CC[C@@H](N[C@H](COC)c1ccc(C)o1)c1ccc(F)cc1[O-] ZINC000285986891 131214099 /nfs/dbraw/zinc/21/40/99/131214099.db2.gz HWWVAPKCJWFLPP-HUUCEWRRSA-N -1 3 307.365 3.861 20 10 DHCDHM COC[C@H](NCc1cc(Cl)c(F)cc1[O-])c1ccccc1 ZINC000293545088 131744887 /nfs/dbraw/zinc/74/48/87/131744887.db2.gz GJVDNMASQALJOV-HNNXBMFYSA-N -1 3 309.768 3.662 20 10 DHCDHM C[C@H](NCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1[O-] ZINC000296608784 131975742 /nfs/dbraw/zinc/97/57/42/131975742.db2.gz WEIBGVIEJGIDFG-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1[O-] ZINC000296250876 335142469 /nfs/dbraw/zinc/14/24/69/335142469.db2.gz BHHJEHPNXOKPED-VHSXEESVSA-N -1 3 322.311 3.990 20 10 DHCDHM CC[C@@H](NC1(c2noc(C(F)F)n2)CCC1)c1ccccc1[O-] ZINC000367827598 336830221 /nfs/dbraw/zinc/83/02/21/336830221.db2.gz DZRISFOKSXRQDQ-LLVKDONJSA-N -1 3 323.343 3.833 20 10 DHCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@@H]2c2cccs2)c([O-])c1O ZINC000368042978 336836431 /nfs/dbraw/zinc/83/64/31/336836431.db2.gz MHUHOODPYWFZME-HNNXBMFYSA-N -1 3 317.410 3.691 20 10 DHCDHM Cc1cc([C@H]2CCCN2Cc2cc(Cl)cc(C)c2[O-])no1 ZINC000375018898 337001659 /nfs/dbraw/zinc/00/16/59/337001659.db2.gz KCDDSDYPXZNIMH-OAHLLOKOSA-N -1 3 306.793 3.988 20 10 DHCDHM C[C@H](N[C@@H]1COc2c1cccc2Cl)c1cc(F)ccc1[O-] ZINC000375242904 337006523 /nfs/dbraw/zinc/00/65/23/337006523.db2.gz ROXBDZNJDNOKJU-LKFCYVNXSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@@H](N[C@@H](C)c1nccn1-c1ccccc1)c1ccccc1[O-] ZINC000376563426 337036917 /nfs/dbraw/zinc/03/69/17/337036917.db2.gz TXIHYYSBJCCKDL-CABCVRRESA-N -1 3 307.397 3.990 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]1c1ccncc1 ZINC000377692529 337058596 /nfs/dbraw/zinc/05/85/96/337058596.db2.gz JDIPYTDWXIGRLF-AWEZNQCLSA-N -1 3 306.768 3.917 20 10 DHCDHM Cc1ccc([C@@H](C)N[C@H](C)c2cn(-c3ccccc3)nn2)c([O-])c1 ZINC000186113217 337253825 /nfs/dbraw/zinc/25/38/25/337253825.db2.gz RLKSYVCSXOULTB-HUUCEWRRSA-N -1 3 322.412 3.693 20 10 DHCDHM CN(Cc1cccc(Cl)c1[O-])[C@@H]1CCCc2cccnc21 ZINC000365032757 523304683 /nfs/dbraw/zinc/30/46/83/523304683.db2.gz XINTYQZTFPGSDE-OAHLLOKOSA-N -1 3 302.805 3.950 20 10 DHCDHM Cc1ccc(CN(C(=O)c2cccc(O)c2[O-])C(C)C)s1 ZINC000188284322 524359804 /nfs/dbraw/zinc/35/98/04/524359804.db2.gz JUSBYXDCTMJKEM-UHFFFAOYSA-N -1 3 305.399 3.519 20 10 DHCDHM C[C@H](N[C@H]1c2cccc(F)c2O[C@@H]1C)c1ccc(F)c(F)c1[O-] ZINC000364809006 525637870 /nfs/dbraw/zinc/63/78/70/525637870.db2.gz MQBUGTSENQIMEW-IQMYEBEASA-N -1 3 323.314 3.982 20 10 DHCDHM COCC[C@@H](N[C@H](C)c1ccc(F)cc1[O-])c1ccc(C)o1 ZINC000273478305 536809519 /nfs/dbraw/zinc/80/95/19/536809519.db2.gz TZDSSGKSFYJQQY-IUODEOHRSA-N -1 3 307.365 3.861 20 10 DHCDHM C[C@H](CC[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-])c1ccccc1 ZINC001592519985 978365997 /nfs/dbraw/zinc/36/59/97/978365997.db2.gz LFVFAXAAQDKTJJ-ZIAGYGMSSA-N -1 3 313.397 3.935 20 10 DHCDHM C[C@@H]([NH2+][C@@H]1CCC[C@H](CCCC(=O)[O-])C1)c1ccccc1[O-] ZINC001599841218 988836166 /nfs/dbraw/zinc/83/61/66/988836166.db2.gz RRYTWRDWOOXZGC-RBSFLKMASA-N -1 3 305.418 3.857 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC(OC(C)(C)C)CC2)c1[O-] ZINC000119050914 1017544226 /nfs/dbraw/zinc/54/42/26/1017544226.db2.gz RSFFVZFDPPQGAD-UHFFFAOYSA-N -1 3 323.408 3.513 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCc3sccc3[C@@H]2C)c1[O-] ZINC000314965557 1032721965 /nfs/dbraw/zinc/72/19/65/1032721965.db2.gz AIFOYVLLEHNDHH-JTQLQIEISA-N -1 3 319.401 3.915 20 10 DHCDHM [O-]c1cccc(F)c1CN1CCN(c2cccc(Cl)c2)CC1 ZINC001137833277 1018210769 /nfs/dbraw/zinc/21/07/69/1018210769.db2.gz ZHUDTFXQZGWLBJ-UHFFFAOYSA-N -1 3 320.795 3.507 20 10 DHCDHM COc1cc(OC)c(OC)cc1N[C@H](C)c1ccc(F)cc1[O-] ZINC000186476762 1018829905 /nfs/dbraw/zinc/82/99/05/1018829905.db2.gz NMPMBGDHAVFZLL-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM C[C@@H]1CC[C@@H](C)N(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715718468 1018949803 /nfs/dbraw/zinc/94/98/03/1018949803.db2.gz NSUQYEANYDVUJZ-NXEZZACHSA-N -1 3 316.214 3.914 20 10 DHCDHM CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@@H](C)C1 ZINC000282130974 1020867892 /nfs/dbraw/zinc/86/78/92/1020867892.db2.gz BKPGJGNBAMSTEV-JOYOIKCWSA-N -1 3 304.217 3.698 20 10 DHCDHM COc1cccc(OC)c1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000850504863 1021566057 /nfs/dbraw/zinc/56/60/57/1021566057.db2.gz GXTDFBYAGDMTME-SNVBAGLBSA-N -1 3 323.339 3.538 20 10 DHCDHM C[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1[O-])c1nccn1C ZINC000850573029 1021615829 /nfs/dbraw/zinc/61/58/29/1021615829.db2.gz SODZCZXZYXLTJW-NXEZZACHSA-N -1 3 313.323 3.556 20 10 DHCDHM [O-]c1cccc(Cl)c1CN(Cc1ccco1)C[C@@H]1CCCO1 ZINC000119080901 1021786345 /nfs/dbraw/zinc/78/63/45/1021786345.db2.gz BQVSFDPWXKGYBZ-AWEZNQCLSA-N -1 3 321.804 3.820 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC(c3ccco3)CC2)c1[O-] ZINC000852325158 1022105713 /nfs/dbraw/zinc/10/57/13/1022105713.db2.gz YMFMTHANESSZDI-UHFFFAOYSA-N -1 3 317.360 3.707 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CC[C@H]2c2ccc(F)cc2)c1[O-] ZINC000852468380 1022123924 /nfs/dbraw/zinc/12/39/24/1022123924.db2.gz NJKGHGZHLXNUEI-KRWDZBQOSA-N -1 3 317.335 3.820 20 10 DHCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])c1cccc(Cl)c1 ZINC000776628430 1022189006 /nfs/dbraw/zinc/18/90/06/1022189006.db2.gz SLPOCAKVSAAUDM-ZDUSSCGKSA-N -1 3 305.761 3.632 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](c2ccccc2)C1 ZINC000768238586 1022925766 /nfs/dbraw/zinc/92/57/66/1022925766.db2.gz QSUNLPYOSTVNNN-QGZVFWFLSA-N -1 3 303.789 3.619 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](c2ccccc2)C1 ZINC000768235643 1022930654 /nfs/dbraw/zinc/93/06/54/1022930654.db2.gz BUQNUWFKTWSZCO-KRWDZBQOSA-N -1 3 303.789 3.619 20 10 DHCDHM CCc1nc([C@@H]2CCCCN2Cc2c([O-])cccc2Cl)no1 ZINC000768967322 1023060990 /nfs/dbraw/zinc/06/09/90/1023060990.db2.gz OXDPAVBDNKANEP-ZDUSSCGKSA-N -1 3 321.808 3.718 20 10 DHCDHM CC(=O)N1CCc2c1cccc2N[C@@H](C)c1ccc(F)cc1[O-] ZINC000769417068 1023145396 /nfs/dbraw/zinc/14/53/96/1023145396.db2.gz PIFMFNSFGKGUHT-NSHDSACASA-N -1 3 314.360 3.613 20 10 DHCDHM CCc1ccc([C@@H]2COCCN2Cc2cc(Cl)ccc2[O-])o1 ZINC000769445363 1023153744 /nfs/dbraw/zinc/15/37/44/1023153744.db2.gz GFHJPBOCKBBYKP-HNNXBMFYSA-N -1 3 321.804 3.775 20 10 DHCDHM CC(=O)c1cc(F)cc(CN(C)Cc2cc(C)ccc2F)c1[O-] ZINC000769911497 1023231289 /nfs/dbraw/zinc/23/12/89/1023231289.db2.gz ZWXRRLBNROIVBF-UHFFFAOYSA-N -1 3 319.351 3.813 20 10 DHCDHM Cc1nc2c(s1)[C@H](N(C)Cc1ccc(F)c(F)c1[O-])CCC2 ZINC000876732478 1033129534 /nfs/dbraw/zinc/12/95/34/1033129534.db2.gz XEARPXFIJPQDHK-CYBMUJFWSA-N -1 3 324.396 3.945 20 10 DHCDHM COC(=O)CCc1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000786577540 1023707408 /nfs/dbraw/zinc/70/74/08/1023707408.db2.gz POGQYGHTGSXTEH-UHFFFAOYSA-N -1 3 319.788 3.763 20 10 DHCDHM CCOc1ccc(NCc2c([O-])cccc2Cl)cc1CO ZINC000121175971 1023711350 /nfs/dbraw/zinc/71/13/50/1023711350.db2.gz LYZUUOBIUNFQEU-UHFFFAOYSA-N -1 3 307.777 3.549 20 10 DHCDHM CCN(C(=O)c1ccc(C)c(O)c1[O-])c1ccc2[nH]ccc2c1 ZINC000788551584 1023904388 /nfs/dbraw/zinc/90/43/88/1023904388.db2.gz RAVIBTXORMWZNX-UHFFFAOYSA-N -1 3 310.353 3.554 20 10 DHCDHM CC[C@@](C)(NCc1cc(F)cc(F)c1[O-])c1nc(C)cs1 ZINC000883017777 1024211581 /nfs/dbraw/zinc/21/15/81/1024211581.db2.gz APXCSDURBLEYKS-OAHLLOKOSA-N -1 3 312.385 3.850 20 10 DHCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1csc2ccccc21 ZINC000790657451 1024355596 /nfs/dbraw/zinc/35/55/96/1024355596.db2.gz HBDIFUYZELWVKW-JTQLQIEISA-N -1 3 313.378 3.804 20 10 DHCDHM Cc1nc2cc(NCc3c([O-])ccc(Cl)c3F)ccc2n1C ZINC000790980859 1024423581 /nfs/dbraw/zinc/42/35/81/1024423581.db2.gz JBWPTOBAJXSLEY-UHFFFAOYSA-N -1 3 319.767 3.992 20 10 DHCDHM Cc1nc(C)c([C@@H](C)N(C)Cc2cc(F)cc(F)c2[O-])s1 ZINC000894014610 1025654880 /nfs/dbraw/zinc/65/48/80/1025654880.db2.gz NLNUMVQDWMPWNH-SECBINFHSA-N -1 3 312.385 3.937 20 10 DHCDHM C[C@@H](N[C@H]1COc2ccc(Cl)cc21)c1c([O-])cccc1F ZINC000886552118 1025698957 /nfs/dbraw/zinc/69/89/57/1025698957.db2.gz UYKXQCDCOZHNLW-RNCFNFMXSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@H](NC1(c2ccc3c(c2)OCO3)CC1)c1c([O-])cccc1F ZINC000886576790 1025716798 /nfs/dbraw/zinc/71/67/98/1025716798.db2.gz PDSCTESJVACNHO-NSHDSACASA-N -1 3 315.344 3.600 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)N(C)CCO2)c1c([O-])cccc1F ZINC000886586523 1025724432 /nfs/dbraw/zinc/72/44/32/1025724432.db2.gz TUXZSCOQLABTNO-LLVKDONJSA-N -1 3 302.349 3.533 20 10 DHCDHM CO[C@H]1Cc2ccc(N[C@H](C)c3c([O-])cccc3F)cc2C1 ZINC000886589702 1025727557 /nfs/dbraw/zinc/72/75/57/1025727557.db2.gz BXEPLIFEOSICMK-ABAIWWIYSA-N -1 3 301.361 3.818 20 10 DHCDHM CC[C@H](C)c1nnc([C@@H](C)N[C@@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886598645 1025730617 /nfs/dbraw/zinc/73/06/17/1025730617.db2.gz GRTMCZLZYBDFMS-GARJFASQSA-N -1 3 306.385 3.575 20 10 DHCDHM C[C@H](Nc1cccc2c1OCCCO2)c1c([O-])cccc1F ZINC000886648332 1025759270 /nfs/dbraw/zinc/75/92/70/1025759270.db2.gz QJAOBIZJCWNRQW-NSHDSACASA-N -1 3 303.333 3.866 20 10 DHCDHM C[C@@H](N[C@H](CCO)C(F)(F)F)c1ccc2ccccc2c1[O-] ZINC000886800953 1025918833 /nfs/dbraw/zinc/91/88/33/1025918833.db2.gz FKXXCNINCXVHQA-QMTHXVAHSA-N -1 3 313.319 3.509 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(c2cccnc2)CC1 ZINC000809737040 1026609871 /nfs/dbraw/zinc/60/98/71/1026609871.db2.gz CBARFFVGUAIGSR-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC(c2cccnc2)CC1 ZINC000809737930 1026611202 /nfs/dbraw/zinc/61/12/02/1026611202.db2.gz MOFUHZBETJLQGC-UHFFFAOYSA-N -1 3 320.795 3.959 20 10 DHCDHM C[C@H]1CN(Cc2cccc(Br)c2[O-])CCC1(F)F ZINC000811512717 1027028608 /nfs/dbraw/zinc/02/86/08/1027028608.db2.gz QJUQAFKTNYZRMF-VIFPVBQESA-N -1 3 320.177 3.632 20 10 DHCDHM CN(Cc1nc(-c2ccccc2)c[nH]1)Cc1cc(F)ccc1[O-] ZINC000813332427 1027611584 /nfs/dbraw/zinc/61/15/84/1027611584.db2.gz ZHDAKLSUGJPLBB-UHFFFAOYSA-N -1 3 311.360 3.553 20 10 DHCDHM C[C@H](NCc1ccc(F)cn1)c1cccc(C(F)(F)F)c1[O-] ZINC000815589389 1028558471 /nfs/dbraw/zinc/55/84/71/1028558471.db2.gz QPJAYXOXZNKKES-VIFPVBQESA-N -1 3 314.282 3.796 20 10 DHCDHM CC[C@H](Nc1ccc(COCCO)cc1)c1ccc(F)cc1[O-] ZINC000818361991 1029386509 /nfs/dbraw/zinc/38/65/09/1029386509.db2.gz NBVKTJRPKFEFKQ-KRWDZBQOSA-N -1 3 319.376 3.603 20 10 DHCDHM CCCCN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC000818802271 1029433549 /nfs/dbraw/zinc/43/35/49/1029433549.db2.gz LKCKWDQXAMDGMG-ZIAGYGMSSA-N -1 3 305.418 3.919 20 10 DHCDHM Cc1nc([C@@H]2CCCCN2Cc2cc(Cl)c(C)cc2[O-])no1 ZINC000824600636 1030591458 /nfs/dbraw/zinc/59/14/58/1030591458.db2.gz AFPQGDDVILNKGY-AWEZNQCLSA-N -1 3 321.808 3.773 20 10 DHCDHM CO[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1(C)C ZINC000824820855 1030647383 /nfs/dbraw/zinc/64/73/83/1030647383.db2.gz OWHFTXUCPKNIGQ-ZDUSSCGKSA-N -1 3 318.244 3.946 20 10 DHCDHM CO[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1C ZINC000824815793 1030647414 /nfs/dbraw/zinc/64/74/14/1030647414.db2.gz ZSIHSKWVLDDYAZ-TVQRCGJNSA-N -1 3 304.217 3.556 20 10 DHCDHM [O-]c1c(CNCc2cccc(OC3CC3)c2F)ccc(F)c1F ZINC000877627174 1033389436 /nfs/dbraw/zinc/38/94/36/1033389436.db2.gz LAJJRLQFASERJG-UHFFFAOYSA-N -1 3 323.314 3.641 20 10 DHCDHM C[C@@H](Nc1cccc(-n2nccn2)c1)c1ccc(Cl)cc1[O-] ZINC000864023604 1034263639 /nfs/dbraw/zinc/26/36/39/1034263639.db2.gz SCIOADSYMADGMS-LLVKDONJSA-N -1 3 314.776 3.799 20 10 DHCDHM CN(C)c1ccc(/C=C/C(=O)Nc2cc([O-])cc(Cl)c2)cc1 ZINC001180128192 1035604464 /nfs/dbraw/zinc/60/44/64/1035604464.db2.gz FDIXQHOVUBMSGN-VMPITWQZSA-N -1 3 316.788 3.764 20 10 DHCDHM Cc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c([O-])c1 ZINC000914484659 1035950071 /nfs/dbraw/zinc/95/00/71/1035950071.db2.gz LGBJCNOYUXPQFN-UHFFFAOYSA-N -1 3 324.424 3.571 20 10 DHCDHM CC[C@@H](C)OC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001195144256 1036150005 /nfs/dbraw/zinc/15/00/05/1036150005.db2.gz LFONYIOUQHOPOD-SECBINFHSA-N -1 3 308.765 3.619 20 10 DHCDHM CSC1CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])CC1 ZINC000312255470 1036235643 /nfs/dbraw/zinc/23/56/43/1036235643.db2.gz LCJLKTBBEWLXRU-UHFFFAOYSA-N -1 3 313.850 3.576 20 10 DHCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC(OCC2CC2)CC1 ZINC000775726773 1036575850 /nfs/dbraw/zinc/57/58/50/1036575850.db2.gz WHNGRCKRAOAOJA-UHFFFAOYSA-N -1 3 313.800 3.576 20 10 DHCDHM COc1c([O-])c(CNc2ccc(Cl)cc2C)ccc1[N+](=O)[O-] ZINC000774927718 1037239132 /nfs/dbraw/zinc/23/91/32/1037239132.db2.gz IOAXIFRGUQYPPA-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM [O-]c1c(CNc2nccnc2Cl)cc(Cl)c2cccnc12 ZINC001168522068 1038007069 /nfs/dbraw/zinc/00/70/69/1038007069.db2.gz OMUAQYLJKWWZSI-UHFFFAOYSA-N -1 3 321.167 3.649 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccc(Br)nc1 ZINC000225945032 1039266908 /nfs/dbraw/zinc/26/69/08/1039266908.db2.gz ZZWGQVXMWOKLMK-UHFFFAOYSA-N -1 3 313.582 3.815 20 10 DHCDHM C[C@H](NCc1c(F)cccc1OC(F)F)c1ccccc1[O-] ZINC000272914181 130074267 /nfs/dbraw/zinc/07/42/67/130074267.db2.gz WZUKCHDOGWYWTC-JTQLQIEISA-N -1 3 311.303 3.984 20 10 DHCDHM COc1cccc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273390284 130116366 /nfs/dbraw/zinc/11/63/66/130116366.db2.gz KKZFVNGIPNHEOH-VXGBXAGGSA-N -1 3 316.357 3.721 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1nnc(CC(F)(F)F)s1 ZINC000274564176 130245311 /nfs/dbraw/zinc/24/53/11/130245311.db2.gz CWCIJBBVRMLYET-UHFFFAOYSA-N -1 3 323.727 3.614 20 10 DHCDHM Cc1ccc([C@@H](C)NCc2ccn(Cc3ccccc3)n2)c([O-])c1 ZINC000284361159 131073398 /nfs/dbraw/zinc/07/33/98/131073398.db2.gz MZJFTFYTUVINFA-MRXNPFEDSA-N -1 3 321.424 3.796 20 10 DHCDHM CC[C@H](NCc1csc([C@H](C)OC)n1)c1ccc(F)cc1[O-] ZINC000285937429 131211361 /nfs/dbraw/zinc/21/13/61/131211361.db2.gz FNTSCQJOWNEMDD-HZMBPMFUSA-N -1 3 324.421 3.936 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000286148499 131222696 /nfs/dbraw/zinc/22/26/96/131222696.db2.gz NYVYVGCHOXPPAW-UAGQMJEPSA-N -1 3 323.392 3.506 20 10 DHCDHM COCCOc1ccc(N[C@H](C)c2cc(F)ccc2[O-])cc1 ZINC000176985052 332967027 /nfs/dbraw/zinc/96/70/27/332967027.db2.gz VAIJWCQEWFTJRY-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM Cc1nn(C)c(C)c1N[C@H](C)c1ccc(Br)cc1[O-] ZINC000273410777 334046201 /nfs/dbraw/zinc/04/62/01/334046201.db2.gz HTMWDIIXKCKTHQ-MRVPVSSYSA-N -1 3 324.222 3.678 20 10 DHCDHM CC[C@@H](NCc1nc(C)n2c1CCCC2)c1ccc(F)cc1[O-] ZINC000368616593 336849289 /nfs/dbraw/zinc/84/92/89/336849289.db2.gz DQODLHWYWZPHBN-OAHLLOKOSA-N -1 3 317.408 3.613 20 10 DHCDHM COc1ccc2c(c1)OCC[C@@H]2N[C@H](C)c1ccc(F)cc1[O-] ZINC000371871234 336915379 /nfs/dbraw/zinc/91/53/79/336915379.db2.gz YLNVKQBFUFOLRA-BZNIZROVSA-N -1 3 317.360 3.714 20 10 DHCDHM Cc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(F)c(F)c1[O-])CO2 ZINC000372621752 336936429 /nfs/dbraw/zinc/93/64/29/336936429.db2.gz SDXLPLCJTHECJD-QMTHXVAHSA-N -1 3 305.324 3.763 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC([C@@H]2CCCO2)CC1 ZINC000373821094 336973849 /nfs/dbraw/zinc/97/38/49/336973849.db2.gz FHZCEQAHLXUAHF-HNNXBMFYSA-N -1 3 313.800 3.576 20 10 DHCDHM C[C@H]1Oc2cc(F)ccc2[C@@H]1NCc1cccc(Cl)c1[O-] ZINC000377835608 337062116 /nfs/dbraw/zinc/06/21/16/337062116.db2.gz VIRKNJQBPGWCDC-RFAUZJTJSA-N -1 3 307.752 3.797 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccccc1[O-])c1noc(-c2ccccc2)n1 ZINC000183562730 337192376 /nfs/dbraw/zinc/19/23/76/337192376.db2.gz VMFWGGQNAVLECS-QWHCGFSZSA-N -1 3 309.369 3.854 20 10 DHCDHM C[C@H](NCc1ncc(-c2ccccc2)cn1)c1ccc(F)cc1[O-] ZINC000186063295 337253184 /nfs/dbraw/zinc/25/31/84/337253184.db2.gz WCSWGSCFOFBJMZ-ZDUSSCGKSA-N -1 3 323.371 3.839 20 10 DHCDHM COc1ccc([C@H](C)NCc2cc(Cl)ccc2[O-])c(OC)c1 ZINC000237249160 341209956 /nfs/dbraw/zinc/20/99/56/341209956.db2.gz SOXXXAQLLGJPIL-NSHDSACASA-N -1 3 321.804 3.914 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CNC(C)(C)c2nccs2)c1[O-] ZINC000267360990 518277828 /nfs/dbraw/zinc/27/78/28/518277828.db2.gz IEBPDIGKJNEMNO-UHFFFAOYSA-N -1 3 324.833 3.730 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cccc([N+](=O)[O-])c1 ZINC000191222949 525606468 /nfs/dbraw/zinc/60/64/68/525606468.db2.gz XJMXOLHIZZPPDV-ZJUUUORDSA-N -1 3 322.311 3.990 20 10 DHCDHM C[C@H](N[C@H]1CN(C)Cc2ccccc21)c1ccc(F)c(F)c1[O-] ZINC000364793677 525633393 /nfs/dbraw/zinc/63/33/93/525633393.db2.gz QMKQKUIQGWLGDX-ZBEGNZNMSA-N -1 3 318.367 3.508 20 10 DHCDHM Cc1nc(C2(NCc3cc(Cl)cc(C)c3[O-])CCCC2)no1 ZINC000181791553 526769102 /nfs/dbraw/zinc/76/91/02/526769102.db2.gz MSFJEYMRADENRI-UHFFFAOYSA-N -1 3 321.808 3.605 20 10 DHCDHM CC(C)COC[C@@H](N[C@H]1CCc2cccc([O-])c21)c1ccco1 ZINC000297833972 535181678 /nfs/dbraw/zinc/18/16/78/535181678.db2.gz RXZDQMDTRKJKPR-JKSUJKDBSA-N -1 3 315.413 3.976 20 10 DHCDHM CC[C@@H](Nc1ccc(OC2COC2)cc1)c1ccc(F)cc1[O-] ZINC000287297631 535809832 /nfs/dbraw/zinc/80/98/32/535809832.db2.gz DMBDNXIHFOBPPW-QGZVFWFLSA-N -1 3 317.360 3.872 20 10 DHCDHM O=C([O-])c1cc2ccccc2c(CN2Cc3ccccc3C2)c1O ZINC000740098788 599955010 /nfs/dbraw/zinc/95/50/10/599955010.db2.gz UYRYZVKLEPFULF-UHFFFAOYSA-N -1 3 319.360 3.759 20 10 DHCDHM [O-]c1c(Cl)cc(Cl)cc1CNCc1ccc2c(n1)CCC2 ZINC000839107078 1013508914 /nfs/dbraw/zinc/50/89/14/1013508914.db2.gz VBLJJDQIEDRCNA-UHFFFAOYSA-N -1 3 323.223 3.873 20 10 DHCDHM Cc1cccc(C2=CCN(C(=O)c3cccc(O)c3[O-])CC2)c1C ZINC000891344470 1014462546 /nfs/dbraw/zinc/46/25/46/1014462546.db2.gz VZFOZGZLDXAPKL-UHFFFAOYSA-N -1 3 323.392 3.644 20 10 DHCDHM C[C@@H]([NH2+][C@@H](C)CCc1ccccc1)c1cc(C(=O)[O-])ccc1[O-] ZINC001592541264 978428313 /nfs/dbraw/zinc/42/83/13/978428313.db2.gz WJBFEDXQMHITQP-UONOGXRCSA-N -1 3 313.397 3.762 20 10 DHCDHM C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1cc(C(=O)[O-])ccc1[O-] ZINC001593208303 994224305 /nfs/dbraw/zinc/22/43/05/994224305.db2.gz AUOYJNOTSWFCTH-CYBMUJFWSA-N -1 3 311.381 3.820 20 10 DHCDHM C[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1cc(C(=O)[O-])ccc1O ZINC001593296762 994698685 /nfs/dbraw/zinc/69/86/85/994698685.db2.gz PTJWBHPKOBJVEC-UHIISALHSA-N -1 3 315.369 3.658 20 10 DHCDHM C[C@H](NCc1cccc(Cl)c1F)c1cc(C(=O)[O-])ccc1O ZINC001593303763 994737840 /nfs/dbraw/zinc/73/78/40/994737840.db2.gz FOTVWQZTYRNDQQ-VIFPVBQESA-N -1 3 323.751 3.734 20 10 DHCDHM CC[C@H](NCC(C)(F)F)c1cc(Br)ccc1[O-] ZINC000700111146 1017821040 /nfs/dbraw/zinc/82/10/40/1017821040.db2.gz SVZMPSMRCGNKRJ-JTQLQIEISA-N -1 3 308.166 3.851 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@H]1c2ccccc2OC[C@@H]1F ZINC000922519523 1020109444 /nfs/dbraw/zinc/10/94/44/1020109444.db2.gz CMQZUNVXAJLQOQ-BBRMVZONSA-N -1 3 307.752 3.607 20 10 DHCDHM Cc1nc(C2(NCc3cc(Cl)ccc3[O-])CCCCC2)no1 ZINC000725850648 1020955807 /nfs/dbraw/zinc/95/58/07/1020955807.db2.gz FYGGMQPDBQQMJB-UHFFFAOYSA-N -1 3 321.808 3.686 20 10 DHCDHM COCc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1OC ZINC000858568874 1032949211 /nfs/dbraw/zinc/94/92/11/1032949211.db2.gz ZHVPZSFEMVPEFS-NSHDSACASA-N -1 3 305.349 3.859 20 10 DHCDHM COc1ccc(CN2CC[C@H](F)C(F)(F)CC2)c([O-])c1Cl ZINC001236802015 1021288284 /nfs/dbraw/zinc/28/82/84/1021288284.db2.gz MRPJHSHGJPDCAA-NSHDSACASA-N -1 3 323.742 3.623 20 10 DHCDHM CC(=O)N(C)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000744449576 1021549980 /nfs/dbraw/zinc/54/99/80/1021549980.db2.gz KFYSOQYSDHOUIJ-UHFFFAOYSA-N -1 3 304.777 3.640 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(N3CCCC3)c2)c([O-])c1C ZINC000919749444 1021882582 /nfs/dbraw/zinc/88/25/82/1021882582.db2.gz XCJHNPWONUVGBO-UHFFFAOYSA-N -1 3 310.397 3.862 20 10 DHCDHM Cc1c([C@H]2CCCN2Cc2c([O-])ccc(Cl)c2F)cnn1C ZINC000364473700 1023221988 /nfs/dbraw/zinc/22/19/88/1023221988.db2.gz ULOMEHKWZSKEHX-CQSZACIVSA-N -1 3 323.799 3.564 20 10 DHCDHM Cc1nc2c(s1)[C@@H](N(C)Cc1ccc(F)c(F)c1[O-])CCC2 ZINC000876732479 1033128598 /nfs/dbraw/zinc/12/85/98/1033128598.db2.gz XEARPXFIJPQDHK-ZDUSSCGKSA-N -1 3 324.396 3.945 20 10 DHCDHM Cc1ccc2c(c1C)OC[C@H]2NCc1ccc(F)c(F)c1[O-] ZINC000876876413 1033172529 /nfs/dbraw/zinc/17/25/29/1033172529.db2.gz PGQTUXFMNWSOTK-CQSZACIVSA-N -1 3 305.324 3.511 20 10 DHCDHM COc1ccc(OC)c([C@H](C)NCc2cc(F)cc(F)c2[O-])c1 ZINC000882880071 1024156795 /nfs/dbraw/zinc/15/67/95/1024156795.db2.gz AOBOZNTUYVGZID-JTQLQIEISA-N -1 3 323.339 3.538 20 10 DHCDHM CCCN(C(=O)c1cccc(O)c1[O-])[C@H]1CCc2ccccc21 ZINC000790597457 1024332096 /nfs/dbraw/zinc/33/20/96/1024332096.db2.gz OSBXGTWIZNXXTD-INIZCTEOSA-N -1 3 311.381 3.638 20 10 DHCDHM C[C@@H](NC1(c2ncccn2)CCC1)c1cc(Cl)ccc1[O-] ZINC000883312097 1024361989 /nfs/dbraw/zinc/36/19/89/1024361989.db2.gz TZZWEIIRHNLJMG-LLVKDONJSA-N -1 3 303.793 3.566 20 10 DHCDHM C[C@H](NC1(c2ncccn2)CCC1)c1cc(Cl)ccc1[O-] ZINC000883312098 1024364119 /nfs/dbraw/zinc/36/41/19/1024364119.db2.gz TZZWEIIRHNLJMG-NSHDSACASA-N -1 3 303.793 3.566 20 10 DHCDHM CCOC1CCN(Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000132462119 1024478265 /nfs/dbraw/zinc/47/82/65/1024478265.db2.gz QVLRVYVBJZAZKP-UHFFFAOYSA-N -1 3 304.217 3.700 20 10 DHCDHM CC[C@H](C)Oc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000318723027 1024847703 /nfs/dbraw/zinc/84/77/03/1024847703.db2.gz FNSAIXIRBVBXIW-NSHDSACASA-N -1 3 301.342 3.527 20 10 DHCDHM C[C@@H](NCc1ccccc1OC(F)F)c1c([O-])cccc1F ZINC000886495407 1025651329 /nfs/dbraw/zinc/65/13/29/1025651329.db2.gz XANYMZVIRVWLMZ-SNVBAGLBSA-N -1 3 311.303 3.984 20 10 DHCDHM C[C@@H](N[C@@H]1COc2c1cccc2Cl)c1c([O-])cccc1F ZINC000886552326 1025700450 /nfs/dbraw/zinc/70/04/50/1025700450.db2.gz ZBJLGYGWXVPUPS-NOZJJQNGSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561874 1025705483 /nfs/dbraw/zinc/70/54/83/1025705483.db2.gz LPDUWBCMSJDSTI-MNOVXSKESA-N -1 3 304.321 3.851 20 10 DHCDHM C[C@H](N[C@@H](C)c1c([O-])cccc1F)c1ccccc1[N+](=O)[O-] ZINC000886561875 1025707869 /nfs/dbraw/zinc/70/78/69/1025707869.db2.gz LPDUWBCMSJDSTI-QWRGUYRKSA-N -1 3 304.321 3.851 20 10 DHCDHM COc1cc(N[C@H](C)c2c([O-])cccc2F)cc(OC)c1OC ZINC000886563932 1025711065 /nfs/dbraw/zinc/71/10/65/1025711065.db2.gz JKROHWYIUPGIDE-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM COCCOc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1 ZINC000886566275 1025712789 /nfs/dbraw/zinc/71/27/89/1025712789.db2.gz NDPMEBWMOGJPFF-GFCCVEGCSA-N -1 3 305.349 3.730 20 10 DHCDHM C[C@H](Nc1ccc(O[C@H]2CCOC2)cc1)c1c([O-])cccc1F ZINC000886575136 1025715327 /nfs/dbraw/zinc/71/53/27/1025715327.db2.gz HAEMUEQEMAOMKP-WFASDCNBSA-N -1 3 317.360 3.872 20 10 DHCDHM COc1cc(OC)c(N[C@H](C)c2c([O-])cccc2F)cc1F ZINC000886586427 1025725186 /nfs/dbraw/zinc/72/51/86/1025725186.db2.gz RHKZFBYFUQHNKD-SECBINFHSA-N -1 3 309.312 3.861 20 10 DHCDHM COCCOCc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1 ZINC000886642780 1025754105 /nfs/dbraw/zinc/75/41/05/1025754105.db2.gz APVOIZMMGZUFRJ-CYBMUJFWSA-N -1 3 319.376 3.867 20 10 DHCDHM COCc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1OC ZINC000886643036 1025756420 /nfs/dbraw/zinc/75/64/20/1025756420.db2.gz JGLJEQCYBLURRZ-NSHDSACASA-N -1 3 305.349 3.859 20 10 DHCDHM CC(C)n1nccc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000809774331 1026607862 /nfs/dbraw/zinc/60/78/62/1026607862.db2.gz KLQDPESVGMNZTN-UHFFFAOYSA-N -1 3 314.216 3.766 20 10 DHCDHM C[C@H]1Oc2ccccc2[C@@H]1NCc1cc(Cl)cc(F)c1[O-] ZINC000809787458 1026626154 /nfs/dbraw/zinc/62/61/54/1026626154.db2.gz DLSPBZDSVNWLFM-RFAUZJTJSA-N -1 3 307.752 3.797 20 10 DHCDHM CO[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CC[C@@H]1C ZINC000188294704 1028505104 /nfs/dbraw/zinc/50/51/04/1028505104.db2.gz WYMJDNAIUNXDDY-ZANVPECISA-N -1 3 304.217 3.556 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000188352900 1028505206 /nfs/dbraw/zinc/50/52/06/1028505206.db2.gz AHUVCDSRUPGDFJ-KRWDZBQOSA-N -1 3 323.392 3.780 20 10 DHCDHM CN(Cc1ccc2c(c1)OCO2)Cc1cc(Cl)c(F)cc1[O-] ZINC000816482734 1028892798 /nfs/dbraw/zinc/89/27/98/1028892798.db2.gz QQBWVJKMQKDVGY-UHFFFAOYSA-N -1 3 323.751 3.545 20 10 DHCDHM C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816594753 1028956944 /nfs/dbraw/zinc/95/69/44/1028956944.db2.gz OGSDGCXSWYGKJE-APPZFPTMSA-N -1 3 311.706 3.957 20 10 DHCDHM CC(C)c1ncc(CN(C)Cc2cc(Cl)c(F)cc2[O-])cn1 ZINC000816599597 1028957381 /nfs/dbraw/zinc/95/73/81/1028957381.db2.gz RXCLFDBBVZNBJR-UHFFFAOYSA-N -1 3 323.799 3.730 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1c(F)cc(F)cc1F ZINC000816651060 1028978299 /nfs/dbraw/zinc/97/82/99/1028978299.db2.gz QXAHWLHOGODWEY-UHFFFAOYSA-N -1 3 319.685 3.892 20 10 DHCDHM Cc1cccc(C2(NC(=O)c3cccc(O)c3[O-])CCCC2)c1 ZINC001136593032 1030044207 /nfs/dbraw/zinc/04/42/07/1030044207.db2.gz PGBWTYYPVQNDOG-UHFFFAOYSA-N -1 3 311.381 3.606 20 10 DHCDHM Cc1cc(Br)c([O-])c(CNc2cccc(CO)c2)c1 ZINC000789561462 1030795752 /nfs/dbraw/zinc/79/57/52/1030795752.db2.gz DOROIVHBHPJYSB-UHFFFAOYSA-N -1 3 322.202 3.568 20 10 DHCDHM O=C(c1cccc(O)c1[O-])N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000844105283 1030964894 /nfs/dbraw/zinc/96/48/94/1030964894.db2.gz GVSLEFHTGMFHHG-SFHVURJKSA-N -1 3 321.376 3.631 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCC2(CC2)CC1 ZINC001144293931 1031432070 /nfs/dbraw/zinc/43/20/70/1031432070.db2.gz VSUPTLSKIJIBOL-UHFFFAOYSA-N -1 3 314.198 3.670 20 10 DHCDHM CC1(F)CCN(Cc2cc(Br)c(F)cc2[O-])CC1 ZINC001144298849 1031439595 /nfs/dbraw/zinc/43/95/95/1031439595.db2.gz LHQNSBGEWYBYTJ-UHFFFAOYSA-N -1 3 320.177 3.618 20 10 DHCDHM [O-]c1cc(F)c(Br)cc1CN1CCC[C@H](F)CC1 ZINC001144299029 1031439625 /nfs/dbraw/zinc/43/96/25/1031439625.db2.gz PESFBTHBWMEFFJ-JTQLQIEISA-N -1 3 320.177 3.618 20 10 DHCDHM C[C@@H]1CN(Cc2cc(Br)c(F)cc2[O-])C2(CC2)C1 ZINC001144308129 1031459391 /nfs/dbraw/zinc/45/93/91/1031459391.db2.gz QOZNOZJSTNWCON-VIFPVBQESA-N -1 3 314.198 3.668 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1ccc(O[C@H]2CCOC2)cc1 ZINC000152809258 1033544875 /nfs/dbraw/zinc/54/48/75/1033544875.db2.gz OPOGUTJSIOYLJF-AWEZNQCLSA-N -1 3 319.788 3.825 20 10 DHCDHM C[C@@H](c1ccccn1)N(C)Cc1c([O-])cccc1Br ZINC000862301717 1033816478 /nfs/dbraw/zinc/81/64/78/1033816478.db2.gz IGQHRZLIJVKREM-NSHDSACASA-N -1 3 321.218 3.743 20 10 DHCDHM CC[C@@H](C)[C@H](C(=O)NCc1c([O-])cccc1F)c1ccccc1 ZINC001178412684 1035429142 /nfs/dbraw/zinc/42/91/42/1035429142.db2.gz FCZPKXSBLVWKLI-ACJLOTCBSA-N -1 3 315.388 3.977 20 10 DHCDHM O=C(NCc1c([O-])cccc1F)c1cc2ccc(Cl)cc2[nH]1 ZINC001178410871 1035429151 /nfs/dbraw/zinc/42/91/51/1035429151.db2.gz WRSYDWCNEIJUQL-UHFFFAOYSA-N -1 3 318.735 3.596 20 10 DHCDHM C/C=C(C)/C=C/C(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001178511326 1035432789 /nfs/dbraw/zinc/43/27/89/1035432789.db2.gz BZOOUEKIBVRCGM-INLLIYESSA-N -1 3 316.788 3.732 20 10 DHCDHM Cc1nnc(CN[C@H](C)c2cc(Cl)c(Cl)cc2[O-])s1 ZINC000774357131 1036313062 /nfs/dbraw/zinc/31/30/62/1036313062.db2.gz YZOOLCCHOQMCQR-ZCFIWIBFSA-N -1 3 318.229 3.710 20 10 DHCDHM Cc1cccc(CC2CN(Cc3ccc(F)c(F)c3[O-])C2)c1 ZINC001183025298 1036505784 /nfs/dbraw/zinc/50/57/84/1036505784.db2.gz RNBACKGJYOJQOM-UHFFFAOYSA-N -1 3 303.352 3.653 20 10 DHCDHM CSCC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC001184097844 1036743075 /nfs/dbraw/zinc/74/30/75/1036743075.db2.gz ONFPPRSDYNIWHT-UHFFFAOYSA-N -1 3 303.830 3.760 20 10 DHCDHM Cc1cnc(C(C)(C)NCc2cc(Cl)cc(F)c2[O-])s1 ZINC000776230636 1037938446 /nfs/dbraw/zinc/93/84/46/1037938446.db2.gz KINXZDJEWREHPM-UHFFFAOYSA-N -1 3 314.813 3.975 20 10 DHCDHM Cc1cc(Br)c([O-])c(CNc2ncccc2F)c1 ZINC000776264455 1038120085 /nfs/dbraw/zinc/12/00/85/1038120085.db2.gz IYUHXEYPEARSMP-UHFFFAOYSA-N -1 3 311.154 3.609 20 10 DHCDHM CCOc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000273437439 130122317 /nfs/dbraw/zinc/12/23/17/130122317.db2.gz XJGAVBRIHXTWMP-LBPRGKRZSA-N -1 3 316.357 3.550 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1[O-] ZINC000273533393 130134231 /nfs/dbraw/zinc/13/42/31/130134231.db2.gz WVRSSGFZYVQJJB-WDEREUQCSA-N -1 3 304.321 3.851 20 10 DHCDHM CO[C@@H](C)c1nc(CN[C@@H](C)c2ccc(F)cc2[O-])cs1 ZINC000273551093 130134940 /nfs/dbraw/zinc/13/49/40/130134940.db2.gz FWIBANWYPFIFEA-UWVGGRQHSA-N -1 3 310.394 3.546 20 10 DHCDHM CC[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1[O-] ZINC000286100614 131219392 /nfs/dbraw/zinc/21/93/92/131219392.db2.gz NGJZTQXPNPOTBZ-AWEZNQCLSA-N -1 3 304.321 3.680 20 10 DHCDHM C[C@@H](N[C@@H](C)C(F)(F)F)c1ccc(Br)cc1[O-] ZINC000287262330 131272169 /nfs/dbraw/zinc/27/21/69/131272169.db2.gz ILZHQWYHTNDZEJ-RQJHMYQMSA-N -1 3 312.129 3.756 20 10 DHCDHM C[C@@H](N[C@H](C)C(F)(F)F)c1cc(Br)ccc1[O-] ZINC000287310430 131274193 /nfs/dbraw/zinc/27/41/93/131274193.db2.gz LEHIEQKYBUWWFZ-RNFRBKRXSA-N -1 3 312.129 3.756 20 10 DHCDHM [O-]c1ccccc1CN1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000289141961 131361469 /nfs/dbraw/zinc/36/14/69/131361469.db2.gz AJTUYIUBOOCYGV-HNNXBMFYSA-N -1 3 313.401 3.770 20 10 DHCDHM C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1[O-] ZINC000297255476 335152222 /nfs/dbraw/zinc/15/22/22/335152222.db2.gz JOSHWXUHRQEIQQ-WDEREUQCSA-N -1 3 304.321 3.851 20 10 DHCDHM Cc1ccc(-c2cnccn2)cc1NCc1cccc(F)c1[O-] ZINC000373484815 336961951 /nfs/dbraw/zinc/96/19/51/336961951.db2.gz YEHVPYIXUFADPB-UHFFFAOYSA-N -1 3 309.344 3.909 20 10 DHCDHM Cc1cc(Cl)cc(CN2CCO[C@H](c3ccco3)C2)c1[O-] ZINC000180629045 337176818 /nfs/dbraw/zinc/17/68/18/337176818.db2.gz ZJPREEKHMBVWND-HNNXBMFYSA-N -1 3 307.777 3.521 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)CN(C)C(=O)N2)c1cc(F)ccc1[O-] ZINC000186535307 337257334 /nfs/dbraw/zinc/25/73/34/337257334.db2.gz MPCISQSUNQVWFN-SNVBAGLBSA-N -1 3 315.348 3.682 20 10 DHCDHM COC[C@@H](NCc1cc(Cl)cc(C)c1[O-])c1ccc(C)o1 ZINC000182530121 522360406 /nfs/dbraw/zinc/36/04/06/522360406.db2.gz SZSCGEXPHKSAAV-CQSZACIVSA-N -1 3 309.793 3.733 20 10 DHCDHM Cc1ccc([C@@H](C)NCc2cc(COC(C)(C)C)on2)c([O-])c1 ZINC000186809358 525730914 /nfs/dbraw/zinc/73/09/14/525730914.db2.gz ZMIRIJONFDMAEY-CYBMUJFWSA-N -1 3 318.417 3.855 20 10 DHCDHM Cc1ccc(C(=O)N2CCC[C@H]2c2ccc(F)cc2)c([O-])c1O ZINC000267544016 526105699 /nfs/dbraw/zinc/10/56/99/526105699.db2.gz BCLYXPYSSPPATQ-HNNXBMFYSA-N -1 3 315.344 3.523 20 10 DHCDHM CC[C@H](N[C@H](CO)c1ccccc1)c1cccc(Cl)c1[O-] ZINC000287292278 535944338 /nfs/dbraw/zinc/94/43/38/535944338.db2.gz BZBAULLJKAZUFW-JKSUJKDBSA-N -1 3 305.805 3.820 20 10 DHCDHM O=C([O-])c1ccc(C[N@H+](Cc2ccccc2[O-])C2CCCC2)o1 ZINC000740123289 600318618 /nfs/dbraw/zinc/31/86/18/600318618.db2.gz DXRSZJXTSDKFHQ-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM O=C([O-])c1ccc(C[N@@H+](Cc2ccccc2[O-])C2CCCC2)o1 ZINC000740123289 600318621 /nfs/dbraw/zinc/31/86/21/600318621.db2.gz DXRSZJXTSDKFHQ-UHFFFAOYSA-N -1 3 315.369 3.628 20 10 DHCDHM CC(C)(C)[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)[O-] ZINC000833426515 605753007 /nfs/dbraw/zinc/75/30/07/605753007.db2.gz NZOBJLQUQHIKHP-KRWDZBQOSA-N -1 3 313.397 3.648 20 10 DHCDHM C[C@@H](C[NH2+][C@@H](C)c1cc(C(=O)[O-])ccc1[O-])Cc1cccs1 ZINC001592705701 979171632 /nfs/dbraw/zinc/17/16/32/979171632.db2.gz HNRJHZYVXWEIIX-NEPJUHHUSA-N -1 3 319.426 3.681 20 10 DHCDHM C[C@@H](C[NH2+][C@H](C)c1cc(C(=O)[O-])ccc1[O-])Cc1cccs1 ZINC001592705713 979171845 /nfs/dbraw/zinc/17/18/45/979171845.db2.gz HNRJHZYVXWEIIX-VXGBXAGGSA-N -1 3 319.426 3.681 20 10 DHCDHM CC[C@H](N[C@@H](C)c1ncc(C(=O)[O-])s1)c1ccc(C)cc1O ZINC001595281290 980332464 /nfs/dbraw/zinc/33/24/64/980332464.db2.gz LMZDCLMEAPQEKK-JQWIXIFHSA-N -1 3 320.414 3.657 20 10 DHCDHM CCCC[N@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccccc1 ZINC001595748134 982417540 /nfs/dbraw/zinc/41/75/40/982417540.db2.gz UIQWWOFVXLQRBV-GOSISDBHSA-N -1 3 313.397 3.820 20 10 DHCDHM CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccccc1 ZINC001595748134 982417543 /nfs/dbraw/zinc/41/75/43/982417543.db2.gz UIQWWOFVXLQRBV-GOSISDBHSA-N -1 3 313.397 3.820 20 10 DHCDHM CCCC[N@H+](Cc1ccc(C(=O)[O-])cc1)Cc1ccccc1[O-] ZINC001595749068 982419827 /nfs/dbraw/zinc/41/98/27/982419827.db2.gz DLQFVOKDILIZAT-UHFFFAOYSA-N -1 3 313.397 3.893 20 10 DHCDHM CCCC[N@@H+](Cc1ccc(C(=O)[O-])cc1)Cc1ccccc1[O-] ZINC001595749068 982419833 /nfs/dbraw/zinc/41/98/33/982419833.db2.gz DLQFVOKDILIZAT-UHFFFAOYSA-N -1 3 313.397 3.893 20 10 DHCDHM C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1cc(C(=O)[O-])ccc1[O-] ZINC001593219444 994299962 /nfs/dbraw/zinc/29/99/62/994299962.db2.gz OEYVWSNVJKZYFX-SJCJKPOMSA-N -1 3 311.381 3.819 20 10 DHCDHM C[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1cc(C(=O)[O-])ccc1O ZINC001593296758 994697958 /nfs/dbraw/zinc/69/79/58/994697958.db2.gz PTJWBHPKOBJVEC-MJVIPROJSA-N -1 3 315.369 3.658 20 10 DHCDHM C[C@@H]1CCCCN1Cc1cc(Br)cc(F)c1[O-] ZINC000715702488 1018939931 /nfs/dbraw/zinc/93/99/31/1018939931.db2.gz LCXBQZLESRFAST-SECBINFHSA-N -1 3 302.187 3.668 20 10 DHCDHM CC1(C)CCN(Cc2cc(Br)cc(F)c2[O-])C1 ZINC000715702588 1018940403 /nfs/dbraw/zinc/94/04/03/1018940403.db2.gz LZMHVIXADACWAQ-UHFFFAOYSA-N -1 3 302.187 3.526 20 10 DHCDHM COc1cc(N[C@H](C)c2ccc(F)cc2[O-])cc(OC)c1OC ZINC000170788754 1019435148 /nfs/dbraw/zinc/43/51/48/1019435148.db2.gz KCUDKBDJCCVEKW-SNVBAGLBSA-N -1 3 321.348 3.730 20 10 DHCDHM Cc1cc([O-])c(CNCc2nc3c(s2)CCC3)c(Cl)c1 ZINC000922473857 1020092164 /nfs/dbraw/zinc/09/21/64/1020092164.db2.gz ZJXUJEAQMUYUMU-UHFFFAOYSA-N -1 3 308.834 3.589 20 10 DHCDHM Cc1nc(CC(C)C)c(NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000182616289 1021741167 /nfs/dbraw/zinc/74/11/67/1021741167.db2.gz RRCLSMUKLOQJEC-UHFFFAOYSA-N -1 3 320.414 3.622 20 10 DHCDHM Cc1cc(C)c2c(c1)N(C(=O)c1ccc(C)c(O)c1[O-])CCC2 ZINC000179475600 1022448276 /nfs/dbraw/zinc/44/82/76/1022448276.db2.gz SXXQXJDPKSFVSD-UHFFFAOYSA-N -1 3 311.381 3.616 20 10 DHCDHM CC(C)N(CC(=O)OC(C)(C)C)Cc1cc(Cl)ccc1[O-] ZINC000769504224 1023169125 /nfs/dbraw/zinc/16/91/25/1023169125.db2.gz QVBTTXYIRJNGMP-UHFFFAOYSA-N -1 3 313.825 3.598 20 10 DHCDHM CN(Cc1ccccc1O)C(=O)c1cc2sccc2c([O-])c1 ZINC000788281812 1023869547 /nfs/dbraw/zinc/86/95/47/1023869547.db2.gz GDUGPBGXVKRDQS-UHFFFAOYSA-N -1 3 313.378 3.585 20 10 DHCDHM C[C@@H](NCc1cccnc1F)c1cccc(C(F)(F)F)c1[O-] ZINC000788805946 1023936660 /nfs/dbraw/zinc/93/66/60/1023936660.db2.gz MMTJPIXOYADRDO-SECBINFHSA-N -1 3 314.282 3.796 20 10 DHCDHM CC(C)Oc1ccccc1CNCc1cc(F)cc(F)c1[O-] ZINC000882910376 1024170552 /nfs/dbraw/zinc/17/05/52/1024170552.db2.gz QYBDYSYMPWKHCD-UHFFFAOYSA-N -1 3 307.340 3.747 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CNCc1ccccc1OCC1CC1 ZINC000883015944 1024212837 /nfs/dbraw/zinc/21/28/37/1024212837.db2.gz JLBYZSOQYQGIMB-UHFFFAOYSA-N -1 3 319.351 3.749 20 10 DHCDHM [O-]c1c(F)cc(F)cc1CN[C@H]1c2ccccc2CC[C@H]1F ZINC000883381970 1024414013 /nfs/dbraw/zinc/41/40/13/1024414013.db2.gz XFTPOXBXBKMRIZ-ZBFHGGJFSA-N -1 3 307.315 3.786 20 10 DHCDHM C[C@H](N[C@@H]1CCOc2ccc(F)cc21)c1c([O-])cccc1F ZINC000886547310 1025697021 /nfs/dbraw/zinc/69/70/21/1025697021.db2.gz IZXKZPNGMAHXOM-IINYFYTJSA-N -1 3 305.324 3.845 20 10 DHCDHM C[C@@H](N[C@H]1COc2c1cccc2Cl)c1c([O-])cccc1F ZINC000886552327 1025698002 /nfs/dbraw/zinc/69/80/02/1025698002.db2.gz ZBJLGYGWXVPUPS-RNCFNFMXSA-N -1 3 307.752 3.969 20 10 DHCDHM C[C@H](NCc1ccn(C2CCCC2)n1)c1c([O-])cccc1F ZINC000886553389 1025701073 /nfs/dbraw/zinc/70/10/73/1025701073.db2.gz MALFQSNMVUPCSP-LBPRGKRZSA-N -1 3 303.381 3.694 20 10 DHCDHM C[C@H](Nc1ccc(N2CCOCC2)cc1)c1c([O-])cccc1F ZINC000886564267 1025710706 /nfs/dbraw/zinc/71/07/06/1025710706.db2.gz RFRYJXOCISFRKC-ZDUSSCGKSA-N -1 3 316.376 3.541 20 10 DHCDHM COCCOc1cccc(N[C@@H](C)c2c([O-])cccc2F)c1 ZINC000886565860 1025710913 /nfs/dbraw/zinc/71/09/13/1025710913.db2.gz BHJDAJYEKURZQB-LBPRGKRZSA-N -1 3 305.349 3.730 20 10 DHCDHM COCCOc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1 ZINC000886566276 1025713309 /nfs/dbraw/zinc/71/33/09/1025713309.db2.gz NDPMEBWMOGJPFF-LBPRGKRZSA-N -1 3 305.349 3.730 20 10 DHCDHM COc1ccc(N[C@@H](C)c2c([O-])cccc2F)c(OC)c1OC ZINC000886576518 1025715270 /nfs/dbraw/zinc/71/52/70/1025715270.db2.gz IETTUIZMHLJKOW-JTQLQIEISA-N -1 3 321.348 3.730 20 10 DHCDHM CC[C@H](C)c1nnc([C@H](C)N[C@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886598643 1025729029 /nfs/dbraw/zinc/72/90/29/1025729029.db2.gz GRTMCZLZYBDFMS-AXFHLTTASA-N -1 3 306.385 3.575 20 10 DHCDHM COCCOCc1ccc(N[C@@H](C)c2c([O-])cccc2F)cc1 ZINC000886642781 1025752654 /nfs/dbraw/zinc/75/26/54/1025752654.db2.gz APVOIZMMGZUFRJ-ZDUSSCGKSA-N -1 3 319.376 3.867 20 10 DHCDHM [O-]c1c(Br)cccc1CN1CCCc2occc2C1 ZINC000809792186 1026629732 /nfs/dbraw/zinc/62/97/32/1026629732.db2.gz LHZYBZAJVXZKLN-UHFFFAOYSA-N -1 3 322.202 3.696 20 10 DHCDHM CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])[C@H]1C1CC1 ZINC000811513906 1027028522 /nfs/dbraw/zinc/02/85/22/1027028522.db2.gz VODXUHVKIUEQJX-AWEZNQCLSA-N -1 3 310.781 3.574 20 10 DHCDHM CCO[C@@H](C)c1nc(CN(C)Cc2cc(F)ccc2[O-])cs1 ZINC000779022896 1027891681 /nfs/dbraw/zinc/89/16/81/1027891681.db2.gz KSMMQXGVFKCKCN-NSHDSACASA-N -1 3 324.421 3.717 20 10 DHCDHM Cc1ccc(-c2cccnc2)cc1NC(=O)c1cccc(O)c1[O-] ZINC000366550599 1028096538 /nfs/dbraw/zinc/09/65/38/1028096538.db2.gz GEVZYHAZUPFADX-UHFFFAOYSA-N -1 3 320.348 3.721 20 10 DHCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000189424796 1028576628 /nfs/dbraw/zinc/57/66/28/1028576628.db2.gz AZCXMGFQDSCBNO-UHFFFAOYSA-N -1 3 319.426 3.879 20 10 DHCDHM C[C@@H](NCc1c(F)cc(F)cc1F)c1cc(F)cc(F)c1[O-] ZINC000815649549 1028592082 /nfs/dbraw/zinc/59/20/82/1028592082.db2.gz SRNPUPPWHYQTSJ-SSDOTTSWSA-N -1 3 317.257 3.939 20 10 DHCDHM CN(Cc1ccc(Cl)nc1)Cc1cc(Cl)c(F)cc1[O-] ZINC000816483870 1028891638 /nfs/dbraw/zinc/89/16/38/1028891638.db2.gz IFNIHHAFOSXTLY-UHFFFAOYSA-N -1 3 315.175 3.865 20 10 DHCDHM CCCN(Cc1ccccc1O)Cc1c(F)ccc([O-])c1F ZINC000816499024 1028906942 /nfs/dbraw/zinc/90/69/42/1028906942.db2.gz BJHJMWCZNPARIZ-UHFFFAOYSA-N -1 3 307.340 3.788 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@@H](CC(F)(F)F)C1 ZINC000816592283 1028939476 /nfs/dbraw/zinc/93/94/76/1028939476.db2.gz FSEPNJLCLDLTJS-QMMMGPOBSA-N -1 3 311.706 3.959 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@H]1c1cccnc1 ZINC000816610629 1028960010 /nfs/dbraw/zinc/96/00/10/1028960010.db2.gz RTFVKAZVYLLDPK-HNNXBMFYSA-N -1 3 306.768 3.917 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CN1CC(c2ccccc2F)C1 ZINC000816617429 1028964338 /nfs/dbraw/zinc/96/43/38/1028964338.db2.gz YUWDWQXPSUHJSO-UHFFFAOYSA-N -1 3 309.743 3.923 20 10 DHCDHM CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000819749370 1029609462 /nfs/dbraw/zinc/60/94/62/1029609462.db2.gz NTKKWZZXDXNJEF-HNNXBMFYSA-N -1 3 311.381 3.711 20 10 DHCDHM COCc1cc(NCc2c([O-])cccc2Cl)ccc1OC ZINC000865751565 1030004104 /nfs/dbraw/zinc/00/41/04/1030004104.db2.gz PZEPABGGMVIVLR-UHFFFAOYSA-N -1 3 307.777 3.813 20 10 DHCDHM CC(C)(C)OCc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000928387720 1031299675 /nfs/dbraw/zinc/29/96/75/1031299675.db2.gz FYWZFFDSVTVJQO-UHFFFAOYSA-N -1 3 315.369 3.665 20 10 DHCDHM C[C@@H]1CCN(Cc2cc(Br)c(F)cc2[O-])[C@H](C)C1 ZINC001144306476 1031452176 /nfs/dbraw/zinc/45/21/76/1031452176.db2.gz DARJJORCHWHBQL-NXEZZACHSA-N -1 3 316.214 3.914 20 10 DHCDHM C[C@@H]1C[C@@H](C)CCN1Cc1cc(Br)c(F)cc1[O-] ZINC001144306478 1031452853 /nfs/dbraw/zinc/45/28/53/1031452853.db2.gz DARJJORCHWHBQL-VHSXEESVSA-N -1 3 316.214 3.914 20 10 DHCDHM C[C@H]1CCN(Cc2cc(Br)c(F)cc2[O-])[C@@H](C)C1 ZINC001144306477 1031453059 /nfs/dbraw/zinc/45/30/59/1031453059.db2.gz DARJJORCHWHBQL-UWVGGRQHSA-N -1 3 316.214 3.914 20 10 DHCDHM CCc1nc([C@@H]2CCCCN2Cc2cc(Cl)ccc2[O-])no1 ZINC000361157568 1031763268 /nfs/dbraw/zinc/76/32/68/1031763268.db2.gz PHVCUNALISAUOH-ZDUSSCGKSA-N -1 3 321.808 3.718 20 10 DHCDHM C[C@H](NCc1cc(F)cc(F)c1[O-])c1cnn(CC2CCC2)c1 ZINC000898184701 1031985075 /nfs/dbraw/zinc/98/50/75/1031985075.db2.gz VPFCTIUTDOPGID-NSHDSACASA-N -1 3 321.371 3.518 20 10 DHCDHM Cc1cc([O-])c(CN2CC(C)(C)[C@@H]2c2nccn2C)cc1Cl ZINC000826043741 1033732363 /nfs/dbraw/zinc/73/23/63/1033732363.db2.gz QAZAYDSSAMRFHG-HNNXBMFYSA-N -1 3 319.836 3.671 20 10 DHCDHM C[C@H](c1ccncc1)N(C)Cc1c([O-])cccc1Br ZINC000862323070 1033817778 /nfs/dbraw/zinc/81/77/78/1033817778.db2.gz RTHGGEBBOPLIOW-LLVKDONJSA-N -1 3 321.218 3.743 20 10 DHCDHM Cc1ccc(N(CC2CC2)C(=O)c2cccc(O)c2[O-])cc1F ZINC000863600889 1034139953 /nfs/dbraw/zinc/13/99/53/1034139953.db2.gz JDSBUQFGFSBLLK-UHFFFAOYSA-N -1 3 315.344 3.602 20 10 DHCDHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1C[C@]1(F)c1ccccc1 ZINC001178998071 1035460624 /nfs/dbraw/zinc/46/06/24/1035460624.db2.gz BGGOKCCTRZFDBG-HOCLYGCPSA-N -1 3 309.743 3.912 20 10 DHCDHM [O-]c1c(F)cc(Br)cc1CN1CCCC2(CC2)C1 ZINC001181114119 1035837603 /nfs/dbraw/zinc/83/76/03/1035837603.db2.gz SARKACZHNUESRD-UHFFFAOYSA-N -1 3 314.198 3.670 20 10 DHCDHM COc1cccc2c1CCCCN2Cc1cccc(F)c1[O-] ZINC001182127800 1036101400 /nfs/dbraw/zinc/10/14/00/1036101400.db2.gz QWXOUQKJKKUHRX-UHFFFAOYSA-N -1 3 301.361 3.883 20 10 DHCDHM [O-]c1cc(F)c(F)cc1CN1CCC(Cc2nccs2)CC1 ZINC001183239328 1036553681 /nfs/dbraw/zinc/55/36/81/1036553681.db2.gz VKWIGSXKLURYMZ-UHFFFAOYSA-N -1 3 324.396 3.582 20 10 DHCDHM CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2ccccc2[O-])c1[O-] ZINC001197004492 1036667706 /nfs/dbraw/zinc/66/77/06/1036667706.db2.gz UFNAMNXKXUGTTO-SNVBAGLBSA-N -1 3 319.788 3.805 20 10 DHCDHM COc1c([O-])c(CNc2cccc(C(F)F)c2)ccc1[N+](=O)[O-] ZINC000774935822 1037251602 /nfs/dbraw/zinc/25/16/02/1037251602.db2.gz GVYFEDSDTWPQRO-UHFFFAOYSA-N -1 3 324.283 3.859 20 10 DHCDHM CN1C(=O)c2cc(Cl)ccc2N[C@H]1c1cc(Cl)ccc1[O-] ZINC000054682657 1037587820 /nfs/dbraw/zinc/58/78/20/1037587820.db2.gz FHNQNANYDNTFBW-CQSZACIVSA-N -1 3 323.179 3.895 20 10 DHCDHM O=c1cc(CSc2nccs2)nc(-c2ccccc2)[n-]1 ZINC001188661317 1037947932 /nfs/dbraw/zinc/94/79/32/1037947932.db2.gz ZFCLOLDHEPCDEO-UHFFFAOYSA-N -1 3 301.396 3.598 20 10 DHCDHM CC(C)(C)c1csc(CN[C@@H]2CCc3cccc([O-])c32)n1 ZINC000297576176 535149094 /nfs/dbraw/zinc/14/90/94/535149094.db2.gz GWTJJQUBFZQZEE-GFCCVEGCSA-N -1 3 302.443 3.923 20 10 DHCDHM CC[C@H](c1ccncc1)N(C)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000092223781 193176742 /nfs/dbraw/zinc/17/67/42/193176742.db2.gz PYFDGRWIGYGCLD-QGZVFWFLSA-N -1 3 316.376 3.712 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@H](C)c2cccnc2)c1[O-] ZINC000093227194 193219100 /nfs/dbraw/zinc/21/91/00/193219100.db2.gz FWTGXTOQPGNQLG-LLVKDONJSA-N -1 3 318.804 3.836 20 10 DHCDHM CCc1nn(C)cc1N[C@@H](C)c1cc(Br)ccc1[O-] ZINC000273351745 130109821 /nfs/dbraw/zinc/10/98/21/130109821.db2.gz BVEPMBLWEUAKMG-VIFPVBQESA-N -1 3 324.222 3.624 20 10 DHCDHM C[C@@H](NCc1cccc2c1OCCCO2)c1ccc(F)cc1[O-] ZINC000273347958 130110209 /nfs/dbraw/zinc/11/02/09/130110209.db2.gz BCRLCEOJUVJQRR-GFCCVEGCSA-N -1 3 317.360 3.543 20 10 DHCDHM C[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1[O-])c1ccc(F)cc1F ZINC000273414963 130119411 /nfs/dbraw/zinc/11/94/11/130119411.db2.gz QRWJQMLABQTOSK-NXEZZACHSA-N -1 3 322.311 3.990 20 10 DHCDHM COc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(F)cc1[O-])CCO2 ZINC000274359294 130228469 /nfs/dbraw/zinc/22/84/69/130228469.db2.gz IAGJGQDODYDHAC-BZNIZROVSA-N -1 3 317.360 3.714 20 10 DHCDHM Cc1ccc([C@H](C)NCc2ccn(Cc3ccccc3)n2)c([O-])c1 ZINC000284361156 131073040 /nfs/dbraw/zinc/07/30/40/131073040.db2.gz MZJFTFYTUVINFA-INIZCTEOSA-N -1 3 321.424 3.796 20 10 DHCDHM CCCOc1ccc(CN[C@H](C)c2c(F)cncc2F)c([O-])c1 ZINC000285571700 131182674 /nfs/dbraw/zinc/18/26/74/131182674.db2.gz UHIOOLBSMYHNOF-LLVKDONJSA-N -1 3 322.355 3.705 20 10 DHCDHM CC[C@H](NCc1cn2c(cccc2C)n1)c1ccc(F)cc1[O-] ZINC000286273078 131227248 /nfs/dbraw/zinc/22/72/48/131227248.db2.gz VLUZVNAGRDUBEE-INIZCTEOSA-N -1 3 313.376 3.728 20 10 DHCDHM COc1cc(Cl)cc(CN2CCCC[C@H]2c2cc[nH]n2)c1[O-] ZINC000289331198 131375246 /nfs/dbraw/zinc/37/52/46/131375246.db2.gz GVSCGIWYUPWFQR-AWEZNQCLSA-N -1 3 321.808 3.505 20 10 DHCDHM Cc1noc(CN(Cc2ccccc2[O-])[C@@H](C)c2ccccc2)n1 ZINC000299691723 132115407 /nfs/dbraw/zinc/11/54/07/132115407.db2.gz URIJRPDDQISAIE-AWEZNQCLSA-N -1 3 323.396 3.847 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@@H](C)c2cc(F)ccc2[O-])cs1 ZINC000273460897 334047227 /nfs/dbraw/zinc/04/72/27/334047227.db2.gz CQDIWLMCQHGBMN-VHSXEESVSA-N -1 3 310.394 3.546 20 10 DHCDHM COc1c([O-])c(CNc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000278570056 334098383 /nfs/dbraw/zinc/09/83/83/334098383.db2.gz COFCBAKFVMZOQO-UHFFFAOYSA-N -1 3 302.330 3.538 20 10 DHCDHM CC[C@H](Nc1cccc(C(=O)N(C)C)c1)c1ccc(F)cc1[O-] ZINC000286177096 334151443 /nfs/dbraw/zinc/15/14/43/334151443.db2.gz QFABJYSWEHUNPP-INIZCTEOSA-N -1 3 316.376 3.796 20 10 DHCDHM COCCCCc1cccnc1NCc1cccc(F)c1[O-] ZINC000291108981 334176636 /nfs/dbraw/zinc/17/66/36/334176636.db2.gz SMRHJCSSAAREDY-UHFFFAOYSA-N -1 3 304.365 3.508 20 10 DHCDHM C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cccc(O)c1[O-] ZINC000292663246 334190498 /nfs/dbraw/zinc/19/04/98/334190498.db2.gz LPGBXFBPPNQCQU-XJKCOSOUSA-N -1 3 311.381 3.505 20 10 DHCDHM O=C(c1cccs1)C1CCN(Cc2cccc(F)c2[O-])CC1 ZINC000374882498 336998804 /nfs/dbraw/zinc/99/88/04/336998804.db2.gz QJHBEDANTLNFRT-UHFFFAOYSA-N -1 3 319.401 3.688 20 10 DHCDHM CN(Cc1ncc(-c2cccc(F)c2)o1)Cc1ccccc1[O-] ZINC000177676300 337158409 /nfs/dbraw/zinc/15/84/09/337158409.db2.gz HCPKFJBGNKLTEB-UHFFFAOYSA-N -1 3 312.344 3.818 20 10 DHCDHM C[C@@H](NCc1nnc(-c2ccccc2)s1)c1ccccc1[O-] ZINC000183617611 337193742 /nfs/dbraw/zinc/19/37/42/337193742.db2.gz PWDXTNDOSJMQQF-GFCCVEGCSA-N -1 3 311.410 3.762 20 10 DHCDHM [O-]c1ccc(Cl)cc1CN1CCC(O)(c2ccccc2)CC1 ZINC000185637189 337249807 /nfs/dbraw/zinc/24/98/07/337249807.db2.gz VDVFILKSRLIRAK-UHFFFAOYSA-N -1 3 317.816 3.529 20 10 DHCDHM CCn1ncc2c1CCC[C@@H]2N[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000364797307 523695872 /nfs/dbraw/zinc/69/58/72/523695872.db2.gz GUTMWPIDYKCBJU-HZMBPMFUSA-N -1 3 321.371 3.615 20 10 DHCDHM [O-]c1ccccc1CN(Cc1csnn1)C1CCCCC1 ZINC000156782048 526372397 /nfs/dbraw/zinc/37/23/97/526372397.db2.gz VYYNNNNMHUCRQG-UHFFFAOYSA-N -1 3 303.431 3.579 20 10 DHCDHM CCC[N@H+](Cc1cc(C(=O)[O-])oc1CC)Cc1ccccc1[O-] ZINC000829496847 601415338 /nfs/dbraw/zinc/41/53/38/601415338.db2.gz RMYJNMCAKPPPMF-UHFFFAOYSA-N -1 3 317.385 3.658 20 10 DHCDHM CCC[N@@H+](Cc1cc(C(=O)[O-])oc1CC)Cc1ccccc1[O-] ZINC000829496847 601415339 /nfs/dbraw/zinc/41/53/39/601415339.db2.gz RMYJNMCAKPPPMF-UHFFFAOYSA-N -1 3 317.385 3.658 20 10 DHCDHM COCc1ccc([C@@H]2CCCN2Cc2cc(F)cc(F)c2[O-])o1 ZINC000894474724 1013382323 /nfs/dbraw/zinc/38/23/23/1013382323.db2.gz DZZCZIVRVZJTNF-HNNXBMFYSA-N -1 3 323.339 3.747 20 10 DHCDHM O=C(c1ccccc1[O-])N(Cc1ccco1)Cc1ccccc1O ZINC000120814198 1013514496 /nfs/dbraw/zinc/51/44/96/1013514496.db2.gz XSXVHCPPAUAGBV-UHFFFAOYSA-N -1 3 323.348 3.533 20 10 DHCDHM CC[C@@H](C)c1nnc([C@H](C)NCc2cccc(Cl)c2[O-])[nH]1 ZINC000276833269 1015695309 /nfs/dbraw/zinc/69/53/09/1015695309.db2.gz BOVQARZGLAAJLR-ZJUUUORDSA-N -1 3 308.813 3.528 20 10 DHCDHM C[C@H]([NH2+]CCCc1ccccc1F)c1cc(C(=O)[O-])ccc1[O-] ZINC001593266359 994579962 /nfs/dbraw/zinc/57/99/62/994579962.db2.gz CVCXYWYVJVOCTJ-LBPRGKRZSA-N -1 3 317.360 3.513 20 10 DHCDHM CSCc1ccccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000185069111 1016531340 /nfs/dbraw/zinc/53/13/40/1016531340.db2.gz FXUCVCDQRSZJQE-UHFFFAOYSA-N -1 3 303.383 3.522 20 10 DHCDHM CC[C@H](C)c1ccc(NC(=O)c2cc(O)c([O-])c(O)c2)cc1 ZINC001148580705 1032420958 /nfs/dbraw/zinc/42/09/58/1032420958.db2.gz KJWPLEBFTUWHIA-JTQLQIEISA-N -1 3 301.342 3.569 20 10 DHCDHM CC(C)Cn1ccc(NCc2cc3ccccc3cc2[O-])cc1=O ZINC001171407172 1032602071 /nfs/dbraw/zinc/60/20/71/1032602071.db2.gz LYSOCBQSOUSSMJ-UHFFFAOYSA-N -1 3 322.408 3.975 20 10 DHCDHM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1 ZINC000185857236 1017462498 /nfs/dbraw/zinc/46/24/98/1017462498.db2.gz BIXRWRIZXMUULU-MRXNPFEDSA-N -1 3 311.381 3.692 20 10 DHCDHM Cn1c2cccc(F)c2nc1NCc1c([O-])cccc1Cl ZINC000766106478 1018367139 /nfs/dbraw/zinc/36/71/39/1018367139.db2.gz DNKUWVIAVGMHOZ-UHFFFAOYSA-N -1 3 305.740 3.684 20 10 DHCDHM [O-]c1cccc(F)c1CN1CCSC[C@H]1c1ccccc1 ZINC001137837413 1018649940 /nfs/dbraw/zinc/64/99/40/1018649940.db2.gz FZWVIXYAKHFKTC-INIZCTEOSA-N -1 3 303.402 3.821 20 10 DHCDHM Cc1cc([N-]S(=O)(=O)c2ccc(F)cc2C)c(C)c(C)c1O ZINC000187060664 1018973071 /nfs/dbraw/zinc/97/30/71/1018973071.db2.gz YNOOLIUYCCTOAB-UHFFFAOYSA-N -1 3 323.389 3.566 20 10 DHCDHM CCc1cccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c1 ZINC000187060162 1018976156 /nfs/dbraw/zinc/97/61/56/1018976156.db2.gz QBANSZNYPAJNHI-UHFFFAOYSA-N -1 3 319.426 3.681 20 10 DHCDHM Cc1c(NC(=O)c2cccc(O)c2[O-])sc2c1CCCC2 ZINC000187126935 1019088120 /nfs/dbraw/zinc/08/81/20/1019088120.db2.gz FODZCXLFDVRPIH-UHFFFAOYSA-N -1 3 303.383 3.599 20 10 DHCDHM COCCOCc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1 ZINC000858549884 1032941420 /nfs/dbraw/zinc/94/14/20/1032941420.db2.gz FPCGPGFXOFWMES-ZDUSSCGKSA-N -1 3 319.376 3.867 20 10 DHCDHM [O-]c1cccc(Cl)c1CNc1nnc(-c2ccccn2)s1 ZINC000776265798 1021206643 /nfs/dbraw/zinc/20/66/43/1021206643.db2.gz QGENEDCRXQANRR-UHFFFAOYSA-N -1 3 318.789 3.571 20 10 DHCDHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cccc(O)c2[O-])o1 ZINC000185765517 1022521753 /nfs/dbraw/zinc/52/17/53/1022521753.db2.gz PAACDRZEZPTIIL-RISCZKNCSA-N -1 3 315.369 3.613 20 10 DHCDHM CC(C)Sc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000185850244 1022529716 /nfs/dbraw/zinc/52/97/16/1022529716.db2.gz KBAAICHKPCIJFF-UHFFFAOYSA-N -1 3 303.383 3.851 20 10 DHCDHM O=[N+]([O-])c1cccc2c1CCN(Cc1c([O-])cccc1Cl)C2 ZINC000769426536 1023146480 /nfs/dbraw/zinc/14/64/80/1023146480.db2.gz RCXAJEREIIWNSV-UHFFFAOYSA-N -1 3 318.760 3.512 20 10 DHCDHM C[C@@]1(c2ccccc2)CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000769397292 1023149811 /nfs/dbraw/zinc/14/98/11/1023149811.db2.gz CLHDDATXROBDGD-SFHVURJKSA-N -1 3 317.816 3.793 20 10 DHCDHM Cc1ccc(C(=O)N(C)c2ccc(C(C)(C)C)cc2)c([O-])c1O ZINC000770485399 1023320891 /nfs/dbraw/zinc/32/08/91/1023320891.db2.gz CBRLKFKMLIJVTH-UHFFFAOYSA-N -1 3 313.397 3.980 20 10 DHCDHM COC(=O)c1ccc([O-])c([C@H](C)Nc2ccc3ccn(C)c3c2)c1 ZINC000785569855 1023595673 /nfs/dbraw/zinc/59/56/73/1023595673.db2.gz LSVJBRPWVNNMOG-LBPRGKRZSA-N -1 3 324.380 3.844 20 10 DHCDHM C[C@@H](Nc1ccc2ccc(=O)n(C)c2c1)c1ccc(F)cc1[O-] ZINC000786942774 1023746121 /nfs/dbraw/zinc/74/61/21/1023746121.db2.gz ZDBUWWIVCIEMCN-LLVKDONJSA-N -1 3 312.344 3.556 20 10 DHCDHM CCCCOc1ncccc1CNCc1ccc(F)c(F)c1[O-] ZINC000876986257 1033197058 /nfs/dbraw/zinc/19/70/58/1033197058.db2.gz ALJYXDCYZFJAFA-UHFFFAOYSA-N -1 3 322.355 3.534 20 10 DHCDHM CCSCc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000790772977 1024373427 /nfs/dbraw/zinc/37/34/27/1024373427.db2.gz PAAQTUPPIXMZKA-UHFFFAOYSA-N -1 3 303.383 3.603 20 10 DHCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](c2ccsc2)C1 ZINC000271164667 1024464623 /nfs/dbraw/zinc/46/46/23/1024464623.db2.gz AUIIJCGSCGIBNT-OAHLLOKOSA-N -1 3 309.818 3.681 20 10 DHCDHM C[C@H]1C[C@H](c2cccnc2)N(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877341941 1033285307 /nfs/dbraw/zinc/28/53/07/1033285307.db2.gz HLWRKUSIBLDTBX-XHDPSFHLSA-N -1 3 304.340 3.649 20 10 DHCDHM C[C@H](N[C@H]1COc2ccc(Cl)cc21)c1c([O-])cccc1F ZINC000886552120 1025698867 /nfs/dbraw/zinc/69/88/67/1025698867.db2.gz UYKXQCDCOZHNLW-ZANVPECISA-N -1 3 307.752 3.969 20 10 DHCDHM CCCNC(=O)c1cccc(N[C@H](C)c2c([O-])cccc2F)c1 ZINC000886584599 1025718453 /nfs/dbraw/zinc/71/84/53/1025718453.db2.gz RVICWROWVCZUFG-GFCCVEGCSA-N -1 3 316.376 3.844 20 10 DHCDHM COCc1ccc(N[C@H](C)c2c([O-])cccc2F)cc1OC ZINC000886643035 1025757413 /nfs/dbraw/zinc/75/74/13/1025757413.db2.gz JGLJEQCYBLURRZ-LLVKDONJSA-N -1 3 305.349 3.859 20 10 DHCDHM CC[C@@H](NCc1cc[nH]n1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806138185 1025784991 /nfs/dbraw/zinc/78/49/91/1025784991.db2.gz SFGNYMVJJMLHMA-GFCCVEGCSA-N -1 3 300.189 3.663 20 10 DHCDHM C[C@H](C1CC1)N(Cc1ccccc1)C(=O)c1cccc(O)c1[O-] ZINC000188448881 1028513427 /nfs/dbraw/zinc/51/34/27/1028513427.db2.gz HJCZOJWWXVOPER-CYBMUJFWSA-N -1 3 311.381 3.539 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC[C@H]2c2nccs2)c1[O-] ZINC000370168978 1028572941 /nfs/dbraw/zinc/57/29/41/1028572941.db2.gz KJEVMUOSKBJFAY-AWEZNQCLSA-N -1 3 320.389 3.528 20 10 DHCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1cc(C)c(F)c(C)c1 ZINC000189433416 1028577860 /nfs/dbraw/zinc/57/78/60/1028577860.db2.gz OHHIKOCWHWWVMT-UHFFFAOYSA-N -1 3 323.389 3.511 20 10 DHCDHM CC[C@@H](Nc1ccc(F)c(NC(N)=O)c1)c1ccc(F)cc1[O-] ZINC000815632267 1028580257 /nfs/dbraw/zinc/58/02/57/1028580257.db2.gz IPARIIZMAAIIRO-CYBMUJFWSA-N -1 3 321.327 3.724 20 10 DHCDHM COc1ccc(N[C@H](C)c2cccc(C(F)(F)F)c2[O-])nc1 ZINC000815606922 1028582885 /nfs/dbraw/zinc/58/28/85/1028582885.db2.gz KMURWCQHQIATPW-SECBINFHSA-N -1 3 312.291 3.988 20 10 DHCDHM CC(=O)c1cc(Cl)cc(CN2CCC(F)(F)C[C@H]2C)c1[O-] ZINC000528763731 1028763520 /nfs/dbraw/zinc/76/35/20/1028763520.db2.gz BLJHJDBXOUPAGS-SECBINFHSA-N -1 3 317.763 3.868 20 10 DHCDHM CC(C)COC1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816494452 1028898073 /nfs/dbraw/zinc/89/80/73/1028898073.db2.gz MHYYJFQHWGAGAG-UHFFFAOYSA-N -1 3 315.816 3.822 20 10 DHCDHM [O-]c1cc(F)c(Cl)cc1CNCc1ccn(C2CCCC2)n1 ZINC000816557033 1028941029 /nfs/dbraw/zinc/94/10/29/1028941029.db2.gz BWUJUBYTHWYFJV-UHFFFAOYSA-N -1 3 323.799 3.786 20 10 DHCDHM C[C@H]1c2cccn2CCN1Cc1ccc(Br)cc1[O-] ZINC000824507695 1030579138 /nfs/dbraw/zinc/57/91/38/1030579138.db2.gz LVSATAOGSNLKEL-NSHDSACASA-N -1 3 321.218 3.533 20 10 DHCDHM Cc1nc([C@H]2CCCCN2Cc2cc(Cl)c(C)cc2[O-])no1 ZINC000824600642 1030590713 /nfs/dbraw/zinc/59/07/13/1030590713.db2.gz AFPQGDDVILNKGY-CQSZACIVSA-N -1 3 321.808 3.773 20 10 DHCDHM C[C@@H](NCc1nc2c(s1)CCCC2)c1cc(F)cc(F)c1[O-] ZINC000926919000 1030992882 /nfs/dbraw/zinc/99/28/82/1030992882.db2.gz LPPBEOSIGWHHDU-SECBINFHSA-N -1 3 324.396 3.857 20 10 DHCDHM Cc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)c([O-])c1O ZINC000187352007 1031161622 /nfs/dbraw/zinc/16/16/22/1031161622.db2.gz HUUMXLLJPALYRE-UHFFFAOYSA-N -1 3 307.296 3.770 20 10 DHCDHM C[C@H](NCc1ncc(Cl)s1)c1cc(F)cc(F)c1[O-] ZINC000872117031 1031511093 /nfs/dbraw/zinc/51/10/93/1031511093.db2.gz XFCFPVZDJIWVBQ-LURJTMIESA-N -1 3 304.749 3.631 20 10 DHCDHM Cc1nccnc1[C@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000873187981 1031747492 /nfs/dbraw/zinc/74/74/92/1031747492.db2.gz DUVMPHQHHKSNSU-VIFPVBQESA-N -1 3 312.200 3.648 20 10 DHCDHM [O-]c1c(Cl)cccc1CN1CCC2(CC1)C(F)(F)C2(F)F ZINC000846013826 1031809019 /nfs/dbraw/zinc/80/90/19/1031809019.db2.gz CPSTZDRWHGSILY-UHFFFAOYSA-N -1 3 323.717 3.912 20 10 DHCDHM CSCc1cnc(CNCc2cc(Cl)ccc2[O-])s1 ZINC000846055892 1031847351 /nfs/dbraw/zinc/84/73/51/1031847351.db2.gz ROLRERTUTJOYRX-UHFFFAOYSA-N -1 3 314.863 3.655 20 10 DHCDHM C[C@@]12CCN(Cc3ccc(F)c(F)c3[O-])C[C@@H]1C2(Cl)Cl ZINC000877506726 1033327694 /nfs/dbraw/zinc/32/76/94/1033327694.db2.gz CPIKXRBBLBKJLR-GXFFZTMASA-N -1 3 322.182 3.686 20 10 DHCDHM Cc1occc1CN(C)Cc1c([O-])cccc1Br ZINC000862231340 1033791202 /nfs/dbraw/zinc/79/12/02/1033791202.db2.gz GLWAEIYETKVLDO-UHFFFAOYSA-N -1 3 310.191 3.688 20 10 DHCDHM C[C@@H](Nc1ccc(O[C@H]2CCOC2)cc1)c1ccc(F)cc1[O-] ZINC000186320843 1034617641 /nfs/dbraw/zinc/61/76/41/1034617641.db2.gz VSJBPTJLLSSDQG-WBMJQRKESA-N -1 3 317.360 3.872 20 10 DHCDHM C[C@@H](Nc1ccc2c(c1)N(C)CCO2)c1ccc(F)cc1[O-] ZINC000186458363 1034632038 /nfs/dbraw/zinc/63/20/38/1034632038.db2.gz NAPPTIPZTZSDMB-LLVKDONJSA-N -1 3 302.349 3.533 20 10 DHCDHM CCc1noc(CC)c1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000187753791 1034728620 /nfs/dbraw/zinc/72/86/20/1034728620.db2.gz MGNSPNWOWPNAOZ-VIFPVBQESA-N -1 3 310.344 3.634 20 10 DHCDHM CC[C@@H](C)[C@@H](C(=O)NCc1c([O-])cccc1F)c1ccccc1 ZINC001178412686 1035428765 /nfs/dbraw/zinc/42/87/65/1035428765.db2.gz FCZPKXSBLVWKLI-FZKQIMNGSA-N -1 3 315.388 3.977 20 10 DHCDHM Cc1ccc(C(=O)N2c3ccc(Cl)cc3C[C@H]2C)c([O-])c1O ZINC001181546612 1035940479 /nfs/dbraw/zinc/94/04/79/1035940479.db2.gz FTNVCOSYHOBIKJ-SNVBAGLBSA-N -1 3 317.772 3.651 20 10 DHCDHM COc1c([O-])c(CNc2cc(Cl)ccc2C)ccc1[N+](=O)[O-] ZINC000774914211 1037213144 /nfs/dbraw/zinc/21/31/44/1037213144.db2.gz MGTLAYGRXISGKD-UHFFFAOYSA-N -1 3 322.748 3.883 20 10 DHCDHM CO[C@@H]1Cc2ccc(N[C@H](C)c3ccc(F)cc3[O-])cc2C1 ZINC000760879067 1038969386 /nfs/dbraw/zinc/96/93/86/1038969386.db2.gz CZFMJPVLLXZHBW-BDJLRTHQSA-N -1 3 301.361 3.818 20 10 DHCDHM CC(=O)c1cc(F)cc(CN2CCC[C@H](C(F)(F)F)C2)c1[O-] ZINC000173011085 1040133792 /nfs/dbraw/zinc/13/37/92/1040133792.db2.gz OXEQLPPVIUZTCG-NSHDSACASA-N -1 3 319.298 3.508 20 10 DHCDHM C[C@@H](N[C@H](C)c1cccc(F)c1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273484298 130125730 /nfs/dbraw/zinc/12/57/30/130125730.db2.gz MVZNSSZFERVTHP-NXEZZACHSA-N -1 3 322.311 3.990 20 10 DHCDHM CCc1nn(C)cc1N[C@@H](C)c1ccc(Br)cc1[O-] ZINC000273503995 130129787 /nfs/dbraw/zinc/12/97/87/130129787.db2.gz QSRKAWKWMYOBBC-VIFPVBQESA-N -1 3 324.222 3.624 20 10 DHCDHM C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1[O-] ZINC000273533388 130134068 /nfs/dbraw/zinc/13/40/68/130134068.db2.gz WVRSSGFZYVQJJB-QWRGUYRKSA-N -1 3 304.321 3.851 20 10 DHCDHM Cc1cc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2[O-])n(C)n1 ZINC000284385492 131076098 /nfs/dbraw/zinc/07/60/98/131076098.db2.gz OYISLDYCXUQTOX-VIFPVBQESA-N -1 3 314.216 3.592 20 10 DHCDHM CC[C@H](NCc1cnn(C)c1)c1cc(Cl)cc(Cl)c1[O-] ZINC000287601456 131290370 /nfs/dbraw/zinc/29/03/70/131290370.db2.gz IQMPDBZXSPKLIG-ZDUSSCGKSA-N -1 3 314.216 3.673 20 10 DHCDHM Cc1c(N[C@@H](C)c2ccc(F)cc2[O-])cnn1C1CCOCC1 ZINC000297361592 132012262 /nfs/dbraw/zinc/01/22/62/132012262.db2.gz PUFRWBFFFXDZBT-NSHDSACASA-N -1 3 319.380 3.561 20 10 DHCDHM COc1ccc([C@H](C)NCc2cccc(Cl)c2[O-])c(OC)c1 ZINC000378894929 333061002 /nfs/dbraw/zinc/06/10/02/333061002.db2.gz AAXCSWMPLYLYOM-NSHDSACASA-N -1 3 321.804 3.914 20 10 DHCDHM Cc1ccc([C@H](C)N[C@H]2COc3cc(F)cc(F)c32)c([O-])c1 ZINC000368212361 336840302 /nfs/dbraw/zinc/84/03/02/336840302.db2.gz NAIQTOMNGVFCIQ-HZMBPMFUSA-N -1 3 305.324 3.763 20 10 DHCDHM Cc1ccc([C@H](C)N[C@@H]2COc3cc(F)cc(F)c32)c([O-])c1 ZINC000368212362 336840306 /nfs/dbraw/zinc/84/03/06/336840306.db2.gz NAIQTOMNGVFCIQ-IINYFYTJSA-N -1 3 305.324 3.763 20 10 DHCDHM Cc1nn(C)cc1[C@@H]1CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000377198156 337048564 /nfs/dbraw/zinc/04/85/64/337048564.db2.gz OASCANNFKIORAR-AWEZNQCLSA-N -1 3 323.799 3.564 20 10 DHCDHM CC(C)[C@]1(CO)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000378129950 337066918 /nfs/dbraw/zinc/06/69/18/337066918.db2.gz MTNONHWAVDTNCB-OAHLLOKOSA-N -1 3 318.244 3.539 20 10 DHCDHM CC[C@@H](N[C@@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1[O-] ZINC000183339148 337191415 /nfs/dbraw/zinc/19/14/15/337191415.db2.gz DLODATFYCJUOHX-WMLDXEAASA-N -1 3 322.412 3.775 20 10 DHCDHM CCc1ccc([C@@H](COC)N[C@H](CC)c2ccccc2[O-])o1 ZINC000156014317 524032076 /nfs/dbraw/zinc/03/20/76/524032076.db2.gz ABXHBMIVYCPLFL-HZPDHXFCSA-N -1 3 303.402 3.976 20 10 DHCDHM C[C@H]1N(Cc2c([O-])ccc(Cl)c2F)CCC12CCOCC2 ZINC000364780831 525004233 /nfs/dbraw/zinc/00/42/33/525004233.db2.gz XFXBLFRYSAXMMC-LLVKDONJSA-N -1 3 313.800 3.576 20 10 DHCDHM COc1cccc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])c1OC ZINC000191210622 526032924 /nfs/dbraw/zinc/03/29/24/526032924.db2.gz IFTUEVAGCDMJBH-JTQLQIEISA-N -1 3 323.339 3.538 20 10 DHCDHM Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2)c([O-])c1O ZINC000267544019 526100713 /nfs/dbraw/zinc/10/07/13/526100713.db2.gz BCLYXPYSSPPATQ-OAHLLOKOSA-N -1 3 315.344 3.523 20 10 DHCDHM [O-]c1cccc(Cl)c1CN[C@@H]1CCOc2ccc(F)cc21 ZINC000264987438 526365101 /nfs/dbraw/zinc/36/51/01/526365101.db2.gz WGDDETWOYRQMRJ-CQSZACIVSA-N -1 3 307.752 3.798 20 10 DHCDHM Cc1nc(CN[C@@H](C)c2cc(Cl)ccc2[O-])c2n1CCCC2 ZINC000364910317 526890941 /nfs/dbraw/zinc/89/09/41/526890941.db2.gz YZQDNRHZSUEBOU-NSHDSACASA-N -1 3 319.836 3.738 20 10 DHCDHM CO[C@H](C)c1nc(CN[C@H](C)c2ccc(F)cc2[O-])cs1 ZINC000273551091 536514902 /nfs/dbraw/zinc/51/49/02/536514902.db2.gz FWIBANWYPFIFEA-NXEZZACHSA-N -1 3 310.394 3.546 20 10 DHCDHM CC[C@@H](NCc1cccc(OC)c1OC)c1ccc(F)cc1[O-] ZINC000285989054 535806223 /nfs/dbraw/zinc/80/62/23/535806223.db2.gz IAELLDKUYKPZOO-OAHLLOKOSA-N -1 3 319.376 3.789 20 10 DHCDHM CC[C@H](N[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1[O-] ZINC000287308102 535936360 /nfs/dbraw/zinc/93/63/60/535936360.db2.gz CUQDWZDCDKHYJV-UONOGXRCSA-N -1 3 305.809 3.887 20 10 DHCDHM CC[C@H](N[C@H](C)c1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000272864198 535943273 /nfs/dbraw/zinc/94/32/73/535943273.db2.gz NKPJJLPQIUBTFD-HIFRSBDPSA-N -1 3 314.433 3.512 20 10 DHCDHM